Time stamp: Sun Jul 12 17:28:18 2020 ^

Comparison of Structures of Solids Predicted using PM7 and PM6-D3H4 with X-Ray

(Periodic Table - Home - PM7 and PM6-D3H4 Accuracy - Manual)

      Comparison of Densities in order of error in PM7

    Ref     PM7   PM6-D3H4   PM7%err   PM6-D3H4%err      Data-set name
   3.279   6.742   2.576     105.611     -21.439       Arsenic(iii) fluoride (AsF3)
   1.906   3.833   4.088     101.102     114.481       Cesium (Cs) (ICSD 626969)
   0.534   1.049   0.000      96.442    -100.000       Lithium (Li) (ICSD 77370)
   5.007   9.489   9.272      89.515      85.181       Rubidium hexafluorobismuthate (RbBiF6) (ICSD 15121)
   5.770  10.802   6.968      87.210      20.763       Tin (cubic) (Sn) (ICSD 76040)
   2.851   5.276   3.009      85.058       5.542       Vanadium(V) pentafluoride (VF5)
   1.076   1.889   1.471      75.558      36.710       bis(15-Crown-5-sodium) bis(tetraselenido)-cadmium (SANBEO)
   4.374   7.646   6.680      74.806      52.721       Tellurium(iv) tetrafluoride (TeF4) (ICSD 85452)
   4.697   8.056   4.932      71.514       5.003       Indium trifluoride (InF3) (ICSD 38306)
   3.285   5.529   3.200      68.311      -2.588       Vanadium (iv) tetrafluoride (VF4) (ICSD 65785)
   2.513   4.201   1.987      67.171     -20.931       Germanium chloride (Ge3Cl8) (ICSD 86673)
   6.166  10.184  10.167      65.164      64.888       Lanthanum (La) (ICSD 641382) hcp
   2.494   4.078   2.195      63.512     -11.989       Gallium trichloride (GaCl3) (ICSD 413455)
   3.039   4.957   5.719      63.113      88.187       Fe(iii)PO4
   2.822   4.579   3.906      62.261      38.412       Chromium(vi) oxide (CrO3) (ICSD 16031)
   4.004   6.410   2.361      60.090     -41.034       Manganese(ii) difluoride (MnF2)
   3.931   6.279   5.065      59.730      28.848       Chromium(iii) trifluoride (CrF3)
   4.855   7.745   3.457      59.526     -28.795       Thallium(i) tetrachlorothallate(iii) (Tl2Cl4) (ICSD 4031)
   6.678  10.538   2.574      57.802     -61.456       Tin (Sn) (ICSD 652713)
   2.540   3.968   2.745      56.220       8.071       Beryllium catena-phosphate (BeP2O6) (ICSD 100404)
   4.996   7.739   3.964      54.904     -20.657       Rhenium(vii) heptafluoride (ReF7) (ICSD 78311)
   6.725  10.411   5.324      54.810     -20.833       Nickel oxide (NiO) (ICSD 76669)
   2.629   4.060   4.004      54.431      52.301       Siderite (FeCO3)
   2.576   3.975   3.693      54.309      43.362       Manganese(ii) tetraphosphate (MnP4O11) (ICSD 4282)
   3.917   6.001   3.391      53.204     -13.429       Tellurium(vi) hexafluoride (TeF6) (ICSD 67609)
   3.862   5.872   8.692      52.046     125.065       Iron(iii) trifluoride (FeF3)
   3.950   5.944   2.054      50.481     -48.000       Tungsten oxide tetrachloride (WOCl4) (ICSD 25519)
   2.527   3.800   2.742      50.376       8.508       Sodium hexafluorophosphate (NaPF6) (ICSD 1408764)
   3.844   5.745   5.660      49.454      47.242       Chromium(ii) difluoride (CrF2) (ICSD 31827)
   3.871   5.765   3.429      48.928     -11.418       Cubic arsenic(iii) oxide (As2O3)
   1.394   2.075   1.968      48.852      41.176       Ice-7
   2.373   3.525   2.444      48.546       2.992       Beryllium difluoride (BeF2)
   1.790   2.654   0.663      48.268     -62.961       Silicon(ii) chloride (SiCl2)
   3.059   4.508   2.569      47.368     -16.018       Tellurium(iv) tetrachloride (TeCl4) (ICSD 411157)
   0.669   0.983   0.875      46.936      30.792       Neopentane (ZZWGY01)
   2.174   3.183   2.005      46.412      -7.774       tetrakis(Trifluoromethyl)diphosphane (HIRCEQ)
   4.882   7.142   3.854      46.293     -21.057       Tin(ii) fluoride (SnF2)
   2.952   4.286   3.907      45.190      32.351       Chromium(ii) dichloride (CrCl2) (ICSD 15468)
   7.928  11.474   8.362      44.728       5.474       Bismuth trifluoride (BiF3) (ICSD 9015)
   2.610   3.755   2.149      43.870     -17.663       Arsenic(iii) chloride (AsCl3)
   1.547   2.225   2.171      43.827      40.336       Beryllium dichloride tetrahydrate (BeCl2 4(H2O)) ICSD 417642)
   4.967   7.124   4.401      43.427     -11.395       Tin(iv) tetrafluoride (SnF4) (ICSD 78894)
   3.302   4.723   4.624      43.035      40.036       Krypton difluoride (KrF2) (ICSD 23534)
   1.839   2.629   2.033      42.958      10.549       beta-Alaninium tetrachloro-iron(iii) (BALACF)
   1.590   2.256   2.307      41.887      45.094       Magnesium dichloride hexahydrate (MgCl2 6(H2O)) (ICSD 47161)
   1.910   2.709   1.717      41.832     -10.105       Beryllium dichloride (BeCl2)
   2.640   3.738   2.571      41.591      -2.614       LiF
   2.705   3.829   4.354      41.553      60.961       Phosphorus(v) pentoxide (P2O5) (ICSD 82688)
   4.976   7.034   2.412      41.359     -51.527       Rhenium(vi) hexafluoride (ReF6) (ICSD 1211852)
   8.481  11.939  12.587      40.773      48.414       Lead(ii) fluoride (PbF2)
   3.447   4.852   3.447      40.760       0.000       Manganese(ii) sulfate (MnSO4) (ICSD 31231)
   2.096   2.949   3.228      40.697      54.008       Oxonium perchlorate (H3O(+) ClO4(-)) (ICSD 23866)
   6.214   8.703   5.276      40.055     -15.095       Rhenium(vii) oxide (Re2O7) (ICSD 15217)
   3.595   5.002   0.035      39.138     -99.026       Technetium(vi) hexafluoride (TcF6) (ICSD 1211848)
   6.338   8.790   6.216      38.687      -1.925       Palladium(ii) fluoride (PdF2)
   1.753   2.422   1.886      38.163       7.587       catena-hexakis(mu-2-Chloro)-(h6-benzene)-dichloro-aluminium-tin benzene solvate (BENZSN10)
   3.516   4.837   0.000      37.571    -100.000       Molybdenum(vi) hexafluoride (MoF6) (ICSD 36219)
   4.351   5.974   8.102      37.302      86.210       Potassium hexafluorobismuthate (KBiF6) (ICSD 25024)
   4.491   6.161   4.118      37.185      -8.305       Gallium trifluoride (GaF3) (ICSD 22197)
   3.012   4.131   3.593      37.151      19.290       Lutetium(iii) perchlorate trihydrate (Lu[ClO4]3[H2O]3)
   5.169   7.086   5.498      37.086       6.365       Lutetium(iii) tribromide (LuBr3)
   1.857   2.544   2.364      36.995      27.302       Perchloric acid trihydrate (HClO4 (H2O)3) (ICSD 27248)
   4.390   5.974   8.188      36.082      86.515       Sodium hexafluorobismuthate (NaBiF6) (ICSD 15120)
   4.061   5.524   0.000      36.026    -100.000       Cobalt chromate (CoCrO4) (ICSD 23492)
   3.437   4.675   2.909      36.020     -15.362       Lithium hexafluoroarsenate (LiAsF6) (ICSD 74831)
   2.488   3.382   2.034      35.932     -18.248       Aluminum trichloride (AlCl3)
   3.700   5.007   1.608      35.324     -56.541       Rhodochrosite (MnCO3)
   4.276   5.785   4.127      35.290      -3.485       Strontium fluoride (SrF2)
   3.889   5.261   5.692      35.279      46.362       Hafnium(iv) tetrachloride (HfCl4)
   1.625   2.195   1.844      35.077      13.477       Nitric acid trihydrate (HNO3 (H2O)3) (ICSD 1902)
   2.569   3.468   2.899      34.994      12.845       Vaterite (CaCO3)
   2.187   2.942   1.769      34.522     -19.113       Phosphorus pentachloride (PCl5)
   3.985   5.355   5.245      34.379      31.619       Lithium yttrium(iii) tetrafluoride (LiYF4) (ICSD 73709)
   2.187   2.937   2.114      34.294      -3.338       Hydrophilite(CaCl2)
   2.923   3.923   3.262      34.211      11.598       Iron(iii) trichloride (FeCl3)
   2.982   4.001   3.042      34.172       2.012       Zinc dichloride (ZnCl2) (ICSD 2459)
   3.619   4.848   1.361      33.960     -62.393       Tungsten(vi) hexachloride (WCl6) (ICSD 2365)
   3.952   5.286   3.656      33.755      -7.490       Vanadium(ii) difluoride (VF2)
   1.922   2.570   2.002      33.715       4.162       bis(Guanidinium) tetrachloro-palladium(ii) (DILJEN)
   1.313   1.755   1.726      33.663      31.455       Hydrogen chloride hexahydrate (H9O4(+) Cl(-) 2(H2O)) (ICSD 2235)
   2.527   3.370   2.228      33.360     -11.832       Phosphorus pentafluoride (PF5)
   1.757   2.343   1.962      33.352      11.668       Ferricinium tetrachloro-iron(iii) (FERRIC)
   2.638   3.517   2.202      33.321     -16.528       Antimony(v) pentachloride (SbCl5) (ICSD 250363)
   4.288   5.695   0.000      32.812    -100.000       MnO(OH)
   1.846   2.451   0.761      32.774     -58.776       Beryllium (Be) hcp (ICSD 600013)
   3.351   4.447   5.925      32.707      76.813       Barium chlorate (Ba(ClO3)2) (ICSD 40285)
   1.989   2.639   2.521      32.680      26.747       1,4-Dioxane dichloro-germanium (DIOXGC03)
   3.269   4.337   4.164      32.671      27.378       Phosphoric tribromide (POBr3) (ICSD 1100034)
   2.146   2.846   2.109      32.619      -1.724       Guanidinium hydrogenselenate (HESNAV01)
   5.442   7.204   2.473      32.378     -54.557       Mercury dichloride (HgCl2)
   2.831   3.742   2.563      32.179      -9.467       Diammonium bis((mu-2-carbonyl)-dichloro-palladium(i)) (LUPHOT)
   4.809   6.342   4.849      31.878       0.832       Manganese(iv) dioxide (MnO2) (ICSD 171866)
   1.614   2.126   1.519      31.722      -5.886       Sodium acetylide (Na2C2) (ICSD 28066)
   3.411   4.493   5.070      31.721      48.637       Boron tribromide (BBr3) (ICSD 24727)
   3.776   4.968   3.753      31.568      -0.609       Manganese phosphate (Mn3(PO4)2) (ICSD 1322074)
   1.856   2.433   1.502      31.088     -19.073       Boron trichloride (BCl3) (ICSD 27869)
   5.590   7.313   0.642      30.823     -88.515       Silver(i) chloride (AgCl)
   1.374   1.797   1.611      30.786      17.249       Ice-6
   1.524   1.993   1.571      30.774       3.084       Tetramethylammonium tetrachloro-iron(iii) (DIRKEU01)
   1.778   2.324   1.527      30.709     -14.117       Boron chloride (B8Cl8) (ICSD 43258)
   3.749   4.900   2.791      30.702     -25.553       Manganese(ii) metasilicate (MnSiO3) (ICSD 34343)
   3.203   4.181   5.203      30.534      62.441       Iron(ii) dichloride (FeCl2) (ICSD 44397)
   2.709   3.536   2.883      30.528       6.423       Calcite (CaCO3) (ICSD 52151)
   4.075   5.316   3.745      30.454      -8.098       Cadmium chloride (CdCl2)
   3.108   4.053   3.146      30.405       1.223       Strontium chloride (SrCl2)
   1.747   2.278   1.396      30.395     -20.092       Titanium(iii) perchlorate-hexa-urea complex (TIUERA)
   2.377   3.099   2.410      30.374       1.388       mu-2-Pyrazine-N,N')-decakis(ammine)-di-osmium(iii) hexachloride dihydrate (DOBGEG)
   1.227   1.599   1.422      30.318      15.892       (Cyclopentadienyl)-chloro-beryllium (JEFKIO)
   1.635   2.130   1.519      30.275      -7.095       bis(Urea) oxalic acid (UROXAL01)
   4.817   6.274   4.716      30.247      -2.097       Nickel(ii) fluoride (NiF2)
   2.940   3.828   5.330      30.204      81.293       Titanium(iv) fluoride (TiF4)
   3.163   4.113   2.099      30.035     -33.639       Selenium(iv) tetrafluoride (SeF4) (ICSD 85451)
   1.696   2.205   1.695      30.012      -0.059       Sodium cyanide (NaCN) (ICSD 77172)
   3.812   4.953   3.247      29.932     -14.822       Lead(iv) tetrachloride (PbCl4) (ICSD 280975)
   7.464   9.698   4.565      29.930     -38.840       Thallium(i) bromide (TlBr) (ICSD 541941)
   7.107   9.234   6.866      29.928      -3.391       Hafnium(iv) tetrafluoride (HfF4)
   2.027   2.633   1.359      29.896     -32.955       Chlorine (Cl2) (ICSD 24653)
   7.293   9.471   3.427      29.864     -53.010       Indium (In) (ICSD 1711679)
   2.699   3.504   1.773      29.826     -34.309       Aluminum (Al) (ICSD 64700)
   3.921   5.089   5.501      29.788      40.296       Gallium tribromide (GaBr3) (ICSD 413456)
   1.587   2.059   1.765      29.742      11.216       Tetramethylammonium trichloro-germanium(ii) (TMACGE20)
   3.921   5.080   5.072      29.559      29.355       Tin(iv) tetrabromide (SnBr4) (ICSD 51570)
   1.814   2.349   1.711      29.493      -5.678       o-Tetrachlorodicyanobenzene (BAWMUH01)
   3.324   4.304   5.682      29.483      70.939       Titanium(iv) bromide (TiBr4)
   2.003   2.591   2.138      29.356       6.740       bis(Imidazolium) tetrachloro-palladium(ii) (RORVOJ)
   1.874   2.424   2.280      29.349      21.665       catena-((mu-3-L-alanine-O,O,O',O')-chloro-triaqua-strontium chloride) (BOPYOV)
   1.641   2.122   1.992      29.311      21.389       Monochloroacetic acid (CLACET02)
   1.606   2.076   1.933      29.265      20.361       Potassium acetylide (K2C2) (ICSD 89528)
   1.936   2.499   2.186      29.081      12.913       Weddellite (Ca(C2O4) 2(H2O))
   7.044   9.089   4.074      29.032     -42.164       Thallium chloride (TlCl)
   6.485   8.364   0.316      28.975     -95.127       Silver(i) bromide (AgBr)
   1.702   2.193   1.771      28.848       4.054       Hexacarbonyl-vanadium (FONGUK)
   1.520   1.957   1.963      28.750      29.145       Hydrogen chloride dihydrate (ICSD 15353)
   1.918   2.468   1.936      28.676       0.938       Chloral hydrate (CHORLH01)
   1.832   2.357   1.772      28.657      -3.275       tris(Guanidinium) hexachloro-rhodium(iii) monohydrate (NAMLES)
   3.162   4.068   3.832      28.653      21.189       Calcium chromate (CaCrO4) (ICSD 83387)
   1.305   1.678   1.514      28.582      16.015       hexakis(Acetonitrile)-vanadium(ii) tetrachloro-zinc (CUPYER)
   1.908   2.450   2.164      28.407      13.417       Nitrocalcite (Ca(NO3)2 4(H2O))
   2.219   2.848   2.451      28.346      10.455       Whewellite (Ca(Ox)(H2O)) (CALOXM03)
   2.406   3.086   1.717      28.263     -28.637       Scandium(iii) trichloride (ScCl3)
   4.123   5.285   6.010      28.183      45.768       BaCaAlF7
   1.370   1.756   1.497      28.175       9.270       bis(Acetonitrile) beryllium chloride (MECYBC)
   2.163   2.771   2.307      28.109       6.657       Lithium tetrafluoroberyllate (Li2BeF4) (ICSD 37163)
   8.747  11.205   7.478      28.101     -14.508       Thallium(iii) trifluoride (TlF3) (ICSD 10365)
   1.870   2.392   2.054      27.914       9.840       Caoxite (Ca(C2O4) 3(H2O))
   1.878   2.400   2.219      27.796      18.158       tetrakis(Methylammonium) hexachloro-lutetium(iii) chloride (VESYAU)
   2.196   2.803   2.327      27.641       5.965       bis((mu-2-Chloro)-trans-chloro-methyl-gallium) (ICOHIR)
   2.013   2.567   2.198      27.521       9.190       Calcium formate (CAFORM12)
   3.491   4.445   4.640      27.327      32.913       Beryllium dibromide (BeBr2)
   3.595   4.575   4.396      27.260      22.281       Phosphorus(v) pentabromide (PBr5) (ICSD 22140)
   4.219   5.368   4.524      27.234       7.229       Germanium(ii) bromide (GeBr2)
   1.829   2.326   1.825      27.173      -0.219       Oxonium nitrate (H3O NO3) (ICSD 1900)
   3.773   4.796   0.000      27.114    -100.000       Cobalt(ii) hydroxide (Co(OH)2)) (ICSD 88940)
   2.493   3.165   3.303      26.955      32.491       Calcium dinitrate (Ca(NO3)2) (ICSD 1500652)
   4.043   5.131   4.394      26.911       8.682       Yttrium(iii) trifluoride (YF3) (ICSD 15961)
   5.016   6.365   5.525      26.894      10.148       Manganese(ii) diiodide (MnI2)
   1.837   2.330   2.058      26.837      12.030       XVII 1,2-Dichloro-4,5-dinitrobenzene
   1.371   1.738   1.363      26.769      -0.584       Urea (UREAXX13)
   4.127   5.231   3.088      26.751     -25.176       Manganese(ii) orthosilicate (Mn2SiO4) (ICSD 26376)
   2.791   3.530   0.198      26.478     -92.906       Niobium(v) pentachloride (NbCl5) (ICSD 300102)
   2.001   2.530   1.704      26.437     -14.843       Tetrachloro-p-benzoquinone (TCBENQ07)
   3.216   4.066   4.185      26.430      30.131       Silicon(ii) bromide (SiBr2)
   1.849   2.337   2.301      26.393      24.446       Ho Complex Sparkle (XEWVIE)
   1.631   2.061   1.640      26.364       0.552       Fumaric acid (FUMAAC)
   3.277   4.139   4.920      26.305      50.137       Aluminum tribromide (AlBr3)
   4.248   5.364   6.372      26.271      50.000       Usovite (Ba2CaMgAlF14)
   1.860   2.348   1.933      26.237       3.925       Tetrachlorophthalic acid hemihydrate (TCLPHA)
   1.496   1.888   1.726      26.203      15.374       tris(Trimethylammonium) tetrachloro-palladium chloride (BIJNIR)
   1.982   2.496   2.353      25.933      18.718       Octahydroxycyclobutane (HOCBUT)
   1.544   1.943   1.569      25.842       1.619       Ammonium chloride (NH4Cl)
   4.153   5.221   4.160      25.716       0.169       Strontium chlorapatite (Sr5(PO4)3Cl) (ICSD 1404651)
   2.852   3.585   2.680      25.701      -6.031       Molybdenum(V) chloride (MoCl5)
   3.169   3.980   4.209      25.592      32.818       Sellaite (MgF2)
   2.974   3.734   8.745      25.555     194.048       Cobalt(ii) dinitrate (Co(NO3)2) (ICSD 412004)
   1.808   2.270   1.818      25.553       0.553       5-Nitrouracil monohydrate
   1.384   1.733   1.617      25.217      16.835       Basic beryllium acetate (Be4O(OOCCH3)6) (BEOACT)
   2.408   3.015   1.912      25.208     -20.598       Chloromagnesite (MgCl2)
   2.141   2.680   1.679      25.175     -21.579       tris(Tetrachlorocatecholato-O,O')-rhenium(vi) anisole solvate (FEGFUS)
   3.922   4.906   1.602      25.089     -59.153       Platinum(iv) tetrachloride (PtCl4) (ICSD 22073)
   1.769   2.212   1.921      25.042       8.592       Mascagnite ((NH4)2SO4)
   1.839   2.297   1.939      24.905       5.438       bis(Trifluoromethanesulfonate) hexa-aqua-vanadium(ii) (VEPSUE)
   1.915   2.390   1.851      24.804      -3.342       Ammonium chromate ((NH4)2CrO4) (ICSD 1501451)
   1.795   2.240   1.926      24.791       7.298       bis(Tetramethylammonium) hexachloro-platinum(iv) (TMAMPC)
   4.730   5.902   0.000      24.778    -100.000       Potassium hexafluoroiridate(iv) (K2IrF6) (ICSD 95779)
   1.551   1.935   1.817      24.758      17.150       Calcium acetate chloride pentahydrate (CALCLA)
   2.126   2.652   2.023      24.741      -4.845       bis(Dimethyl(phenyl)telluronium) hexachlorotellurate (CIFVET)
   2.903   3.621   3.623      24.733      24.802       Potassium hexafluorophosphate (KPF6) (ICSD 1616491)
   2.859   3.564   3.084      24.659       7.870       Dolomite (CaMg(CO3)2)
   3.626   4.519   2.288      24.628     -36.900       Cadmium dinitrate (Cd(NO3)2) (ICSD 297)
   1.645   2.048   1.854      24.498      12.705       Aqua-chloro-(15-crown-5)-iron(ii) oxonium tetrachloro-iron(ii) monohydrate (XEQGUV)
   2.430   3.025   3.571      24.486      46.955       Ammonium bromide (NH4Br) (ICSD 43300)
   1.892   2.355   2.195      24.471      16.015       18-Crown-6-dichloro-lead(ii) (NOMJUV)
   3.407   4.239   2.674      24.420     -21.515       Strontium hydroxide(Sr(OH)2) (ICSD 1415801)
   2.838   3.531   2.243      24.419     -20.965       Lithium hexafluorophosphate (LiPF6) (ICSD 74830)
   1.837   2.285   1.661      24.388      -9.581       4,4'-Bipyridinedi-ium bis(chloro-trioxo-chromium(vi)) (HIHFOT)
   3.408   4.235   0.000      24.266    -100.000       Cobalt(ii) chloride (CoCl2)
   6.424   7.979   0.000      24.206    -100.000       Cobalt oxide (CoO) (ICSD 9865)
   3.638   4.518   3.914      24.189       7.587       Strontium bromide (SrBr2)
   1.769   2.196   2.174      24.138      22.894       Ammonium sulfate (2(NH4)SO4)
   4.479   5.557   6.970      24.068      55.615       Trisodium octafluorotantalate (Na3TaF8) (ICSD 26611)
   3.204   3.974   2.866      24.032     -10.549       Fluorite (CaF2)
   1.723   2.137   1.467      24.028     -14.858       B4Cl4 (ICSD 27872)
   1.024   1.270   0.966      24.023      -5.664       Dodecanoic acid (LAURAC05)
   1.585   1.964   1.578      23.912      -0.442       beta Glycine
   1.566   1.940   1.716      23.883       9.579       Succinic acid (SUCACB11)
   1.493   1.849   1.301      23.845     -12.860       D,L-tris(Ethylenediamine)-cobalt(iii) trichloride trihydrate (COTENC01)
   1.900   2.352   2.137      23.789      12.474       bis(Glycine) strontium dichloride trihydrate (GLYSRC10)
   1.629   2.014   2.102      23.634      29.036       Rubidium (Rb) (ICSD 650018)
   1.783   2.204   2.069      23.612      16.040       Tetra-azacyclotetradecane-palladium(ii) diperchlorate (BUXSIW10)
   1.999   2.470   2.252      23.562      12.656       catena-((mu-6-D,L-Homocysteic acid)-aqua-strontium chloride) (NARZEM)
   2.004   2.476   2.057      23.553       2.645       catena-(tris(mu-2-Formato-O,O')-scandium) (SCFORM11)
   2.149   2.653   1.695      23.453     -21.126       Hexachlorobenzene (HCLBNZ13)
   1.600   1.975   1.598      23.438      -0.125       Carnallite (KMg(H2O)6Cl3)
   2.741   3.380   2.707      23.313      -1.240       Strontium formate (SrC2H2O4) (ICSD 249198)
   4.751   5.858   4.131      23.300     -13.050       Bismuth trichloride (BiCl3) (ICSD 1250429)
   4.696   5.790   2.989      23.296     -36.350       Thallium(iii) trichloride (TlCl3) (ICSD 1300751)
   2.580   3.181   2.265      23.295     -12.209       Sodium phosphate (NaPO3) (ICSD 34693)
   1.871   2.305   2.067      23.196      10.476       Dioxane-seleninyl-dichloride (DOXSEC)
   4.599   5.665   1.197      23.179     -73.973       Rhenium(iv) tetrachloride (ReCl4) (ICSD 1301314)
   2.983   3.673   2.888      23.131      -3.185       Strontium nitrate (Sr(NO3)2) (ICSD 35494)
   4.433   5.448   2.896      22.896     -34.672       Tin(ii) chloride (SnCl2)
   3.841   4.719   5.430      22.859      41.369       Potassium hexafluorostannate (K2SnF6) (ICSD 376982)
   2.018   2.477   2.100      22.745       4.063       Potassium octapyridinium tris(hexachlorobismuthate(iii)) (BIPGAJ)
   1.723   2.114   1.907      22.693      10.679       catena-((mu-2-Galactitol)-tetra-aqua-strontium dichloride) (AKOSAU)
   1.785   2.189   2.017      22.633      12.997       4,4'-Bipyridinium tetrachloro-zinc (CIQXAB)
   1.585   1.943   1.723      22.587       8.707       tetrakis(Dimethylammonium) hexachloro-ruthenium(iii) chloride (ENIDAG)
   3.844   4.708   3.449      22.477     -10.276       Strontianite (SrCO3)
   3.987   4.882   4.603      22.448      15.450       Nickel(ii) sulfate (NiSO4) (ICSD 33737)
   5.577   6.823   4.774      22.342     -14.398       Thallium(i) tetrabromothallate(iii) (Tl2Br4) (ICSD 14216)
   2.047   2.502   2.501      22.228      22.179       Ammonium perchlorate (NH4ClO4) (ICSD 40382)
   1.918   2.343   2.019      22.158       5.266       Iron(ii) sulfate heptahydrate (FeSO4 7(H2O)) (ICSD 1120081)
   1.417   1.730   1.263      22.089     -10.868       tris(Guanidinium) pyrofluoroberyllate (SEYHOT)
   1.006   1.228   0.733      22.068     -27.137       Ammonium fluoride (NH4F)
   3.983   4.858   1.603      21.968     -59.754       Rhodium(iii) trichloride (RhCl3) (ICSD 25764)
   1.444   1.761   0.714      21.953     -50.554       pentakis(Methylisonitrile)-cobalt(i) perchlorate (MINCOP)
   3.056   3.724   2.696      21.859     -11.780       Strontium hydroxide hydrate (Sr(OH)2 (H2O)) (ICSD 63016)
   4.484   5.462   5.889      21.811      31.334       Iron(iii) tribromide (FeBr3)
   1.774   2.159   1.989      21.702      12.120       [H9O4(+)][CHB11Cl11(-)]
   1.577   1.919   1.650      21.687       4.629       Maleic anhydride (MLEICA01)
   3.446   4.193   3.357      21.677      -2.583       Vanadium(iii) oxychloride (VOCl) (ICSD 1981)
   1.269   1.544   2.235      21.671      76.123       Kernite (Na2B4O7 4(H2O))
   1.819   2.213   2.005      21.660      10.225       [H7O3(+)][CHB11Cl11(-)]
   3.354   4.080   3.855      21.646      14.937       Calcium dibromide (CaBr2)
   2.988   3.634   0.465      21.620     -84.438       Manganese(ii) dichloride (MnCl2)
   3.322   4.036   3.904      21.493      17.520       Sodium bromate (NaBrO3) (ICSD 1302)
   1.878   2.281   2.313      21.459      23.163       Lu Complex Sparkle (ICSD 110102)
   1.856   2.254   1.811      21.444      -2.425       catena-(Hexane-1,6-diammonium bis(mu-4-phosphato)-bis(mu-3-hydrogen phosphato)-bis(hydroxy)-tetra-beryllium monohydrate) (ACOKUZ)
   1.180   1.433   0.161      21.441     -86.356       Dichloro-nitrosyl-bis(trimethylphosphine)-cobalt (FALTER)
   4.007   4.866   4.511      21.437      12.578       Indium hexafluoroarsenate (InAsF6) (ICSD 417952)
   2.235   2.714   2.278      21.432       1.924       Nona-aqua-bismuth(iii) tris(triflate) (ZEZTUT)
   1.928   2.339   2.014      21.317       4.461       Deca-azonia-30-crown-10 tetrachloro-palladium(ii) clathrate bis(tetrachloro-palladium(ii)) tetrachloride (JEJHIP10)
   1.746   2.117   1.431      21.249     -18.041       bis(Dimethylglyoximato)diammine-rhodium(iii) bis(dimethylglyoximato) dichloro-rhodium(iii) tetrahydrate (ACGXRH)
   1.304   1.581   1.473      21.242      12.960       Aqua-chloro-(15-crown-5)-magnesium chloride acetonitrile solvate (YAFYEJ)
   1.677   2.033   1.823      21.228       8.706       bis(Dihydroxypropan-2-one)-diaqua-dichloro-bis(1,3-dihydroxypropan-2-one)-di-calcium dichloride (NADQEP)
   1.707   2.069   1.929      21.207      13.005       catena(Dichloro-bis(mu-2-pyrazine)-iron(ii)) (ZIFRUB)
   3.034   3.674   2.528      21.094     -16.678       Antimony(v) chloride (SbCl5)
   4.615   5.588  10.272      21.083     122.579       Gold(i) bromide (AuBr) (ICSD 200287)
   2.950   3.571   2.566      21.051     -13.017       Chromium(iii) trichloride (CrCl3)
   3.920   4.744   3.747      21.020      -4.413       Nickel(ii) hydroxide (Ni(OH)2) (ICSD 28101)
   1.390   1.681   1.463      20.935       5.252       bis(Tetraethylammonium) hexachloro-zirconium (JESFIW)
   3.946   4.771   6.479      20.907      64.192       Barium dichloride (BaCl2) (ICSD 15705)
   2.014   2.434   1.945      20.854      -3.426       H5Be2PO7 (ICSD 1710400)
   2.332   2.817   2.014      20.798     -13.636       bis(Diamino-3-pyridinium) pentachloro thallium (PEVXEU)
   1.534   1.853   1.702      20.795      10.952       tris(1-Ethyl-3-methylimidazolium) hexachlorolanthanate (UFAXAA)
   1.963   2.370   2.042      20.734       4.024       tris(Pyridinium) tris(mu-2-chloro)-bis(trichloro-molybdenum(iii)) (DISNAU)
   4.293   5.179   3.627      20.638     -15.514       Claudetite (As2O3)
   2.932   3.537   2.877      20.634      -1.876       bis((mu-2-Oxo)-(mu-2-trifluoroacetato-O,O')-trifluoro-antimony(v)) (OFAFSB01)
   1.678   2.023   1.558      20.560      -7.151       Pyromellitic dianhydride (PYMDAN)
   1.796   2.164   1.952      20.490       8.686       15-Crown-5 octa-aqua-lutetium trichloride (FILVUR)
  11.481  13.831   1.314      20.469     -88.555       Technetium (Tc) (ICSD 653014) hcp
   2.838   3.418   1.494      20.437     -47.357       Vanadium(iii) trichloride (VCl3) (ICSD 1902637)
   1.755   2.112   2.174      20.342      23.875       1,3-di-t-butyl-2,4,5-triiodo-2,4,5-triphosphabicyclopentane iodine (BOCROB)
   2.444   2.941   2.053      20.336     -15.998       Difluoro-tris(pentafluorophenyl)-bismuth bis(tris(pentafluorophenyl)-bismuth) (SETNOU)
   5.195   6.251   4.533      20.327     -12.743       Manganese(iv) dioxide (MnO2) (ICSD 393)
   1.707   2.053   1.999      20.269      17.106       [H(CH3OH)3(+)][CHB11Cl11(-)]
   1.725   2.072   2.208      20.116      28.000       Oxalic acid dihydrate (OXACDH26)
   2.508   3.012   2.220      20.096     -11.483       Sodium tetrafluoroborate (NaBF4) (ICSD 36067)
   5.688   6.828   0.000      20.042    -100.000       Tungsten dichloride (WCl2) (ICSD 542032)
   3.360   4.033   4.515      20.030      34.375       Potassium hexafluorogermanate (K2GeF6) (ICSD 30310)
   1.949   2.339   2.269      20.010      16.419       La Complex Sparkle (YIVZIM)
   4.657   5.588   7.244      19.991      55.551       Iron(ii) dibromide (FeBr2) (ICSD 409571)
   1.510   1.810   1.769      19.868      17.152       Hydrazinium chloride (N2H5Cl) (ICSD 65334)
   2.806   3.361   2.870      19.779       2.281       catena(tris(Guanidinium) trichloro-tris(oxalato-O,O')-di-bismuth(iii)) (CAHMAZ)
   1.841   2.204   1.957      19.718       6.301       catena-((mu-3-3-Carboxy-4-hydroxybenzenesulfonato-O,O',O'')-(3-carboxy-4-hydroxybenzenesulfonato)-tetra-aqua-strontium(ii) dihydrate) (YAMNUW)
   3.051   3.650   1.023      19.633     -66.470       Niobium(v) oxychloride (NbOCl3) (ICSD 412071)
   2.098   2.507   2.238      19.495       6.673       catena(Tetraethoxyphosphonium nonachloro-di-tellurium(iv)) (JOJNIF)
   2.362   2.822   2.100      19.475     -11.092       Dichloro-(18-crown-6)-thallium tetrachloro-thallate (XORQIE)
   1.667   1.991   1.673      19.436       0.360       2,4,4,6,6-Pentachloro-2-(piperidyl)cyclotriphosphazene (POTKEO)
   1.474   1.760   1.550      19.403       5.156       Aceclofenac hemikis(piperazine)
   1.935   2.310   1.941      19.380       0.310       Diglycine selenate (DGLYSE)
   2.881   3.439   5.042      19.368      75.009       Ba(OH)2 3(H2O)
   3.088   3.685   2.053      19.333     -33.517       Vanadium(ii) dichloride (VCl2)
   5.984   7.140   0.000      19.318    -100.000       Cobalt(iii) sesquioxide (Co2O3) (high spin) (ICSD 1300629)
   8.241   9.833   5.970      19.318     -27.557       Lead telluride (PbTe) (ICSD 648616)
   1.757   2.096   2.023      19.294      15.139       Tartaric acid (TARTAC)
   1.237   1.474   1.561      19.159      26.192       Ice-5
   6.494   7.734  12.812      19.095      97.290       Lead(iv) tetrafluoride (PbF4) (ICSD 16795)
   2.378   2.832   2.424      19.092       1.934       Brucite (Mg(OH)2)
   1.137   1.354   1.284      19.085      12.929       Hexa(ethanolato-O)-magnesium dichloride (JADJED)
   4.886   5.817   4.835      19.054      -1.044       Frankdicksonite (BaF2)
   1.922   2.288   2.173      19.043      13.059       bis(Guanidinium) orthomolybdate (BAGPEE)
   1.133   1.348   1.261      18.976      11.297       N N'-(6 6'-dimethylbiphenyl-2 2'-diyl)bis(methylamine) (ENIWIH)
   1.592   1.894   1.630      18.970       2.387       1 4 dioxocine 6-carboxylic acid chloride (CUWWIA)
   0.849   1.010   0.923      18.963       8.716       Aminetrimethylborane (RIJHIB)
   1.794   2.133   2.125      18.896      18.450       bis(Methylammonium) tetrachloro-copper(ii) (ZZZPMY13)
   1.905   2.264   1.771      18.845      -7.034       Oxalic acid (OXALAC06)
   1.648   1.958   1.846      18.811      12.015       bis(Trimethylammonium) hexachloro-tin(iv) (CADNOK)
   1.752   2.081   2.023      18.779      15.468       Hexa-ammine-nickel(ii) bis(trinitromethanide) (XIRNUI)
   1.502   1.784   1.649      18.775       9.787       Pr Complex Sparkles (GIWWEO)
   1.664   1.976   1.815      18.750       9.075       N-Chlorosuccinimide (CSUCIM)
   2.160   2.565   1.110      18.750     -48.611       Cyclo-tri-mu-thioacetamide-tris(chloro-copper(i)) (CTACCU)
   1.335   1.585   1.528      18.727      14.457       Tetra-n-butylammonium tetrachloro-indium (BEFFOH)
   3.456   4.103   3.469      18.721       0.376       Tetra-ammine-palladium(ii) tetrachloro-gold(iii) (KIYVUK)
   1.182   1.403   1.458      18.697      23.350       Ice-2
   1.779   2.111   1.278      18.662     -28.162       Pyridinium fluorochromate (NONYUK)
   1.481   1.756   1.602      18.569       8.170       Gallium(i) bis(1,3,5-trimethylbenzene) tetrachloro-gallium(iii) (CUPJUS)
   2.504   2.966   4.369      18.450      74.481       Sodium trimetaphosphate (Na2HP3O9)
   3.614   4.279   4.647      18.401      28.583       Podlesnoite (BaCa2(CO3)2F2)
   2.337   2.766   2.401      18.357       2.739       tetrakis(2,2'-Bipyridinium) tetrakis((mu-2-chloro)-tetrachloro-bismuthate(iii)) (PURLOD01)
   4.198   4.967   4.817      18.318      14.745       Zinc bromide (ZnBr2)
   1.671   1.977   1.871      18.312      11.969       Epsomite (MgSO4 (H2O)7)
   1.972   2.332   2.198      18.256      11.460       Ammonium diaqua-oxo-bis(oxalato-O,O')-niobium(v) trihydrate (AMOXNB)
   2.268   2.680   2.791      18.166      23.060       4-Ethylpyridinium tetrabromoferrate(iii) (EPYMBF)
   1.815   2.144   1.962      18.127       8.099       Trichloro-tris(tetrahydrofuran)-lutetium (HAFWAM)
   1.729   2.042   2.029      18.103      17.351       Ammonium chromium(III) alum ((NH4)Cr(SO4)2 12(H2O))
   5.121   6.048   4.861      18.102      -5.077       Bismuth tribromide (BiBr3) (ICSD 100294)
   1.779   2.101   1.794      18.100       0.843       Propane-1,3-diammonium tetrachloro-chromium(ii) (BAHVIP)
   3.825   4.516   3.052      18.065     -20.209       Lithium hexafluoroantimonate (LiSbF6) (ICSD 23924)
   1.642   1.938   1.847      18.027      12.485       Gd Complex Sparkle (VEDSEC)
   2.342   2.764   2.276      18.019      -2.818       Gypsum (CaSO4 2H2O)
   1.654   1.952   1.667      18.017       0.786       alpha-Ketoglutaric acid (COTPAC)
   3.554   4.194   4.912      18.008      38.210       Realgar (AsS)
   2.517   2.970   2.870      17.998      14.025       XIII 1,3-dibromo-2-chloro-5-fluorobenzene
   1.474   1.739   1.571      17.978       6.581       Phloroglucinol (PHGLOL)
   1.772   2.090   1.732      17.946      -2.257       Picric acid (PICRAC)
   1.222   1.441   1.234      17.921       0.982       Phenanthrene (232) (PHENAN08)
   1.396   1.646   1.494      17.908       7.020       Tryptophan (TRYPTC)
   1.586   1.870   1.715      17.907       8.134       Dichloro-(15-crown-5)-titanium tetrachloro-aluminium (YARSUF)
   1.655   1.951   1.665      17.885       0.604       Trinitrotoluene (ZZZMUC01)
   1.991   2.347   1.484      17.880     -25.465       Phosphorus trichloride (PCl3)
   1.919   2.262   2.092      17.874       9.015       Dodecahydroxycyclohexane dihydrate (SANTEH)
   1.723   2.030   1.944      17.818      12.826       Hexahydrite (MgSO4 6(H2O))
   1.521   1.792   1.772      17.817      16.502       trans-Dichloro-pentakis(tetrahydrofuran)-yttrium(iii) trans-tetrachloro-bis(tetrahydrofuran)-yttrium(iii) (PEHJAN01)
   2.481   2.923   2.603      17.815       4.917       bis(Dichloro-(18-crown-6)-bismuth(iii)) bis(mu-2-chloro)-bis(trichloro-bismuth(iii)) (KAMWOK)
   1.294   1.524   1.534      17.774      18.547       Ice-12
   2.150   2.531   1.153      17.721     -46.372       Cobalt diformate dihydrate (Co(HCO2)2(H2O)2) (ICSD 109960)
   2.277   2.680   4.099      17.699      80.018       Phosphorus(v) pentoxide (P4O10) (ICSD 40865)
   3.058   3.599   2.532      17.691     -17.201       bis(Guanidinium) tetrabromido-mercury(ii) (JISFUN01)
   1.612   1.897   1.733      17.680       7.506       Trichloro-tris(pyridine) molybdenum (CLPYMO10)
   2.122   2.497   2.251      17.672       6.079       Newberyite (MgHPO4 3(H2O))
   1.523   1.792   1.205      17.663     -20.880       Germanocene (CEGTOX)
   1.608   1.892   0.695      17.662     -56.779       Diaqua-15-crown-5-cobalt tetrachloro-cobalt monohydrate (VOMWUP)
   3.478   4.090   3.089      17.596     -11.185       Indium trichloride (InCl3) (ICSD 1300752)
   1.395   1.640   1.628      17.563      16.703       Glycerol (GLCROL)
   0.867   1.019   0.890      17.532       2.653       n-Pentane (PENTAN01)
   1.308   1.537   1.262      17.508      -3.517       Fluoxetine hydrochloride
   1.951   2.292   1.967      17.478       0.820       Nickel(ii) sulfate heptahydrate (NiSO4 7(H2O)) (ICSD 39419)
   1.919   2.254   1.906      17.457      -0.677       Clinobehoite (Be(OH)2)
   2.875   3.376   3.020      17.426       5.043       Huntite (CaMg3 (CO3)4)
   1.738   2.040   2.035      17.376      17.089       Ammonium tris(oxalato-O,O')-chromium(iii) dihydrate (AMOXCR)
   1.566   1.838   1.878      17.369      19.923       Glucose (GLUCSA)
   1.250   1.467   1.367      17.360       9.360       L-Lysine monohydrochloride dihydrate (LYSCLH)
   1.414   1.658   1.592      17.256      12.588       Glutaric acid
   2.417   2.834   3.450      17.253      42.739       bis(Guanidinium) tetrabromo-zinc(ii) (BEYNUO)
   6.121   7.175   3.569      17.219     -41.693       Scheelite (CaWO4)
   1.249   1.464   1.356      17.214       8.567       Ammonium benzoate (YABFEO)
   2.491   2.919   2.511      17.182       0.803       bis(mu-2-hydroxo)-diaqua-hexachloro-tin(iv) benzene solvate monohydrate (GIMYEH)
   1.263   1.480   1.288      17.181       1.979       Chloro-tris(1,3-dimethylimidazolin-2-ylidene)-beryllium chloride (ZEZYEI)
   1.656   1.940   1.856      17.150      12.077       bis(Trimethylammonium) hexachloro-tellurium(iv) (BEJSAK)
   2.970   3.478   3.063      17.104       3.131       Hydroxylherderite (CaBe(PO4)(OH))
   1.222   1.431   1.213      17.103      -0.736       Phenanthrene (221) (PHENAN08)
   2.970   3.477   3.066      17.071       3.232       Herderite (CaBe(PO4)F(OH))
   3.104   3.633   5.221      17.043      68.202       Barium chloride dihydrate (BaCl2 2(H2O)) (ICSD 2254)
   1.350   1.580   1.454      17.037       7.704       hexakis(Methanol)-vanadium(ii) dichloride (DATBUV)
   4.851   5.676   5.422      17.007      11.771       Barium dibromide (BaBr2) (ICSD 15706)
   1.222   1.429   1.169      16.939      -4.337       Phenanthrene (222) (PHENAN08)
   6.800   7.948   5.086      16.882     -25.206       Thallium(i) sulfate (Tl2SO4) (ICSD 1005224)
   1.637   1.913   2.014      16.860      23.030       Chloro-(18-crown-6)-triaqua-barium chloride dihydrate (LIFFIQ)
   2.931   3.425   3.248      16.854      10.815       Aragonite (CaCO3)
   1.159   1.354   1.223      16.825       5.522       4-(2,4-diisopropylphenyl)-4-oxo-2-butenoic acid
   1.245   1.454   1.204      16.787      -3.293       o-Aminopyridine (AMPYRD)
   1.639   1.914   2.037      16.779      24.283       Ammonium aluminum sulfate ((NH4)Al(SO4)2 (12(H2O))
   1.861   2.173   1.939      16.765       4.191       catena-(bis(Ammonium 18-crown-6 (mu2-chloro)-dichloro-(mu-2-thiocyanato-S,N)-bismuth)) (VEJREH)
   1.183   1.381   1.224      16.737       3.466       Biphenyl (BIPHEN04)
   1.923   2.244   1.389      16.693     -27.769       Nona-aqua-scandium(iii) tris(trifluoromethanesulfonate) (NINMIG)
   1.480   1.727   1.278      16.689     -13.649       bis(Tetra-n-butylammonium) hexaselenide (CAHJUQ)
   1.608   1.876   1.656      16.667       2.985       Maleic acid (MALIAC11)
   1.351   1.576   1.398      16.654       3.479       beta-Hydroxystyryl-N-(2-pyridinyl)acetamide hydrochloride monohydrate -NH2-CO- (DIDVER)
   1.422   1.658   1.556      16.596       9.423       bis(mu-2-Chloro)-bis(dichloro-bis(trimethylphosphine)-vanadium(iv)) (LEMCIP)
   2.848   3.320   2.914      16.573       2.317       Cesium hydrogen acetylide (CsHC2) (ICSD 107491)
   2.444   2.848   2.777      16.530      13.625       Lithium perchlorate (LiClO4) (ICSD 413238)
   2.960   3.449   2.263      16.520     -23.547       Anhydrite (CaSO4)
   1.182   1.377   1.168      16.497      -1.184       4-Dimethylaminopyridine (BUKJOG10)
   1.974   2.298   2.144      16.413       8.612       Tb Complex Sparkle (KITGAV)
   1.183   1.377   1.209      16.399       2.198       Triphenylguanidine
   1.636   1.904   1.905      16.381      16.443       (tris(2-Aminoethyl)amine)-pyridine-copper(ii) diperchlorate (SELXIQ)
   1.387   1.614   1.407      16.366       1.442       Eu Complex Sparkle (PIEUAC01)
   1.375   1.600   1.420      16.364       3.273       Salicylaldoxime (SALOXM)
   1.589   1.849   1.565      16.362      -1.510       Sulfuric acid tetrahydrate (H2SO4 4(H2O)) (ICSD 2783)
   1.252   1.456   0.735      16.294     -41.294       Fluoranthene (FLUANT02)
   1.842   2.142   0.393      16.287     -78.664       Sodium tetracarbonyl-cobalt (FUBYOQ)
   1.615   1.878   1.925      16.285      19.195       Dy Complex Sparkle (FOPNAZ)
   3.012   3.502   3.270      16.268       8.566       Guanidinium tetrachloro-gold(iii) (DILJIR)
   1.938   2.253   2.355      16.254      21.517       Sm Complex Sparkle (KUYBAH)
   4.074   4.734   5.435      16.200      33.407       Bromine (Br2) (ICSD 24019)
   1.643   1.909   1.988      16.190      20.998       18-Crown-6 hydroxonium clathrate aqua-oxo-tetrachloro-molybdenum (JOKGOF01)
   1.769   2.055   1.788      16.167       1.074       1,3-Propylenediammonium selenite dihydrate (BAYCEK)
   1.814   2.107   1.912      16.152       5.402       Ammonium dihydrogenphosphate (NH4 H2PO4)
   1.444   1.677   1.507      16.136       4.363       tetrakis(Dimethylammonium) hexachloro-chromium chloride (FAMVUK10)
   1.481   1.719   1.534      16.070       3.579       p-Chloroaniline (CLANIC05)
   4.388   5.093   2.281      16.067     -48.017       Manganese(ii) dibromide (MnBr2)
   2.253   2.614   2.110      16.023      -6.347       aqua-bis(hexafluoropentane-2,4-dione)-barium (KOWPOB)
   1.573   1.825   1.762      16.020      12.015       tetrakis(Dimethylammonium) hexachloro-indium(iii) chloride (FUVCAA)
   1.263   1.465   1.377      15.994       9.026       Acetylcholine (ACHOLC01)
   3.958   4.591   4.964      15.993      25.417       Arsenic(iii) bromide (AsBr3)
   1.546   1.793   1.571      15.977       1.617       Aceclofenac
   1.168   1.354   1.248      15.925       6.849       tetrakis((mu-3-Chloro)-triethylamino-copper) (DEWKAR)
   1.264   1.465   1.326      15.902       4.905       p-Aminopyridine (AMPYRE)
   2.216   2.568   2.277      15.884       2.753       bis(mu-2-Amido)-bis(tetra-ammine-platinum(iv)) hexachloride dimethylsulfoxide solvate (BOGPAO)
   1.375   1.593   1.428      15.855       3.855       4,4'-Biphenol (DOHDPH02)
   2.292   2.655   2.521      15.838       9.991       Trichloro-(triethylene glycol)-lutetium (FUXSEW)
   1.984   2.298   2.054      15.827       3.528       Pr Complex Sparkle (ICSD 240384)
   4.568   5.290   5.948      15.806      30.210       BaFCl
   1.921   2.224   0.105      15.773     -94.534       Cobalt(ii) chloride hexahydrate (CoCl2 6(H2O))
   1.602   1.854   1.867      15.730      16.542       (18-Crown-6)-diaqua-bromo-rubidium(i) (XAJXUD)
   2.266   2.621   2.224      15.666      -1.853       catena-(Pentamethylenediammonium (mu-2-chloro)-tetrachloro-bismuth(iii)) (ACIKED)
   1.941   2.245   1.987      15.662       2.370       18-Crown-6-dichloro-mercury(II) (CESZOP)
   5.096   5.894   7.393      15.659      45.075       Hafnium(iv) tetrabromide (HfBr4)
   1.137   1.315   1.265      15.655      11.258       Beryllium chloride diethyl ether solvate (ETBECL)
   2.017   2.332   2.442      15.617      21.071       Dy Complex Sparkle (FUXRAR)
   7.281   8.418   7.495      15.616       2.939       Gold(i) cyanide(AuCN)
   1.701   1.966   1.783      15.579       4.821       bis(15-Crown-5)-barium tetrachloro-copper (HEPWOO)
   1.811   2.093   1.948      15.572       7.565       Biquanidinium hexachloro-copper(ii) dihydrate (FOWCUP)
   1.229   1.420   1.279      15.541       4.068       4,4'-Biphenol bis(caprolactam) (KEWZUI)
   1.294   1.495   1.524      15.533      17.774       Ice-14
   1.662   1.920   1.854      15.523      11.552       Citric acid (CITRAC10)
   1.039   1.200   1.052      15.496       1.251       bis(Tetramethylethylenediamine-lithium) hexamethyl-zirconium (JAMWOJ)
   1.686   1.947   1.890      15.480      12.100       Lansfordite (MgCO3 5(H2O))
   1.381   1.594   1.444      15.424       4.562       trans-Dichloro-tetrakis(ethylamino)-chromium chloride (TIXMES)
   1.427   1.647   1.428      15.417       0.070       5-Nitrouracilate diphenylguanidinium dihydrate
   2.757   3.182   2.528      15.415      -8.306       Farringtonite (Mg3(PO4)2)
   2.058   2.375   2.358      15.403      14.577       catena-((Ethylenediammonium) tetra-aqua-octaoxo-tetraoxa-tetraphosphacyclo-octane-strontium monohydrate) (VABFEJ)
   3.261   3.763   4.036      15.394      23.766       Potassium bromate (KBrO3) (ICSD 47173)
   2.002   2.310   2.353      15.385      17.532       Tb Complex Sparkle (KUYBEL)
   1.401   1.616   1.529      15.346       9.136       Aspirin(I) ACSALA01
   1.462   1.686   1.650      15.321      12.859       Er Complex Sparkle (XOXXAJ)
   2.496   2.878   3.085      15.304      23.598       Sodium perchlorate (NaClO4) (ICSD 1409185)
   4.953   5.711   0.000      15.304    -100.000       Zinc fluoride (ZnF2)
   3.656   4.214   4.372      15.263      19.584       Strontium metasilicate (SrSiO3) (ICSD 59308)
   2.254   2.598   2.415      15.262       7.143       Hydromagnesite (Mg5(CO3)4(OH)2 4(H2O))
   5.324   6.135   5.063      15.233      -4.902       Tungsten(vi) hexabromide (WBr6) (ICSD 62048)
   4.136   4.766   4.148      15.232       0.290       Tarbuttite (Zn2(PO4)(OH))
   1.877   2.162   1.111      15.184     -40.810       bis(mu-2-Chloro)-bis(h5-cyclopentadienyl)-dichloro-di-chromium (CATSEV01)
   1.255   1.445   1.323      15.139       5.418       p-Diaminobenzene (PENDAM)
   1.463   1.684   1.506      15.106       2.939       fac-(1,3,5-Trimethyl-1,3,5-triazacyclohexane)-trichloro-scandium (JASWUW)
   1.351   1.555   1.387      15.100       2.665       beta-Hydroxystyryl-N-(2-pyridinyl)acetamide hydrochloride monohydrate -NH-COH- (DIDVER)
   5.188   5.971   7.184      15.093      38.473       BaBrF
   1.750   2.014   2.031      15.086      16.057       Nd Complex Sparkle (BILSIY)
   1.465   1.686   1.482      15.085       1.160       bis(bis(2-Aminoethyl)amine)-nickel(ii) dichloride monohydrate (AEAMNI10)
   1.421   1.635   1.411      15.060      -0.704       Dibromo-(tetrahydrofuran)-(2,6-bis((3-mesityl-1,3-dihydroimidazol-2-ylidene)methyl)phenyl)-lutetium tetrahydrofuran solvate (TOJMEL)
   1.409   1.621   1.545      15.046       9.652       tris(Acetylacetonato)-gallium(iii) (ACACGA)
   1.317   1.515   1.433      15.034       8.808       Benzoylacrylic crystal structure
   1.917   2.205   1.800      15.023      -6.103       catena-(tris(1,2,4-triazolium) (mu-2-chloro)-tetrachloroantimonate(iii) chloride)(AFEVEM)
   1.881   2.163   0.443      14.992     -76.449       Diaqua-dichloro-bis(urea)-cobalt (AQURCO10)
   2.245   2.581   2.257      14.967       0.535       N,N,N',N'-Tetramethylethylenediammonium hexachloro-platinum(iv) (CULZOY)
   1.592   1.830   1.576      14.950      -1.005       p-Chlorobenzoic acid (CLBZAP03)
   2.611   3.001   2.133      14.937     -18.307       Yttrium(iii) trichloride (YCl3) (ICSD 15684)
   1.897   2.180   2.130      14.918      12.283       bis(Guanidinium) eosinate trihydrate (BOJFEM)
   1.422   1.634   1.527      14.909       7.384       1 4-Dimethoxyanthracene-9 10-dione (VICZAJ)
   1.215   1.396   1.303      14.897       7.243       Hydroquinone bis(aniline) (HIBFUT)
   4.393   5.045   5.736      14.842      30.571       Germanium(iv) diselenide (GeSe2) (ICSD 614)
   1.551   1.781   1.657      14.829       6.834       s-Trinitrobenzene-s-triaminobenzene (NIBZAM)
   1.309   1.503   1.424      14.820       8.785       bis(Tetramethylammonium) tetrachloro-manganese (KAVWAF05)
   1.822   2.091   1.831      14.764       0.494       15-Crown-5 diaqua-tetrachloro-tin(iv) (FANRUH)
   2.040   2.341   2.290      14.755      12.255       Tm Complex Sparkle (KITHAW)
   1.315   1.509   1.377      14.753       4.715       Aconitine (ACONTO10)
   1.127   1.293   1.270      14.729      12.689       Tetramethylphosphonium chloride monohydrate (MIYHEH)
   2.092   2.400   2.174      14.723       3.920       bis((mu-2-Chloro)-acetonitrile-chloro-copper(ii)) (DCUCAN)
   1.142   1.310   1.148      14.711       0.525       m-Toluidine (FANDOO)
   1.958   2.246   2.082      14.709       6.333       Triaqua-bromo-(12-crown-4)-strontium bromide (WOZHUO)
   3.937   4.515   3.634      14.681      -7.696       Celestine (SrSO4)
   2.162   2.479   2.357      14.662       9.019       trans-Dibromo-tetrakis(acetonitrile-N)-vanadium(iii) tribromide (DUSGED)
   1.214   1.392   1.241      14.662       2.224       o-Diaminobenzene (BAGFIY)
   1.746   2.002   1.811      14.662       3.723       tris(Dimethylamino)cyclopropenylium hexachloro-niobium(v) (KOWGOS)
   1.682   1.928   1.839      14.625       9.334       tris(Piperazinediium) bis(tris(pyridine-2,6-dicarboxylato-N,O,O')-indium(iii)) dodecahydrate (KEQGUJ)
   1.348   1.545   1.380      14.614       2.374       5-Nitrouracil triphenylguanidinium
   1.972   2.260   2.310      14.604      17.140       Eu Complex Sparkle (FUXPOD)
   1.483   1.699   1.564      14.565       5.462       Aceclofenac hemikis(piperazine) hydrate
   4.417   5.060   6.729      14.557      52.343       Antimony(iii) fluoride (SbF3)
   1.313   1.504   1.355      14.547       3.199       tris(4,4'-Biphenol) bis(2-aminopyridine) (KEXBAR)
   3.810   4.364   4.051      14.541       6.325       Paracelsian (SrGa2Si2O8)
   3.323   3.806   5.236      14.535      57.568       Cesium hexafluorophosphate (CsPF6) (ICSD 1703996)
   1.200   1.374   1.236      14.500       3.000       trans-Stilbene (TSTILB03)
   1.441   1.649   1.491      14.434       3.470       bis(tris(2-Pyridylmethyl)amine)-calcium diperchlorate (FESPOI)
   1.782   2.038   2.257      14.366      26.655       Nona-aqua-yttrium(iii) tris(ethyl sulfate) (AYETHS01)
   1.685   1.927   1.799      14.362       6.766       Urea nitrate (UREANT02)
   1.853   2.119   2.180      14.355      17.647       Tetrodotoxin hydrobromide (TETXHB)
   1.317   1.506   1.352      14.351       2.658       Nevirapine hemihydrate
   1.589   1.817   1.984      14.349      24.858       Hexa-aqua-magnesium(ii) 18-crown-6 dibromide dihydrate (IFOYAE)
   2.947   3.369   3.755      14.320      27.418       bis(Ethylenediammonium) hexabromo-bismuth(iii) bromide monohydrate (YINDUV)
   2.106   2.407   2.282      14.292       8.357       bis(Oxo)-dichloro-bis(18-crown-6)-di-tellurium(iv) bis(hexachloroantimonate) (LONVEP)
   5.116   5.846   2.867      14.269     -43.960       Strontium oxide (SrO)
   1.609   1.838   1.758      14.232       9.260       Ammonium hydrogen phosphate ((NH4)2HPO4) (ICSD 2799)
   2.146   2.451   2.199      14.212       2.470       (15-Crown-5)-trichloro-tellurium hexachloro-antimony (KUHXOA)
   2.070   2.364   2.141      14.203       3.430       LiCl
   2.162   2.469   1.905      14.200     -11.887       Sodium cyclooctaphosphate hexahydrate (Na8P8O24 6(H2O))
   2.085   2.381   2.464      14.197      18.177       bis(Morpholinium) diaqua-hexachloro-di-molybdenum(ii) (BELWAQ)
   2.860   3.266   2.856      14.196      -0.140       catena-(3,3'-Dichlorobenzidinedi-ium bis(mu-3-chloro)-bis(mu-2-chloro)-dichloro-di-lead(ii)) (COCPAM)
   1.529   1.746   1.786      14.192      16.808       alpha-Lactose monohydrate (LACTOS10)
   2.341   2.673   2.238      14.182      -4.400       Pyridinium pentachloro-(pyridine)-rhenium(iv) (AKINUD)
   1.192   1.361   1.231      14.178       3.272       Nd Complex Sparkle (QAYWOC)
   1.185   1.353   1.274      14.177       7.511       Molecular anvil (RATPEH)
   1.425   1.627   1.622      14.175      13.825       beta-Alanine (BALNIN01)
   1.222   1.395   1.099      14.157     -10.065       Phenanthrene (121) (PHENAN08)
   1.251   1.428   1.573      14.149      25.739       Ice-13
   2.207   2.519   2.252      14.137       2.039       Nona-aqua-lutetium tris(trifluoromethanesulfonate) (BUVVUJ)
   2.133   2.434   2.163      14.112       1.406       Bobierrite Mg3(PO4)2(H2O)8
   1.846   2.106   1.883      14.085       2.004       Tetramethylammonium nickel(ii) trichloride (TMANIC)
   1.444   1.647   1.418      14.058      -1.801       Salicylic acid (SALIAC03)
   1.497   1.707   1.592      14.028       6.346       p-Hydroxybenzoic acid (JOZZIH)
   3.523   4.017   3.376      14.022      -4.173       Johannsenite (CaMnSi2O6)
   1.798   2.050   1.830      14.016       1.780       Terpyridyl(dimethyl)chlorotin(iv) dimethyl(trichloro)stannate(iv) (SNTPYR10)
   1.303   1.485   1.231      13.968      -5.526       Benzo[c]phenanthrene (BZPHAN01)
   1.196   1.363   1.218      13.963       1.839       Diphenylguanidine
   2.421   2.759   2.628      13.961       8.550       Dichloro-(dihydroxy-di-2-pyridylmethane)-gold(iii) chloride (BATTOF)
   1.641   1.870   1.749      13.955       6.581       Aspartic acid (LASPRT)
   2.487   2.834   2.712      13.953       9.047       Sodium chlorate (NaClO3) (ICSD 1117)
   1.536   1.750   1.552      13.932       1.042       bis(Pyridinium) isopropoxy-pentachloro-titanium(iv) (ZUMMUP)
   4.329   4.932   4.592      13.929       6.075       Tellurium(iv) tetrabromide) (TeBr4) (ICSD 1600105)
   2.147   2.446   3.020      13.926      40.661       Hydrogen bromide dihydrate (HBr (H2O)2) (ICSD 34105)
   1.221   1.391   1.352      13.923      10.729       Ammonium nitrate 18-crown-6 (QOBJAS)
   1.516   1.727   1.660      13.918       9.499       Bis(Pyridinium) oxalate oxalic acid (DEFCUM)
   2.609   2.972   3.216      13.913      23.266       Copper(i) diammine bromide (Cu(NH3)2Br) (ICSD 170947)
   1.924   2.191   1.841      13.877      -4.314       Diammonium copper sulfate hexahydrate (Cu(NH4)2 (SO4)2 (H2O)6)
   8.019   9.131  14.728      13.867      83.664       Rhodium(iii) oxide (Rh2O3) (ICSD 108941)
   1.343   1.529   1.421      13.850       5.808       (Diphenylmethanide)-(18-crown-6)-rubidium (UNIJIK)
   2.125   2.418   1.379      13.788     -35.106       Sulfur dichloride (SCl2) (ICSD 38351)
   1.664   1.892   0.551      13.702     -66.887       trans-Dichloro-bis(ethylenediamine)-cobalt(iii) chloride hydrochloride dihydrate (ETDCOH02)
   2.957   3.362   3.045      13.696       2.976       Ice-10
   2.588   2.942   2.840      13.679       9.737       bis(Dimethylammonium) tetrabromo-palladium(ii) (FETHOB)
   1.529   1.738   1.732      13.669      13.277       tris(Hexaaqua-magnesium) benzenehexa(methylsulfonate) tris(1,4-dioxane) clathrate (UMANOL)
   1.779   2.022   0.811      13.659     -54.413       (15-Crown-5)-diaqua-cobalt tetrachloro-copper(ii) (JUSGAF)
   1.693   1.924   1.662      13.644      -1.831       Hexaaqua-manganese(ii) ethylenediammoniotetraacetate (ACIJAY)
   1.694   1.925   1.883      13.636      11.157       Diaqua-(15-crown-5)-copper(ii) diperchlorate (ROBKOI)
   2.138   2.429   2.268      13.611       6.080       catena-(1,2-Ethylenediammonium bis(mu-2-oxo)-tetraoxo-di-vanadium) (FUDLOF02)
   1.921   2.182   1.759      13.587      -8.433       Diammonium hexaquacopper(ii) sulfate ((NH4)2[Cu(H2O)6](SO4)2) (ICSD 62991)
   1.867   2.120   2.098      13.551      12.373       Er Complex Sparkle (LEYJII)
   2.749   3.121   2.676      13.532      -2.656       Sodium yttrium(iii) tetrachloride (NaYCl4) (ICSD 1707980)
   2.149   2.439   2.447      13.495      13.867       Dichloro(1,2-ethanediol) copper(ii) (CETDCU10)
   1.597   1.812   1.707      13.463       6.888       Hexa-aqua-magnesium dihydrogen ethylenediaminetetra-acetate (AQMEDA)
   2.202   2.498   1.541      13.442     -30.018       catena-((mu-3-Methylphosphonato)-(mu-2-fluoro)-aqua-scandium) (UDEHOB)
   1.347   1.528   1.412      13.437       4.826       Carbamazepine (CBMZPN01)
   1.243   1.410   1.420      13.435      14.240       Ethyl magnesium bromide diethyletherate (EMGBRE10)
   2.250   2.552   2.348      13.422       4.356       bis(Pyridinium) hexachloro-rhenium(iv) (GUVVIC01)
   1.753   1.988   0.452      13.406     -74.216       (+-)cis-Dichloro-bis(ethylenediamine)-cobalt(iii) chloride monohydrate (CLECOC01)
   1.731   1.963   1.646      13.403      -4.910       2,4,6-Trinitro-N-methyl-N-nitroaniline (Tetryl) (MTNANL)
   1.307   1.481   1.479      13.313      13.160       Methylene blue (MAPAZT10)
   2.554   2.894   1.869      13.312     -26.821       Boron oxide (B2O3) (ICSD 16021)
   2.247   2.546   2.087      13.307      -7.121       tris(Selenourea) dichloride monohydrate (SECLUR)
   1.256   1.423   1.310      13.296       4.299       Sm Complex Sparkle (YEYLAP)
   3.012   3.412   4.087      13.280      35.691       Lu Complex Sparkle (ICSD 410763)
   1.619   1.834   1.598      13.280      -1.297       5-Nitrouracil dioxane
   6.055   6.859   1.519      13.278     -74.913       Cobalt oxide (Co3O4) (ICSD 28158)
   2.615   2.962   2.978      13.270      13.881       246-Tribromoaniline (BRANIL)
   1.463   1.657   1.507      13.260       3.008       L-Histidinium acetate (POPGIK)
   6.407   7.256   5.631      13.251     -12.112       Antimony (Sb) (ICSD 651499)
   5.284   5.984   3.305      13.248     -37.453       Niobium(v) pentoxide (Nb2O5) (ICSD 71317)
   3.200   3.623   2.833      13.219     -11.469       NaBr
   4.628   5.239   4.381      13.202      -5.337       Vanadium(ii) dibromide (VBr2)
   1.947   2.204   2.201      13.200      13.046       Tb Complex Sparkle (FOPPUV)
   2.540   2.875   2.735      13.189       7.677       bis(Guanidinium) bis(oxalato)-platinum(ii) (AJESEN)
   2.079   2.353   2.330      13.179      12.073       4,4'-Bipyridylium bis(mu-2-chloro)-tetrachloro-di-copper (BPYCCU)
   1.506   1.704   1.410      13.147      -6.375       Calcium (Ca) (ICSD 44727)
   1.021   1.155   1.060      13.124       3.820       Cholesterol (CHOEST20)
   2.115   2.392   1.982      13.097      -6.288       bis(a,a'-Dithio-bis(formamidinium)) dichloride hexachloro-rhenium(iv) trihydrate (DEBJOJ)
   1.881   2.127   2.079      13.078      10.526       (mu-2-1,4,7,10-Tetra-azacyclododecane-1,4,7-triacetato-10-methyl hydrogen phosphonato)-triaqua-lithium-lutetium(iii) dihydrate (LARLAS)
   1.430   1.617   1.582      13.077      10.629       4-Nitroaniline (NANILI22)
   1.323   1.496   1.374      13.076       3.855       Tetracene (TETCEN01)
   2.058   2.327   1.663      13.071     -19.193       Hexafluorobenzene (HFBENZ02)
   1.800   2.035   1.768      13.056      -1.778       catena(Aqua-hydroxo-malonato-scandium(iii) dihydrate) (AXMLSC)
   2.029   2.293   2.284      13.011      12.568       Cis Cu Diglycine (CUGLYM02)
   2.189   2.473   2.398      12.974       9.548       Yb Complex Sparkle (BUVYEW01)
   1.497   1.691   1.512      12.959       1.002       Nevirapine rac-tartaric acid
   1.831   2.068   1.949      12.944       6.445       Ikaite ((CaO)(CO2)(H2O)6)
   4.543   5.131   2.944      12.943     -35.197       Strontium orthosilicate (Sr2SiO4) (ICSD 544865)
   1.516   1.712   1.554      12.929       2.507       Aceclofenac cytosine
   1.317   1.487   1.374      12.908       4.328       Diethylammonium tetracyanopalladate (EATCPD)
   1.560   1.761   1.594      12.885       2.179       Trichloro-(2,5,8-trioxononane)-scandium (CORNIG)
   1.058   1.194   1.052      12.854      -0.567       bis(h5-isopropyl-tetramethyl-cyclopentadienyl)-(1,3-di-isopropyl-4,5-dimethylimidazol-2-ylidene)-calcium toluene solvate (QIBBEI)
   1.387   1.565   1.423      12.833       2.596       4-(Dimethylamino)pyridinium hydrogen phthalate (GUKVOY)
   1.349   1.522   1.310      12.824      -2.891       Pentacene (PENCEN02)
   6.506   7.340   0.000      12.819    -100.000       Zirconium (Zr) (ICSD 653525) hcp
   1.568   1.769   1.366      12.819     -12.883       tris(Hexafluoroacetylacetonato) magnesium 1-dimethylammonium-8-dimethylamino-naphthalene (NAFAMG10)
   4.104   4.629   6.707      12.792      63.426       Niobium(iii) trifluoride (NbF3) (ICSD 60246)
   1.207   1.361   1.304      12.759       8.036       Tetramethylammonium benzoate monohydrate (ISIHIB)
   1.602   1.806   1.785      12.734      11.423       beta-D-Fructose (FRUCTO11)
   1.532   1.727   1.507      12.728      -1.632       18-Crown-6 oxonium clathrate aqua-pentachloro-titanium (SEPJEC)
   2.247   2.532   2.355      12.684       4.806       (Ethylenediamine)-tetrahydroxy-germanium(iv) (NOHHIC)
   1.730   1.949   1.798      12.659       3.931       bis(4-Chloropyridinium) tetrachlorido-nickelate(ii) (KIWGED)
   3.676   4.141   5.520      12.650      50.163       Strontium phosphate (Sr2P2O7) (ICSD 31004)
   1.763   1.986   1.784      12.649       1.191       bis(Tetramethylammonium) di-tellurium (LAXTAF)
   1.850   2.084   1.911      12.649       3.297       Dicalcium naphthalenetetracarboxylate Pentahydrate (Ca2C14H14O13)
   4.002   4.507   3.312      12.619     -17.241       Iron silicate (FeSiO3) (ICSD 17055)
   3.238   3.645   0.866      12.569     -73.255       Technetium(iv) tetrachloride (TcCl4) (ICSD 26055)
   0.916   1.031   1.083      12.555      18.231       ice-Ih
   1.628   1.832   1.830      12.531      12.408       bis(Ethylenediamine)-bis(nitrato-O)-copper(ii) (COPDEN)
   1.855   2.087   1.796      12.507      -3.181       tris(Guanidinium) hexafluoro-indium(iii) (BUYFUW02)
   4.526   5.091   7.270      12.483      60.627       Barium hydroxide (Ba(OH)2) (ICSD 56737)
   2.051   2.307   2.219      12.482       8.191       Nona-aqua-lutetium tris(ethyl sulfate) (ZZZARM01)
   1.355   1.524   1.321      12.472      -2.509       Fluoxetine hydrochloride fumaric acid
   1.165   1.310   1.267      12.446       8.755       Tetramethylurea (TIDBIR)
   1.222   1.374   1.329      12.439       8.756       Phenanthrene (PHENAN08)
   3.845   4.323   6.529      12.432      69.805       Lanthanum(iii) trichloride (LaCl3)
   1.312   1.475   1.326      12.424       1.067       Dibenzanthracene (SANQII)
   1.926   2.165   1.938      12.409       0.623       Chloro-bis(cyclopentadienyl)-(tetrahydrofuran)-lutetium (FATGIQ10)
   1.807   2.031   1.867      12.396       3.320       5-Nitrouracil
   3.653   4.105   4.467      12.373      22.283       Hexabromobenzene (HBRBEN02)
   1.560   1.753   1.618      12.372       3.718       7,7,14,4-Tetramethyldinaphtho-di-germanium (YIHWOB)
   1.649   1.853   1.565      12.371      -5.094       Pyridinium (h5-cyclopentadienyl)-tetrachloro-titanium (ICESEO)
   6.019   6.763   5.124      12.361     -14.870       Tellurium dioxide (TeO2) (ICSD 62897)
   1.615   1.814   1.802      12.322      11.579       Cellulose 1 alpha (ja037055wsi20030711 112804)
   1.153   1.295   0.268      12.316     -76.756       Chloro-tris(trimethylphosphine)-cobalt(i) (BUTDEZ)
   3.089   3.469   0.000      12.302    -100.000       Zinc hydroxide (Zn(OH)2)
   2.293   2.575   2.393      12.298       4.361       Zinc cyclooctaphosphate hydrate (Zn2P4O12 9(H2O))
   1.587   1.782   1.616      12.287       1.827       La Complex Sparkle (HUFQOO)
   1.132   1.271   1.190      12.279       5.124       Aqua-tris(2-((dimethylamino)methyl)phenyl)borane (QEVYEV)
   2.480   2.784   3.044      12.258      22.742       KF
   1.291   1.449   1.424      12.239      10.302       3-Hydroxy-10,10-dimethyl-11-oxatricyclododeca-4,6-dien-8-one (LIGHIV)
   2.510   2.817   3.466      12.231      38.088       Ammonium iodide (NH4I)
   2.090   2.345   3.607      12.201      72.584       Barium hydroxide octahydrate (BaO10H18)
   4.328   4.856   4.434      12.200       2.449       Barium sulfide (BaS) (ICSD 1210822)
   1.264   1.418   1.290      12.184       2.057       Sm Complex Sparkle (XAXYAW)
   1.494   1.676   1.462      12.182      -2.142       Aceclofenac hemikis(bipyridine) hydrate
   1.790   2.008   2.109      12.179      17.821       L-Argininium bromate (JAXFOE)
   1.209   1.356   1.277      12.159       5.624       1,2-bis(4-Pyridyl)ethane (ZEXKIW)
   0.658   0.738   1.890      12.158     187.234       (Hexafluoroacetylacetonato)-trimethylphosphine-silver (LEFWEY)
   1.433   1.607   1.467      12.142       2.373       L-histidinium L-histidine hydrogen glutarate (ADAVUW)
   1.368   1.534   1.354      12.135      -1.023       beta Resorcinol
   1.946   2.182   1.754      12.127      -9.866       Dichloro-(bis(h4-tetramethylcyclopentadienyl)dimethylphosphonium)-hafnium iodide (ICEHED)
   1.836   2.058   2.108      12.092      14.815       Ce Complex Sparkle (GINNUM)
   1.704   1.910   1.779      12.089       4.401       Ammonium nitrate (NH4NO3)
   1.317   1.476   1.287      12.073      -2.278       Fluoxetine hydrochloride benzoic acid
   1.251   1.402   1.369      12.070       9.432       4,5-bis(Dimethylamino)-1,8-dihydroxynaphthalene (RISBIE)
   1.235   1.384   1.094      12.065     -11.417       N-Methylacetamide hemihydrochloride -NH2-CO- (BOZGAY)
   1.447   1.621   1.540      12.025       6.427       Aspirin(II) (ACSALA13)
   1.248   1.398   1.341      12.019       7.452       Tetra-n-butylammonium h5-cyclopentadienyl-tricarbonyl-molybdenum (BATCOM)
   2.239   2.508   1.974      12.014     -11.836       bis(tris(Ethylenediamine)-cobalt(iii)) catena(bis(mu-2-chloro)-heptachloro-di-lead(ii)) chloride trihydrate (ENCOPB)
   1.675   1.876   1.836      12.000       9.612       tris(Guanidinium) difluoro-(ethylenediaminetetra-acetato)-yttrium(iii) monohydrate (JIJTIF10)
   1.292   1.447   1.521      11.997      17.724       (Tetra-azacyclotetradecane)-dichloro-diethyl-di-aluminium (JAXTUX)
   1.011   1.132   0.918      11.968      -9.199       Cyclotetradecane (CYTDEC)
   1.580   1.769   1.909      11.962      20.823       beta-D-Galactose (BDGLOS01)
   2.787   3.120   2.823      11.948       1.292       Manganese(ii) dinitrate (Mn(NO3)2) (ICSD 412003)
   1.694   1.896   1.946      11.924      14.876       Nd Complex Sparkle (NATPAZ01)
   0.916   1.025   1.054      11.900      15.066       Ice-11
   4.853   5.429   5.756      11.869      18.607       Indium tribromide (InBr3) (ICSD 65198)
   1.372   1.534   1.362      11.808      -0.729       Indomethacin
   1.790   2.001   1.772      11.788      -1.006       bis(N,N-(Dipyrrolyl-2-methyl)-N-methylamido)-hafnium(iv) dichloromethane solvate (LULCEA)
   2.688   3.004   2.848      11.756       5.952       Parahilgardite ((CaO)2(B2O3)5(Na2O)(H2O)2)
   5.856   6.543   6.906      11.732      17.930       Lead oxide hydrate (PbO2H2)
   2.392   2.672   0.838      11.706     -64.967       2,2'-Bipyridinedi-ium tetrabromo-cobalt(ii) (BPYRBC11)
   1.359   1.518   1.495      11.700      10.007       bis(Pyridine) fumaric acid (GUKWOZ)
   1.890   2.111   1.890      11.693       0.000       tetrakis(Ethylenediamine)-barium tetraselenide ethylenediamine solvate (BINDAD10)
   1.328   1.483   1.268      11.672      -4.518       bis(2-Methylamino-4-methylimino-2-pentene)-copper(ii) (TIZZAE01)
   1.705   1.904   1.980      11.672      16.129       bis(1,4,7,10,13-Pentaoxacyclopentadecane)-barium bromide dihydrate (PXCDBA)
   5.022   5.608   4.731      11.669      -5.795       Manganese(iii) oxide (Mn2O3) (ICSD 159865)
   9.989  11.153   9.370      11.653      -6.197       Mercury difluoride (HgF2)
   2.352   2.626   2.265      11.650      -3.699       Diseleno-bis(formamidinium) dichloride (SEFORC10)
   1.324   1.478   1.319      11.631      -0.378       Carbamazepine isonicotinamide (LOFKIB01)
   1.582   1.766   1.707      11.631       7.901       L-Histidinium L-aspartate monohydrate (LHLASP01)
   1.290   1.440   1.329      11.628       3.023       Chrysene (CRYSEN01)
   1.471   1.642   1.579      11.625       7.342       4-Hydroxybenzoic acid isonicotinamide (VAKTOR)
   6.762   7.547   6.319      11.609      -6.551       Lead(ii) bromide (PbBr2)
   1.499   1.673   1.557      11.608       3.869       Naphthalene pyromellitic dianhydride (NAPYMA12)
   2.439   2.722   2.618      11.603       7.339       Sulfoborite (Mg3SO4(B(OH)4)2(OH)F)
   1.251   1.396   1.215      11.591      -2.878       Anthracene (ANTCEN14)
   1.469   1.639   1.530      11.572       4.152       m-hydroxybenzoic acid (BIDLOP)
   1.478   1.649   1.591      11.570       7.645       Theophylline phthalic acid
   3.097   3.455   3.053      11.560      -1.421       Disulfur dibromide (S2Br2) (ICSD 37020)
   1.229   1.371   1.252      11.554       1.871       bis(4-Picoline-N)-tetraphenylporphyrinato-magnesium (CULXEM)
   1.301   1.451   1.293      11.530      -0.615       alpha Resorcinol
   1.536   1.713   1.716      11.523      11.719       beta-Maltose monohydrate (MALTOS11)
   2.135   2.380   1.446      11.475     -32.272       Calcium acetylide (CaC2) (ICSD 411190)
   1.325   1.477   1.351      11.472       1.962       Triphenylene (TRIPHE12)
   2.267   2.527   3.136      11.469      38.333       catena-(Ammonium bis(mu-2-oxalato)-aqua-yttrium(ii)) (AYOXLH)
   1.730   1.928   1.833      11.445       5.954       Yb Complex Sparkle (MIPTUA)
   2.641   2.943   2.603      11.435      -1.439       Sodium dichromate (Na2Cr2O7) (ICSD 2534)
   1.622   1.807   1.715      11.406       5.734       Malonic acid (MALNAC02)
   1.978   2.203   1.917      11.375      -3.084       Dimethylhafnocene (DMCPHF)
   1.847   2.057   2.094      11.370      13.373       bis(beta-Alaninium) tetrachloro-copper(ii) (BEHXIV)
   1.385   1.542   1.611      11.336      16.318       Nd Complex Sparkle (QEBJIQ)
   1.337   1.488   1.423      11.294       6.432       L-Lysine D-glutamate (JAVSII)
   0.975   1.085   1.119      11.282      14.769       trans-bis(mu-2-2,2-Dimethylhydrazido)-bis(dimethyl-aluminium) (HIMZAE)
   1.889   2.102   1.796      11.276      -4.923       Munchnone (BFAXZO)
   1.109   1.234   1.117      11.271       0.721       Lidocaine
   1.493   1.661   1.472      11.253      -1.407       Hexamminechromium(iii) hexacyanochromate(iii) (Cr(NH3)6 Cr(CN)6) (ICSD 61679)
   1.271   1.414   1.268      11.251      -0.236       Ce Complex Sparkle (SOZLUO)
   1.819   2.023   1.639      11.215      -9.896       Cyanuric acid (CYURAC12)
   6.233   6.931   4.740      11.198     -23.953       Tellurium (Te) (ICSD 96502)
   1.208   1.343   1.244      11.175       2.980       9,10-Dihydroanthracene (DITBOX)
   1.344   1.494   1.328      11.161      -1.190       Fluoxetine hydrochloride succinic acid
   1.741   1.935   1.817      11.143       4.365       bis(Cucurbit(5)uril) bis(aqua-potassium) hexachloro-platinate monohydrate clathrate hydrate (OFOMEC)
   1.636   1.818   1.659      11.125       1.406       Dinicotinic acid (DINICA10)
   1.288   1.431   1.378      11.102       6.988       Cinnamic acid (CINMAC06)
   1.300   1.444   1.337      11.077       2.846       Phenolphthalein (NIMDAO)
   1.383   1.536   1.513      11.063       9.400       4-(Dimethylamino)pyridinium hydrogen maleate (GUKVUE)
   2.207   2.451   2.315      11.056       4.894       Lu Complex Sparkle (BUVVUJ)
   3.644   4.046   2.568      11.032     -29.528       Strontium sulfide (SrS) (ICSD 651068)
   1.400   1.554   1.520      11.000       8.571       bis(Tetramethylammonium) tetrachloro-nickel (TMACNI03)
   1.584   1.758   1.734      10.985       9.470       DL-2-Amino-4-phosphonobutyric acid monohydrate (CAXDIO01)
   1.457   1.617   1.578      10.981       8.305       6-(Pyran-4-one-2-yl)-1,4-dioxocine (CUWWEW)
   1.576   1.749   1.697      10.977       7.678       beta-Cellobiose (CELLOB04)
   1.993   2.211   1.991      10.938      -0.100       Calcium potassium trisoxalato chromate(III) pentahydrate (KCaCr(III)(C2O4)3 5(H2O))
   1.140   1.264   1.228      10.877       7.719       Diethyl-magnesium 18-crown-6 clathrate (GIMNIZ)
   6.086   6.747  11.255      10.861      84.933       Lanthanum(iii) trifluoride (LaF3)
   5.081   5.632   7.457      10.844      46.762       Lanthanum phosphate (LaPO4) (ICSD 79747)
   1.642   1.820   1.788      10.840       8.892       Magnesium phosphate hydrate (Mg3(PO4)2 22(H2O))
   1.414   1.567   1.421      10.820       0.495       Tyrosine (LTYROS10)
   1.638   1.815   1.890      10.806      15.385       Bromo-tris(2-dimethylaminoethyl)amine-iron(ii) (DAEAFE)
   1.676   1.857   1.678      10.800       0.119       Tb Complex Sparkle (XEXJIT)
   1.389   1.539   1.397      10.799       0.576       4-Aminobenzoic acid (AMBNAC04)
   1.658   1.837   1.698      10.796       2.413       3,5-Dinitro-4-methylbenzoic acid (NOMBEA01)
   1.493   1.654   1.600      10.784       7.167       Ce Complex Sparkle (PEKWEH)
   1.679   1.860   1.748      10.780       4.110       Er Complex Sparkle (BOWXOA)
   1.245   1.379   1.262      10.763       1.365       Fluorene (FLUREN02)
   1.162   1.287   1.221      10.757       5.077       Caprinolactam hemihydrochloride -NH-COH- (CAPINC)
   1.358   1.504   1.400      10.751       3.093       bis((mu-2-N,N-diethylcarbamato-O,O,O')-bromo-bis(tetrahydrofuran)-magnesium) (HOYVUM)
   3.110   3.444   3.194      10.740       2.701       Dichloro-(1,2-ethanediamine)-gold(iii) nitrate (DUBNUK)
   1.686   1.867   1.805      10.735       7.058       bis(Tetra-n-butylammonium) decachloro-di-osmium(iv) (CIPTEA)
   1.528   1.692   1.539      10.733       0.720       X (HAMTIZ01)
   2.936   3.251   3.228      10.729       9.946       Calcium phosphate (Ca2P2O7) (ICSD 22225)
   1.698   1.880   1.721      10.718       1.355       Adenosine-3'-phosphate dihydrate (ADPOSD)
   1.969   2.180   2.005      10.716       1.828       Dichloro-(beta-thiodiglycol) copper(ii) (CTDGCU)
   1.401   1.551   1.548      10.707      10.493       Cinnamic acid 3-nitrobenzamide (OPUSOI)
   3.112   3.444   3.089      10.668      -0.739       Wagnerite (Mg2PO4F)
   1.187   1.313   1.308      10.615      10.194       Leucine (LEUCIN02)
   1.358   1.502   1.410      10.604       3.829       bis(Dimethyl malonato)-(pentamethyldiethylenetriamine)-strontium (OFULOQ)
   1.530   1.692   1.654      10.588       8.105       tetrakis(2,2,6,6-Tetramethylheptane-3,5-dionato)-tantalum(v) hexachlorotantalate (QAQPAA)
   1.915   2.117   2.021      10.548       5.535       Tm Complex Sparkle (NIHZUZ)
   2.925   3.233   3.103      10.530       6.085       Wollastonite (CaSiO3)
   1.182   1.306   1.336      10.491      13.029       Acetylacetone (LIWPIQ01)
   7.102   7.847   4.993      10.490     -29.696       Mercury(i) sulfate (Hg2SO4) (ICSD 15005)
   2.450   2.707   2.660      10.490       8.571       bis(1,2-Ethylenediamine-N,N')-platinum(ii) dichloride (ZZZEDM02)
   1.298   1.434   1.408      10.478       8.475       2-Methylbenzoic acid (OTOLIC02)
   2.473   2.732   2.566      10.473       3.761       Tetrapyridinium bis((mu-2-oxo)-trifluorotellurate(iv)) bis(pentafluorotellurate(iv)) (WAVZID)
   2.036   2.249   2.652      10.462      30.255       bis(Acetonitrile)(dibromo)beryllium (PACGEH)
   1.419   1.567   1.428      10.430       0.634       fac-tris(8-Hydroxyquinoline)-aluminium(iii) (WUFVAU01)
   1.276   1.409   1.318      10.423       3.292       Pyrene (PYRENE02)
   6.572   7.256   6.655      10.408       1.263       Cerussite (PbCO3)
   1.942   2.144   2.085      10.402       7.364       18-Crown-6 oxonium hexachloro-tantalum(v) (TEDYUW)
   1.298   1.433   1.404      10.401       8.166       1-diazonia-4-azabicyclo[2.2.2]octane glutarate (UNEFIC)
   1.541   1.701   1.404      10.383      -8.890       bis(15-Crown-5-sodium) difluoro-tetrachloro-zirconium(iv) ((JAVKAS)
   1.416   1.563   1.480      10.381       4.520       L-proline
   1.804   1.991   1.896      10.366       5.100       Ho Complex Sparkle (BAGBAN)
   2.162   2.386   0.000      10.361    -100.000       NaPO3 H2O
   1.321   1.457   1.382      10.295       4.618       Benzoic acid (BENZAC02)
   7.857   8.665   5.150      10.284     -34.453       Platinum(iv) disulfide (PtS2) (ICSD 41375)
   1.278   1.409   1.285      10.250       0.548       m-Aminophenol (MAMPOL02)
   1.252   1.380   1.359      10.224       8.546       o-Dimethoxybenzene (TUKGEL)
   1.937   2.135   1.954      10.222       0.878       Beryllium hydroxide (Be(OH)2) (ICSD 50445)
   3.299   3.636   3.571      10.215       8.245       tris(Guanidinium) tris(mu-2-bromo)-hexabromo-di-bismuth(iii) (ICUMUP)
   2.903   3.198   2.925      10.162       0.758       Calcium phosphate (Ca4P6O19)
   2.099   2.312   2.192      10.148       4.431       Zabuyelite Li2CO3
   1.114   1.227   1.322      10.144      18.671       Phosphatidylcholine (LYPCHL)
   2.111   2.325   2.147      10.137       1.705       Nitrato-pentakis(thiourea)-bismuth(iii) dinitrate monohydrate (CELJIM)
   1.569   1.728   1.433      10.134      -8.668       Stercorite (Na(NH4)HPO4 4(H2O))
   2.421   2.666   2.684      10.120      10.863       2,2'-Bipyridinedi-ium tetrabromo-zinc(ii) (AGEXAM)
   1.282   1.411   1.296      10.062       1.092       Silver nitrate (AgNO3)
   2.018   2.221   2.192      10.059       8.622       Diaqua-bis(malonato-O,O')-copper hexa-aqua-copper (CUMALH)
   1.452   1.598   1.456      10.055       0.275       Indometacine caffeine
   1.671   1.839   1.792      10.054       7.241       Sodium alum (NaAl(SO4)2 12(H2O))
   6.083   6.694   4.192      10.044     -31.087       Rhenium(iii) tribromide (ReBr3) (ICSD 1707233)
   1.456   1.602   1.477      10.027       1.442       5H-dibenz(b,f)azepine-5-carboxamide saccharin solvate (UNEZAO)
   1.188   1.307   1.214      10.017       2.189       Resorcinol bis(caprolactam) (QQQGHM01)
   1.438   1.582   1.493      10.014       3.825       Caffeine monohydrate (CAFINE01)
   1.139   1.253   1.249      10.009       9.658       18-Crown-6 aminosulfuric acid clathrate (SOVJOC)
   1.269   1.396   1.208      10.008      -4.807       Pyridine (PYRDNA03)
   1.360   1.496   1.360      10.000       0.000       Indomethacin nicotinamide
   5.316   5.847   6.851       9.989      28.875       Tin(ii) iodide (SnI2)
   2.883   3.170   2.732       9.955      -5.238       Hexacarbonyl-ruthenium(ii) bis(hexafluoroantimonate(v)) (LARPAW)
   1.357   1.492   1.332       9.948      -1.842       2-Hydroxybenzamide (Salicylamide)
   1.538   1.691   1.555       9.948       1.105       tris(o-((Dimethylamino)methyl)phenyl)-lutetium (CILCUV)
   1.448   1.592   1.552       9.945       7.182       Caffeine
   2.172   2.388   2.500       9.945      15.101       Lu Complex Sparkle (XECQUR)
   1.398   1.537   1.431       9.943       2.361       Succinic acid bis(urea) (VEJXAJ)
   1.610   1.770   1.643       9.938       2.050       alpha Glycine
   1.320   1.451   1.342       9.924       1.667       (Cyclopentadienyl)-(18-crown-6)-rubidium dimethoxyethane solvate (QEXTIW)
   7.398   8.132   5.265       9.922     -28.832       Thallium(i) iodide (TlI) (ICSD 61520)
   1.926   2.117   1.885       9.917      -2.129       Barium cryptate(222) tetraselenide ethylenediamine solvate (BINDEH10)
   6.731   7.395   5.776       9.865     -14.188       Palladium(ii) sulfide (PdS) (ICSD 61063)
   1.289   1.416   1.311       9.853       1.707       Hexahelicene (HEXHEL)
   1.425   1.565   1.544       9.825       8.351       Indomethacin L-proline
   1.603   1.760   1.960       9.794      22.271       Hexa-aqua-bis(2-naphthalenesulfonato-O)-yttrium(iii) 2-naphthalenesulfonate trihydrate (GAKZAT)
   2.019   2.216   2.594       9.757      28.479       Phosphoric acid (H3PO4)
   1.365   1.498   1.348       9.744      -1.245       Lu Complex Sparkle (TABCOO)
   2.330   2.557   2.783       9.742      19.442       Silicon (Si)
   1.531   1.680   1.595       9.732       4.180       La Complex Sparkle (SUZXIU)
   1.730   1.898   1.852       9.711       7.052       Er Complex Sparkle (HAGSAJ)
   2.081   2.283   2.368       9.707      13.791       cis-Diiodo-tetrakis(isopropanol)-lutetium(iii) iodide (ESECEK)
   3.494   3.833   4.384       9.702      25.472       Orpiment (As2S3)
   1.103   1.210   1.140       9.701       3.354       Hexamethylbenzene (HMBENZ04)
   1.405   1.541   1.443       9.680       2.705       Lysine aspartate (LYSASP)
   2.247   2.464   2.362       9.657       5.118       bis(Pyridinium) tetrabromo-copper(ii) (BACHIX)
   1.119   1.227   1.380       9.651      23.324       Y(III)((Me)6 Acac)3 (HAHTOZ01)
   1.485   1.628   1.542       9.630       3.838       Indomethacin saccharin
   2.660   2.916   2.065       9.624     -22.368       Sulfur hexafluoride (SF6) (ICSD 63332)
   3.062   3.356   2.960       9.602      -3.331       (Perfluoroisopropyl)oxonium (mu-2-fluoro)-bis(pentafluoro-antimonate) (GOBDEG)
  21.027  23.043   0.000       9.588    -100.000       Rhenium (Re) (ICSD 40355) hcp
   2.578   2.825   2.690       9.581       4.344       Calcium bis(dihydrogenphospate) (CaH4P2O8)
   3.009   3.297   3.098       9.571       2.958       Magnesite (MgCO3)
   1.423   1.559   1.316       9.557      -7.519       (S)-2,2,2-Trifluoro-1-(9-anthryl)ethanol (SOCLIF)
   1.395   1.528   1.414       9.534       1.362       Coronene (CORONE)
   1.376   1.507   1.464       9.520       6.395       bis(4-(Dimethylamino)pyridinium) terephthalate (GUKWAL)
   1.641   1.797   1.627       9.506      -0.853       bis(Phthalocyaninato)-lutetium(iii) dichloromethane solvate (DICBUM)
   2.094   2.293   2.204       9.503       5.253       (18-Crown-6)-rubidium tetrachloro-gold(iii) (DONYOU)
   2.357   2.580   2.534       9.461       7.510       Magnesium nitrate (Mg(NO3)2) (ICSD 381463)
   1.967   2.153   1.910       9.456      -2.898       bis(Guanidinium) difluoro-(ethylenediaminotetra-acetato)-hafnium(iv) monohydrate (ZULSEE)
   2.017   2.207   2.084       9.420       3.322       bis(Triphenylphosphonium) hexabromo-osmium(iv) (GEBMAB)
   1.434   1.569   1.469       9.414       2.441       2-Pyridone (PYRIDO04)
   2.009   2.198   2.222       9.408      10.602       Gd Complex Sparkle (PADEGA10)
   1.809   1.979   1.689       9.397      -6.633       Tetraamminecopper(ii) sulfate hydrate ([Cu(NH3)4] SO4 H2O) (ICSD 23189)
   1.470   1.608   1.461       9.388      -0.612       Nevirapine hemikis(saccharin)
   1.301   1.423   1.364       9.377       4.842       XV 2-amino-4-methylpyrimidine and 2-methylbenzoic acid
   1.717   1.878   1.824       9.377       6.232       bis(Triethyleneglycol-O,O')-manganese(ii) dibromide (BOTHIC)
   1.762   1.927   1.723       9.364      -2.213       cis-tetrakis(Triaza-tris(s-homobenzene)-N,N',N'')-lanthanum triperchlorate acetonitrile solvate (DEGDEY)
   3.093   3.382   3.979       9.344      28.645       Sodium hexafluorovanadate(iii) (Na3VF6) (ICSD 27347)
   1.735   1.897   1.654       9.337      -4.669       tris(Guanidinium) hexafluoro-gallium (BUYFOQ01)
   4.435   4.849   4.281       9.335      -3.472       Smithsonite (ZnCO3)
   2.885   3.154   2.867       9.324      -0.624       Di-iodo-dipyridine-mercury(ii) (BEJLEH)
   1.299   1.420   1.314       9.315       1.155       Anthracene photodimer (DPANTH03)
   1.882   2.057   2.028       9.299       7.758       La Complex Sparkle (HETALA11)
   1.151   1.258   0.943       9.296     -18.071       bis(2,6-bis((Dimethylphosphino)methyl)phenyl)-magnesium benzene solvate (YESVIB)
   1.560   1.705   1.666       9.295       6.795       Terephthalic acid (TEPHTH13)
   1.390   1.519   1.385       9.281      -0.360       1,3-bis(2-Furyl)azulene (GUDKAS)
   1.110   1.213   1.159       9.279       4.414       Cholesteryl acetate (CHOLAD04)
   1.715   1.874   1.913       9.271      11.545       tris(1,2-bis(Dimethoxy)ethane-O,O')-iodo-calcium iodide (ULOGAD)
   6.778   7.406  13.443       9.265      98.333       Gold(iii) fluoride (AuF3) (ICSD 16876)
   2.897   3.165   3.024       9.251       4.384       Rosenhahnite (H2Ca3Si3O10)
   6.918   7.557   7.992       9.237      15.525       Platinum(ii) bromide (PtBr2)
   1.409   1.539   1.444       9.226       2.484       o-Amino benzoic acid (AMBACO07)
   1.648   1.800   1.432       9.223     -13.107       tris(Guanidinium) hexafluoro-iron(iii) (FULHOJ)
   4.427   4.835   6.256       9.216      41.315       Germanium(ii) iodide (GeI4) (ICSD 67896)
   2.128   2.324   2.174       9.211       2.162       Ho Complex Sparkle (BUVXOF01)
   1.325   1.447   1.441       9.208       8.755       Lysine acetate (CETSOJ)
   1.687   1.842   1.785       9.188       5.809       Pr Complex Sparkles (KAWBIT)
   1.970   2.151   2.262       9.188      14.822       bis(Propane-1,3-diammonium) octachloro-di-molybdenum tetrahydrate (ZAXLIT)
   3.843   4.195   5.186       9.160      34.947       Barium bromide dihydrate (BaBr2 2(H2O)) (ICSD 33949)
   4.181   4.563   1.955       9.137     -53.241       Nickel chromate (NiCrO4) (ICSD 18116)
   1.166   1.272   1.163       9.091      -0.257       Lu Complex Sparkle (FAZDIT)
   4.833   5.272   5.962       9.083      23.360       Copper(ii) bromide (CuBr2) (ICSD 409450)
   4.162   4.540   0.000       9.082    -100.000       Cobalt carbonate(CoCO3) (ICSD 52377)
   1.719   1.875   1.791       9.075       4.188       tris((R,R)-trans-1,2-Cyclohexanediamine-N,N')-iridium(iii) trinitrate trihydrate (ZEDKIC)
   4.025   4.390   7.919       9.068      96.745       Cesium potassium lanthanum hexafluoride (Cs2KLaF6)
   2.262   2.467   2.339       9.063       3.404       Chloro-(18-crown-6)-lead hexachloroantimony (HARBOR)
   6.579   7.175  11.761       9.059      78.766       Lanthanum(iii) oxide (La2O3) (ICSD 56771)
   1.481   1.615   1.704       9.048      15.057       bis(Acetylacetonato)-oxo-vanadium(iv) (ACACVO01)
   1.471   1.604   1.548       9.041       5.235       Theophylline aspirin
   1.604   1.749   1.617       9.040       0.810       La Complex Sparkle (TEQBOG)
   2.999   3.270   1.943       9.036     -35.212       Nontronite (Fe(iii)Si2O5(OH))
   1.466   1.598   1.575       9.004       7.435       Dibromo-tetrakis(pyridine)-magnesium pyridine solvate (MGPPYD)
   1.567   1.708   1.548       8.998      -1.213       bis(mu-2-Hydroxo)-octa-aqua-di-rhodium(iii) tetrakis(mesitylsulfonate) octahydrate (VIPHAD01)
   4.002   4.362   3.370       8.996     -15.792       Lutetium(iii) trichloride (LuCl3)
   1.347   1.468   1.353       8.983       0.445       Indomethacin Lidocaine
   1.659   1.808   1.681       8.981       1.326       Tetraammine-copper(ii) bis(pyrazine-2-carboxylate) (TIBWUX)
   5.601   6.104   5.337       8.981      -4.713       Lanthanum(iii) triiodide (LaI3)
   2.940   3.204   3.132       8.980       6.531       Akermanite (Ca2MgSi2O7)
   1.381   1.505   1.448       8.979       4.852       L-Lysyl-L-glutamic acid dihydrate (VEVGOS)
   7.712   8.402   6.208       8.947     -19.502       Metacinnabar (HgS)
   1.523   1.658   1.511       8.864      -0.788       Adenosine (ADENOS11)
   1.956   2.129   2.136       8.845       9.202       Dy Complex Sparkle (CECLIF10)
   1.438   1.565   1.477       8.832       2.712       Dibromo-tetrakis(tetrahydrofuran)-calcium naphthalene solvate (NITPUC)
   1.394   1.517   1.431       8.824       2.654       4-Aminobenzoic acid 4-nitroaniline (RILJEB)
   1.885   2.051   1.913       8.806       1.485       Ice-8
   1.648   1.793   1.663       8.799       0.910       bis(2-(Ammoniomethyl)pyridinium) hexachloromanganate(ii) dihydrate (LIDQUL)
   4.763   5.182   3.354       8.797     -29.582       Rhenium(iii) trichloride (ReCl3) (ICSD 62222)
   1.639   1.783   1.763       8.786       7.566       XXI form 4 Gallic acid monohydrate
   1.447   1.574   1.583       8.777       9.399       Thymine (THYMIN01)
   1.459   1.587   1.343       8.773      -7.951       Theophylline 4-aminobenzoic acid
   1.233   1.341   1.191       8.759      -3.406       1,8-bis(tris(Dimethylamino)phosphoranylideneamino)naphthalene
   1.428   1.553   1.418       8.754      -0.700       Nevirapine
   1.854   2.016   1.649       8.738     -11.057       tris(Guanidinium) heptafluoro-zirconium (DADVIN)
   1.328   1.444   1.217       8.735      -8.358       III (QAMTAZ)
   2.808   3.053   3.491       8.725      24.323       Copper(II) bromide, tetrahydrate (CuBr2 4(H2O)) (ICSD 67555)
   1.479   1.608   1.527       8.722       3.245       1 8-Bis(methoxy)anthraquinone (APUREI01)
   1.594   1.733   1.567       8.720      -1.694       Tetra-aqua-beryllium 4-oxo-4H-pyran-2,6-dicarboxylate (CICXOC)
   0.803   0.873   0.791       8.717      -1.494       VII Propane (JAYDUI)
   1.423   1.547   1.426       8.714       0.211       Nevirapine hemikis(salicylic acid)
   1.148   1.248   1.259       8.711       9.669       XII Acrolein
   1.620   1.761   1.709       8.704       5.494       Eu Complex Sparkle (EGOBEH)
   7.615   8.277   8.639       8.693      13.447       Trilead dihydroxide dioxide (Pb3O4H2)
   1.461   1.588   1.538       8.693       5.270       Tm Complex Sparkle (TUPYUY)
   3.006   3.267   2.967       8.683      -1.297       Datolite (CaBSiO4(OH))
   1.820   1.978   2.009       8.681      10.385       Pickeringite (MgAl2(SO4)4 22(H2O))
   1.303   1.416   1.226       8.672      -5.909       Sildenafil
   1.742   1.893   1.801       8.668       3.387       Cucurbituril calcium bisulfate sulfuric acid tridecahydrate (BEBDOB)
   1.584   1.721   1.606       8.649       1.389       Dimethylgermanium dicyanide (DMCYGE)
   5.379   5.844   0.000       8.645    -100.000       Palladium(ii) bromide (PdBr2)
   1.967   2.137   2.310       8.643      17.438       Phosphoric acid hemihydrate ((H3PO4)2 H2O) (ICSD 2096)
   2.919   3.171   2.697       8.633      -7.605       (Trifluoromethylsulfonic acid-O)-pentafluoro-antimony (SOVWEF)
   4.274   4.641   5.622       8.587      31.540       Iron(iii) oxide hydroxide (FeO(OH))
   3.141   3.409   2.073       8.532     -34.002       Antimony trichloride (SbCl3) (ICSD 8258)
   3.096   3.360   2.538       8.527     -18.023       Selenic acid (H2SeO4) (ICSD 38432)
   1.736   1.884   0.342       8.525     -80.300       Lithium tetracarbonyl-cobalt (FUBYUW)
   1.443   1.566   1.502       8.524       4.089       2-(4-pyridyl)malondialdehyde sesquihydrate (GIDLIP)
   3.238   3.514   3.293       8.524       1.699       Potassium niobium chloride ((Nb6Cl12)Cl2 (KCl)4) (ICSD 41118)
   1.385   1.503   1.411       8.520       1.877       Pr Complex Sparkles (PELGOC)
   1.716   1.862   1.899       8.508      10.664       Tetra-n-butylammonium tetrabromo-indium (BEFGEY)
   1.622   1.760   1.771       8.508       9.186       Bromo-tris(2-dimethylaminoethyl)amine-manganese(ii) (DAEAMN)
   2.399   2.603   2.233       8.504      -6.920       Potassium cyclo-hexaphosphate (KPO3)
   2.578   2.797   2.630       8.495       2.017       tetrakis(Terpyridinium) bis(aqua-tetrabromo-oxo-rhenate(v)) hexabromo-rhenate(iv) tetrabromide dihydrate (MIGDUC)
   1.930   2.093   1.629       8.446     -15.596       (18-Crown-6)-rubidium tetracyano-gold(iii) (DONYUA)
   1.859   2.016   1.370       8.445     -26.304       bis(2,2,2-Crypt-potassium) dithallium-ditellurium ethylenediamine solvate (BAKYIV)
   5.679   6.157   7.857       8.417      38.352       Gold(i) iodide (AuI) (ICSD 24619)
   2.132   2.311   2.309       8.396       8.302       Telluric acid bis(glycine) monohydrate (BINFAF10)
   3.002   3.254   2.837       8.394      -5.496       Mg5Na2P4O16
   2.595   2.812   2.248       8.362     -13.372       Sodium phosphate (Na4P2O7) (ICSD 10370)
   2.375   2.573   2.785       8.337      17.263       bis(mu-2-bis(Dimethylphosphino)methane-P,P')-di-gold(i) dichloride dihydrate (DUKREG01)
   1.309   1.418   1.254       8.327      -4.202       iso-Sildenafil
   1.311   1.420   1.314       8.314       0.229       Resorcinol (RESORA03)
   1.318   1.427   1.208       8.270      -8.346       Warfarin (EFIWIZ01)
  10.115  10.951   5.170       8.265     -48.888       Hafnium(iv) dioxide (HfO2) (ICSD 27313)
   1.428   1.546   1.332       8.263      -6.723       Methyl (+-)-(1a,2b,8a,9a,10b)-2-chloro-4-aza-3-oxatetracyclo(8.4.0.02,9.04,8)tetradecane-9-carboxylate oxalic acid monohydrate (HUZKOC)
   2.888   3.126   3.736       8.241      29.363       catena-(tetrakis(Propane-1,3-diammonium) tetrakis(mu-2-bromo)-decabromo-tri-lead(ii) dihydrate) (CAKDIB)
   4.039   4.371   3.873       8.220      -4.110       Perovskite (CaTiO3)
   2.416   2.614   2.539       8.195       5.091       18-crown-6-diiodo-lead(II) (TOJPIR)
   1.734   1.876   1.784       8.189       2.884       Yb Complex Sparkle (QAXYAP)
   2.113   2.286   2.125       8.187       0.568       Dy Complex Sparkle (BUVXIZ01)
   2.513   2.718   3.447       8.158      37.167       Dicesium potassium hexacyano-iron(iii) (JIHPAR)
   1.079   1.167   1.192       8.156      10.473       Methyl-(tetramethyl-tetrazacyclotetradecane)-magnesium cyclopentadienide (FIZREM)
   1.914   2.070   0.000       8.150    -100.000       Trans Cu DiGly (IWUBEH)
   2.308   2.496   2.330       8.146       0.953       bis(Tetramethylammonium) tetrabromo-mercury(ii) (MATBHG)
   8.498   9.188   6.247       8.120     -26.489       Thallium(i) sulfide (Tl2S) (ICSD 59735)
   1.566   1.693   1.553       8.110      -0.830       XVIII (1-((4-Chlorophenyl)sulfonyl)-2-oxopropylidene)diazenium
   1.235   1.335   1.345       8.097       8.907       m-Aminopyridine (AMIPYR)
   4.929   5.328   5.122       8.095       3.916       Catena-((mu-4-Ethane-1,2-disulfonato-O,O',O'',O''')-bis(mu-3-fluoro)-di-lead(ii)) (TIQGAC)
   2.066   2.233   2.186       8.083       5.808       Calcium bis(tris(acetato) tin(ii)) (TACSNC)
   2.128   2.300   2.279       8.083       7.096       Cesium tetrakis(hexafluoroacetylacetonato)-yttrate(iii) (CYSFAC10)
   1.474   1.593   1.453       8.073      -1.425       Tris(Acetylacetonato) titanium(iv) perchlorate (TIACPC)
   1.790   1.934   1.828       8.045       2.123       Tetramethylammonium pertechnetate (DUGNEY10)
   1.529   1.652   1.507       8.044      -1.439       4,4'-Bipyridyl-racemic tartaric acid
   2.338   2.526   2.898       8.041      23.952       Potassium chlorate (KClO3) (ICSD 26409)
   1.384   1.495   1.421       8.020       2.673       bis(4-(Dimethylamino)pyridinium) fumarate fumaric acid (GUKWIT)
   1.073   1.159   1.155       8.015       7.642       m-Cresol N,N,N',N'-tetraisopropyloxamide (DUGRIG)
   7.970   8.608   4.795       8.005     -39.837       Nickel(ii) tungstate (NiWO4) (ICSD 15852)
   4.705   5.081   5.253       7.991      11.647       Chromium(iii) tribromide (CrBr3)
   2.541   2.744   2.588       7.989       1.850       catena-(tris(1,2-ethanediaminium) bis(mu-2-sulfato)-bis(mu-2-sulfato)-bis(sulfato-diaqua-di-bismuth tetrahydrate (LOHDES)
   1.828   1.974   1.915       7.987       4.759       Cucurbit(6)uril p-phenylenediammonium clathrate bis(iodide) decahydrate (JEVZAM)
   1.354   1.462   1.464       7.976       8.124       Sildenafil suberate
   2.436   2.630   2.499       7.964       2.586       Colemanite (Ca2B6O11 5(H2O))
   1.357   1.465   1.308       7.959      -3.611       Sildenafil dioxane
   2.401   2.592   2.524       7.955       5.123       mer-Tri-iodo-tripyridyl-bismuth(iii) pyridine solvate (BIMCUV)
   2.126   2.295   2.065       7.949      -2.869       Copper(ii) hexaquo dinitrate (Cu(NO3)2(H2O)6) (ICSD 1420846)
   1.888   2.038   1.821       7.945      -3.549       Sodium magnesium sulfate decahydrate
   1.113   1.201   1.222       7.907       9.793       (Z Z)-N N'-Dimethylurea (NIJHUJ)
   1.255   1.354   1.239       7.888      -1.275       4,4'-Bipyridine
   1.575   1.699   1.682       7.873       6.794       hexakis(Trimethylphosphine oxide)-yttrium(iii) tribromide (MINPUU)
   7.165   7.729   4.170       7.872     -41.800       Mercury(i) chloride (Hg2Cl2) (ICSD 65441)
   1.425   1.537   2.006       7.860      40.772       bis((mu-2-Hydroxo)-bis(h5-cyclopentadienyl)-yttrium) diphenylacetylene (GAWLEV)
   1.900   2.049   1.961       7.842       3.211       tetrakis(Thiourea-S)-tellurium(ii) bis(hydrogen difluoride) (ZZZMJK02)
   1.608   1.734   1.702       7.836       5.846       Sucrose (SUCROS01)
   1.149   1.239   1.122       7.833      -2.350       Piperazine
   2.261   2.438   2.449       7.828       8.315       catena-(hexakis(mu-2-Oxalato)-hexa-aqua-tetra-indium tetradecahydrate) (BAPMIP)
   5.935   6.399   5.906       7.818      -0.489       Germanium (Ge) (ICSD 256961) hexagonal
   1.332   1.436   1.502       7.808      12.763       Ammonium hydrogen benzoate (AMHBZO)
   2.230   2.404   2.033       7.803      -8.834       Biguanidinium hexafluoro-germanium (NEQFUL)
   1.372   1.479   1.586       7.799      15.598       N(Me)4H2PO4 H2O (FIJHEL)
   1.578   1.701   1.742       7.795      10.393       Ammonium aluminum EDTA dihydrate (WUCFIJ)
   1.695   1.827   1.527       7.788      -9.912       bis(Tetra-n-butylammonium) pentatelluride (CAHJOK)
   1.222   1.317   1.325       7.774       8.429       N N-2 6-Tetramethyl-4-nitroaniline (FOCVOI)
   1.456   1.569   1.381       7.761      -5.151       Chabazite (SiO2)
   1.668   1.797   1.851       7.734      10.971       catena-(tris(mu-2-4,4'-Bipyridine)-tetrakis(propan-1-ol)-tetra-iodo-di-barium(ii) bis(4,4'-bipyridine)) (TAQJIE)
   4.139   4.459   5.396       7.731      30.370       Silicon tetraiodide (SiI4) (ICSD 91745)
   1.464   1.577   1.487       7.719       1.571       4-Acetamidobenzoic acid
   2.167   2.334   2.470       7.707      13.982       bis(Azacyclohexadienylidene)-gold(i) chloride dihydrate (WEKKIG)
   1.824   1.964   1.965       7.675       7.730       Gd Complex Sparkle (JOPJIH01)
   1.390   1.496   1.435       7.626       3.237       Sildenafil salicylate
   1.377   1.482   1.371       7.625      -0.436       Sildenafil hemikis(oxalate)
   2.138   2.301   2.217       7.624       3.695       Tm Complex Sparkle (ICSD 39918)
   1.679   1.807   0.200       7.624     -88.088       mer-Trichloro-(N-(3-aminopropyl)-1,3-propanediamine)-cobalt(iii) (AMPRCO)
   2.733   2.941   3.200       7.611      17.087       Chloro-(1,3-dimethylimidazol-2-ylidene)-gold(i) (FIBXIY)
   2.123   2.284   2.250       7.584       5.982       tris(Guanidinium) tetrakis(peroxo)tantalum(v) (ABUNOB)
   1.556   1.674   0.147       7.584     -90.553       (Cyclopentadienyl)-(o-phenylene-diamino)-cobalt (CAFJEY)
   1.727   1.857   1.640       7.528      -5.038       Buckminsterfullerene (C60)
   1.198   1.288   1.271       7.513       6.093       NN-Dimethylbenzamide (ODOTOQ)
   2.849   3.063   3.177       7.511      11.513       Potassium trichloroniccolate(ii) (KNiCl3) (ICSD 10508)
   1.946   2.092   1.973       7.503       1.387       Trichloro-tris(urea)-molybdenum (BOHYEC)
   4.589   4.933   4.469       7.496      -2.615       Strontium iodide (SrI2)
   2.871   3.086   3.689       7.489      28.492       a,e-Diaminocapronic acid iodic acid (HIRMOK)
   2.926   3.145   2.802       7.485      -4.238       catena(bis(Methylammoninum) decaoxadigalliumtrigermanate) (FIGQIV)
   1.800   1.934   1.860       7.444       3.333       Tetrabutylammonium pentabromo-(tetrahydrothiophene)-technetate(iv) (WAJFUJ)
   1.466   1.575   1.497       7.435       2.115       Sodium (nitrilotripropionato)-beryllium(ii) trihydrate (YOMHAJ)
   1.510   1.622   1.638       7.417       8.477       2-Iodo-1,3-di-t-butyl-1,3,2-diazaphospholene (CORGAS)
   1.599   1.717   1.675       7.380       4.753       Dipyridinium bis(hydrogen-oxalate) oxalic acid (DUVLUB)
   1.966   2.111   1.701       7.375     -13.479       Tetramethylammonium chloro-pentacarbonyl-tungsten (CPECOW)
   1.614   1.733   1.383       7.373     -14.312       bis(Dimethylammonium) hexachloro-titanate (BARMAJ)
   3.708   3.981   4.674       7.362      26.052       Barytocalcite (CaCa(CO3)2)
   1.917   2.058   1.908       7.355      -0.469       p-Cycloheptatrienylium-tricarbonyl-molybdenum(0) tetrafluoroborate (CYHMOC10)
   1.593   1.710   1.889       7.345      18.581       Magnesium hypophosphite  hydrate (Mg(H2PO2)2 6(H2O))
   1.703   1.828   1.837       7.340       7.868       Sodium iron(III) EDTA trihydrate (JEPKEU)
   1.794   1.925   1.860       7.302       3.679       tetrakis(Urea) bis(dihydrogen phosphate) magnesium (BORTAD)
   1.690   1.813   1.674       7.278      -0.947       5-Nitrouracilate L-histidinium
   1.513   1.623   1.566       7.270       3.503       Bis(3,5-Dinitro-4-methylbenzoic acid) 1,2-bis(4-pyridyl)ethane (LAPTUS)
   1.322   1.418   1.324       7.262       0.151       Dibenzo(g,p)chrysene (TEBNAP)
   1.203   1.290   1.148       7.232      -4.572       4-(2,6-Dimethyl-4-N,N-diethylaminophenylimino)-3-methyl-1-phenyl-2-pyrazolin-5-one (MEPMPZ10)
   5.229   5.606   6.475       7.210      23.829       Thallium hexafluoroarsenate (TlAsF6) (ICSD 417954)
   1.431   1.534   1.568       7.198       9.574       ROY (QAXMEH04)
   2.339   2.507   2.297       7.183      -1.796       Gaylussite CaNa2(CO3)2 5(H2O)
   1.805   1.934   1.586       7.147     -12.133       Tetrakis(Acetonitrile)-palladium(ii) bis(tetrafluoroborate) (KUXSIF)
   3.016   3.231   3.806       7.129      26.194       bis(Morpholinium) bis(mu-2-bromo)-octabromo-di-selenate(iv) (RAFYUS)
   1.523   1.631   1.598       7.091       4.924       3-Carboxyphenylammonium hydrogen 2,3-pyrazinedicarboxylate dihydrate (ZIKREQ)
   1.300   1.392   1.510       7.077      16.154       p-Aminophenol (AMPHOL01)
   1.925   2.061   1.595       7.065     -17.143       bis(Trichloro-tris(dimethylsulfoxide)-technetium(iv)) hexachloro-technetate(iv) (JEPQOL)
   2.000   2.141   1.774       7.050     -11.300       bis(Tetramethylammonium) pentaselenide (ZAZCIM)
   3.395   3.634   1.986       7.040     -41.502       Copper(ii) dichloride (CuCl2)
   3.812   4.080   4.006       7.030       5.089       catena-(Di-rubidium(i) bis(mu-2-fluoro)-(mu-2-oxalato)-bis(aqua-trifluro-hafnium(iv)) dihydrate) (YEWJAL)
   1.383   1.480   1.278       7.014      -7.592       Sildenafil hydrogen fumarate trihydrate
   1.574   1.684   0.624       6.989     -60.356       Bisacetylacetonato-cobalt(ii) (LIYLIO)
   1.756   1.878   1.820       6.948       3.645       Er Complex Sparkle (DIYNII)
   1.340   1.433   1.238       6.940      -7.612       tris(Tetrabutylammonium) trans-dibromo-tetrathiocyanato-iridium(iii) (LOFKUM)
   2.311   2.471   2.393       6.923       3.548       N,N,N',N'-Tetramethylethylenediammonium tetrachloro-platinum(ii) (CULZIS)
   1.411   1.508   1.405       6.875      -0.425       VI (UJIRIO01)
   2.502   2.674   2.765       6.875      10.512       Copper(II) chloride, dihydrate (CuCl2 2(H2O)) (ICSD 15087)
   1.590   1.699   1.670       6.855       5.031       gamma Glycine
   1.795   1.918   1.686       6.852      -6.072       tetrakis(mu-2-Acetato)-bis(aqua-chromium) (CRAQAC12)
   1.854   1.981   2.040       6.850      10.032       Nd Complex Sparkle (XONYII)
   6.088   6.505   5.929       6.850      -2.612       Tin selenide (SnSe) (ICSD 52426)
   1.909   2.039   1.193       6.810     -37.507       (mu-2-Dibismuthide)-diammine-bis(18-crown-6)-di-cesium ammonia solvate (SAJROL)
   1.534   1.638   1.668       6.780       8.735       Piroxicam (BIYSEH06)
   1.727   1.844   1.866       6.775       8.049       Diaqua-(1,10-diaza-18-crown-6)-tetrafluorosuccinato-barium (MUJBEY)
   1.168   1.247   1.188       6.764       1.712       Triethylenediamine (TETDAM)
   1.628   1.738   1.609       6.757      -1.167       Saccharin
   1.661   1.773   1.737       6.743       4.576       tris(Hydroxymethyl)-methylammonium adenosine-5'-diphosphate dihydrate (HMADPH)
   1.771   1.890   1.720       6.719      -2.880       Potassium adenosine-5'-diphosphate dihydrate (KADPHD02)
   1.411   1.505   1.499       6.662       6.237       XX Benzyl-(4-(4-methyl-5-(p-tolylsulfonyl)-1,3-thiazol-2-yl)phenyl)carbamate
   2.047   2.183   1.688       6.644     -17.538       bis(Tetra-n-propylammonium) spiroundecaselenide (SOMWIA)
   1.715   1.828   1.661       6.589      -3.149       tris(2,2-Bipyridyl)-technetium(ii) bis(hexafluorophosphate) (SUDZOG)
   1.974   2.104   1.984       6.586       0.507       Tb Complex Sparkle (ZZZARD01)
   4.456   4.748   7.179       6.553      61.109       Barium hydroxide (Ba(OH)2) (ICSD 92788)
   2.139   2.279   2.334       6.545       9.116       catena-(bis(Ethane-1,2-diammonium) bis(mu-2-phosphato)-fluoro-oxo-niobium) (HEYBOD)
   2.111   2.249   2.891       6.537      36.949       catena-((mu-3-Methanol)-bis(mu-2-hydroxo)-methanol-barium methanol solvate) (GEMVOK)
   1.561   1.663   1.616       6.534       3.523       Eu Complex Sparkle (QAKWUU)
   2.791   2.973   2.823       6.521       1.147       bis(N-Methyl-2-bromothiazolidinium) hexabromoselenate (POYLAQ)
   1.721   1.833   2.207       6.508      28.239       Tri-sodium tris(dipicolinato-N,O,O')-yttrium nonahydrate (YAWPUI)
   2.245   2.391   2.227       6.503      -0.802       Portlandite (Ca(OH)2)
   1.586   1.689   1.250       6.494     -21.185       Ferrocene (FEROCE16)
   3.003   3.198   2.768       6.494      -7.826       Danburite ((CaO)(B2O3)(SiO2)2)
   0.864   0.920   0.920       6.481       6.481       (Trimethylamine)-borane (ZZZVPE02)
   2.054   2.187   2.114       6.475       2.921       Sm Complex Sparkle (BUVWUK01)
   1.222   1.301   1.316       6.465       7.692       Acetophenone (ACETPH)
   4.271   4.547   0.000       6.462    -100.000       Disodium tellurate (Na2TeO4) (ICSD 1492)
   4.430   4.716   4.302       6.456      -2.889       CsBr
   1.395   1.485   1.343       6.452      -3.728       Chesnokovite (Na2[SiO2(OH)2] 8(H2O))
   2.827   3.009   3.003       6.438       6.226       Woodhouseite CaAl3(PO4)(SO4)(OH)6
   2.024   2.154   2.198       6.423       8.597       Tm Complex Sparkle (ZZZARJ01)
   8.130   8.652   6.958       6.421     -14.416       Mercury niobate (Hg2Nb2O7) (ICSD 22226)
   1.605   1.708   1.497       6.417      -6.729       Melamine (MELAMI07)
   1.201   1.278   1.346       6.411      12.073       N-Methylurea (MEUREA)
   2.422   2.577   2.469       6.400       1.941       mer-Tribromo-tris(pyridine)-osmium(iii) (GOBBUU)
   2.019   2.148   2.032       6.389       0.644       Nd Complex Sparkle (BUVWOE01)
   2.366   2.517   2.416       6.382       2.113       trans-Di-iodo-tetrakis(pyridine)-osmium(ii) (TULHUD)
   2.701   2.873   3.636       6.368      34.617       Tetra-ammine-trans-dibromo-platinum(iv) bis(methanesulfonate) monohydrate (TARFIB)
   1.541   1.639   1.616       6.360       4.867       bis(Caffeine) oxalic acid (GANXUP)
   1.211   1.288   1.172       6.358      -3.220       Diadamantane (CONGRS)
   2.711   2.882   2.961       6.308       9.222       Chloro-(bis(2-aminoethyl)amido)-gold(iii) perchlorate (CAEAUC)
   1.960   2.083   2.094       6.276       6.837       bis(Tetramethylammonium) tetrabromo-zinc(ii) (CEKLOT01)
   1.546   1.643   1.576       6.274       1.940       NH4HCO3
   2.248   2.389   2.484       6.272      10.498       tris(Diethylammonium) hexabromo-bismuth(iii) (DEJLUZ)
   4.243   4.509   5.262       6.269      24.016       Beryllium diiodide (BeI2)
   1.737   1.845   1.797       6.218       3.454       tris(2,2'-Bipyridine)-di-iodo-strontium(ii) 2,2'-bipyridine solvate (TAQQUX)
   2.946   3.129   2.938       6.212      -0.272       Boracite (MgO)5(MgCl2)(B2O3)7
   1.777   1.887   1.995       6.190      12.268       bis(mu-2-Bromo)-bis(1,2-bis(methoxyethoxy)ethane)-di-magnesium bis(mu-2-methyl)-tetrabromo-di-magnesium (OKUTAP)
   3.217   3.416   3.232       6.186       0.466       Chlorapatite (Ca5(PO4)3Cl)
   2.047   2.173   2.177       6.155       6.351       bis(Trimethylammonium) decachlorotetracopper(ii) (MEAMCU10)
   2.031   2.156   2.236       6.155      10.094       Tribromo-(15-crown-5)-arsenic (JIGSUN)
   1.821   1.933   1.453       6.150     -20.209       Chromium potassium alum (KCr(SO4)2 12(H2O))
   1.954   2.074   2.187       6.141      11.924       bis(Dibromo-(mu-2-dimethylamido)-aluminium) (YEFVIO)
   1.468   1.558   0.688       6.131     -53.134       tris(Ethylenediamine) chromium(iii) hexacyano-cobaltate(iii) hexahydrate (ETDHCO)
   1.848   1.961   2.021       6.115       9.361       Ce Complex Sparkle (XONYAA)
   1.162   1.233   1.232       6.110       6.024       Caprinolactam hemihydrochloride -NH2-CO- (CAPINC)
   3.865   4.101   0.000       6.106    -100.000       Cobalt(ii) sulfate (CoSO4) (ICSD 33736)
   4.111   4.362   6.019       6.106      46.412       Aluminum triiodide (AlI3)
   1.429   1.516   1.446       6.088       1.190       ROY (QAXMEH05)
   1.513   1.605   1.543       6.081       1.983       Theophylline salicylic acid
   1.678   1.780   1.807       6.079       7.688       Dodecamethyl-cyclohexagermane (DOMEGE)
   1.729   1.834   1.825       6.073       5.552       (18-Crown-6)-bis(nitrato-O,O')-strontium (JAWWAF)
   1.368   1.451   1.406       6.067       2.778       1-Dimethylamino-8-dimethylammonionaphthalene saccharin dihydrate (AJOHUC)
   1.055   1.119   1.151       6.066       9.100       Benzene (BENZEN)
   2.012   2.134   2.344       6.064      16.501       Tetra-n-butylammonium tetraiodo-indate(iii) (AHOMIT)
   3.931   4.169   3.320       6.054     -15.543       Scandium(iii) tribromide (ScBr3)
   1.289   1.367   1.248       6.051      -3.181       hexakis(6-Isocyanoazulene-C)-chromium tetrafluoroborate (GUZCOT)
   1.803   1.912   2.052       6.045      13.810       Tm Complex Sparkle (TUTXOV)
   1.490   1.580   1.430       6.040      -4.027       p-Fluorobenzoic acid (PFBZAD01)
   1.612   1.709   1.654       6.017       2.605       Mellite
   1.921   2.036   2.851       5.986      48.412       Prussian blue (KFe(II)Fe(III)(CN)6)
   2.278   2.414   2.899       5.970      27.261       Nd Complex Sparkle (ICSD 37181)
   3.791   4.016   3.962       5.935       4.511       Sclarite (Zn7 (OH)10 (CO3)2)
   0.996   1.055   1.007       5.924       1.104       Cyclohexane (CYCHEX)
   2.066   2.188   2.097       5.905       1.500       Eu Complex Sparkle (BUVXAR11)
   1.729   1.831   1.522       5.899     -11.972       bis(Fulvalene-iron) (FULVFE)
   5.233   5.541   0.000       5.886    -100.000       Cadmium bromide (CdBr2)
   1.955   2.070   0.000       5.882    -100.000       Ulexite ((Na2O)(CaO)2(B2O3)5(H2O)16)
   1.549   1.640   1.484       5.875      -4.196       tris(Guanidinium) hexafluoro-scandium(iii) (HEYRUZ)
   1.806   1.912   1.666       5.869      -7.752       Cyclotrimethylene-trinitramine (RDX)
   1.452   1.537   1.475       5.854       1.584       Yb Complex Sparkle (RENXIR)
   1.676   1.774   1.794       5.847       7.041       bis((mu-2-Aqua)-hexa-aqua-calcium 5,5'-azotetrazolate) dihydrate (MINBOA)
   1.660   1.757   1.747       5.843       5.241       Maleic acid (MALIAC13)
   1.663   1.760   1.762       5.833       5.953       trans-Di-iodo-tris(methanol)-(tetramethylethylenediamine)-strontium(ii) tetramethylethylenediamine solvate (TAQPUW)
   1.373   1.452   1.428       5.754       4.006       Phenylmalondialdehyde (PROLON)
   2.000   2.115   2.027       5.750       1.350       Pr Complex Sparkles (BUVWIY01)
   1.949   2.061   1.979       5.747       1.539       tetrakis(hexahydro-pyrimido[1,2-a]pyrimidyl)-tantalum hexachloro-tantalum (EMUDAR)
   1.950   2.062   1.761       5.744      -9.692       Rubidium chromium alum (RbCr(III)(SO4)2 12(H2O))
   3.658   3.868   3.984       5.741       8.912       tris(Guanidinium) tris(mu-2-iodo)-hexaiodo-di-bismuth(iii) (LOFROO)
   2.443   2.583   0.030       5.731     -98.772       Potassium hexachlorovanadate(iv) (K2VCl6) (ICSD 1712440)
   1.589   1.680   1.598       5.727       0.566       Tb Complex Sparkle (VAPTEL01)
   1.592   1.683   1.665       5.716       4.585       Phthalic acid (PHTHAC01)
   1.804   1.907   2.036       5.710      12.860       Potassium sulfide (K2S) (ICSD 1004186)
   2.743   2.899   3.290       5.687      19.942       Magnesium aluminum phosphate oxide (beta'') (MgAlPO4 O) (ICSD 1102532)
   1.763   1.863   1.569       5.672     -11.004       Potassium alum (KAl(SO4)2 12(H2O))
   6.707   7.087   0.000       5.666    -100.000       Tungsten(iii) tribromide (WBr3)
   3.696   3.905   4.723       5.655      27.787       Tri-iodo-methyl-germanium (CUDKIV)
   1.857   1.962   1.850       5.654      -0.377       bis(mu-2-Periodato)-bis(18-crown-6)-di-rubidium (JODBUA)
   1.385   1.463   1.439       5.632       3.899       Lactic Acid (YILLAG)
   1.428   1.508   1.386       5.602      -2.941       ROY (QAXMEH)
   5.666   5.983   4.261       5.595     -24.797       Thallium(i) nitrate (TlNO3)
   1.830   1.932   2.013       5.574      10.000       trans-Diaqua-bis(methoxyacetato)-copper(ii) (CUACDH10)
   1.384   1.461   1.455       5.564       5.130       1,4-Dioxane
   1.654   1.746   1.560       5.562      -5.683       Cyanuric acid-Melamine (QACSUI)
   2.697   2.847   1.147       5.562     -57.471       fac-(1,4,7-Triazacyclononane-trichloro-iridium) (YAPGOL)
   4.417   4.662   5.410       5.547      22.481       Niobium(v) pentabromide (NbBr5) (ICSD 67298)
   1.734   1.830   1.861       5.536       7.324       Sm Complex Sparkle (QIPQOV)
   1.612   1.701   1.517       5.521      -5.893       Ferrocene (FEROCE24)
   2.085   2.200   2.148       5.516       3.022       Gd Complex Sparkle (BUVVOD01)
   1.834   1.935   1.973       5.507       7.579       Ce Complex Sparkle (TIJCIY)
   1.528   1.612   1.520       5.497      -0.524       5-Nitrouracil piperazine
   1.480   1.561   1.436       5.473      -2.973       XIX 1,8-Naphthyridinium fumarate
   1.134   1.196   1.196       5.467       5.467       N-Acetyl-L-leucine -NH-COH- (ACLLEU)
   2.615   2.757   2.501       5.430      -4.359       Langbeinite (K2Ca2(SO4)3)
   1.724   1.817   1.729       5.394       0.290       Beryllium sulfate tetrahydrate (BeSO4 4(H2O)) (ICSD 23218)
   1.891   1.993   2.174       5.394      14.966       (h5-Cyclopentadienyl)-dichloro-oxo-vanadium(v) NIRKUU)
   2.329   2.454   2.661       5.367      14.255       Bis(1,4-Diazoniabicyclo(2.2.2)octane) bis(1-aza-4-azoniabicyclo(2.2.2)octane) tetrakis(tribromide) dibromide (DAHGUO)
   3.762   3.963   7.475       5.343      98.698       Molybdenum(iii) chloride (MoCl3)
   2.005   2.112   2.046       5.337       2.045       Ho Complex Sparkle (HOESUL02)
   1.707   1.798   1.665       5.331      -2.460       5-Formato uracil (POWBAF)
   2.928   3.084   2.384       5.328     -18.579       bis(1,2-Diammonioethane) hexabromo-rhodium(iii) bromide monohydrate (ZOKHEM)
   2.951   3.108   3.418       5.320      15.825       catena-(bis(4-iodobutylammonium) bis(mu-2-iodo)-di-iodo-tin) (BIVLUO)
   3.654   3.848   3.885       5.309       6.322       Iron(ii) sulfate (FeSO4) (ICSD 23507)
   1.489   1.568   1.463       5.306      -1.746       Theophylline isonicotinamide
   1.816   1.912   2.123       5.286      16.905       Aqua-(7,16-bis(2-O-hydroxyethyl-2-oxyethyl)-1,4,10,13-tetraoxa-7,16-diazacyclo-octadecane)-barium(ii) di-iodide dihydrate (VEPMUY)
   9.372   9.867   6.948       5.282     -25.864       Bismuth oxide (Bi2O3) (ICSD 2374)
   2.595   2.732   2.490       5.279      -4.046       Rubidium dihydrogenphosphate (RbH2PO4) (250131)
   2.054   2.162   2.234       5.258       8.763       Dy Complex Sparkle (QQQEMM01)
   2.348   2.471   2.538       5.239       8.092       Dibromo-tetrakis(dimethyl sulfoxide-S)-osmium(ii) (SAWZAR)
   1.838   1.934   2.199       5.223      19.641       (18-Crown-6)-bis(perchlorato)-barium (MIFNUL)
   3.068   3.228   3.140       5.215       2.347       Telluric acid (Te(OH)6)) (ICSD 2879)
   1.669   1.756   1.683       5.213       0.839       VIII Hydantoin (PAHYON01)
   1.114   1.172   1.164       5.206       4.488       Nonactin-potassium thiocyanate (NONKCS)
   1.809   1.903   1.796       5.196      -0.719       Tetramminecopper sulfate hydrate (Cu(NH3)4 (SO4) (H2O))
   6.853   7.209   6.276       5.195      -8.420       Bismuth sulfide (Bi2S3) (ICSD 89323)
   2.664   2.802   1.983       5.180     -25.563       Titanium(iii) trichloride (TiCl3)
   1.451   1.526   1.461       5.169       0.689       Isonicotinamide 3-hydroxybenzoic acid (LUNMEM)
   1.896   1.994   1.923       5.169       1.424       meso-bis(1,4,7-Trithiacyclodecane)-ruthenium(ii) diperchlorate (TAZWOG)
   2.199   2.312   2.270       5.139       3.229       Phosphorus(iii) trioxide (P4O6) (ICSD 24407)
   1.874   1.970   1.949       5.123       4.002       4-Iodo-tetramethyl-tetra-aza-phosphaspiroheptane-2,6-dione (SAKMUM)
   2.098   2.205   2.119       5.100       1.001       Tb Complex Sparkle (BUVXEV01)
   3.281   3.448   5.136       5.090      56.538       Potassium hexafluoroarsenate (KAsF6) (ICSD 2362)
   2.222   2.335   2.317       5.086       4.275       (4,4-bipyridinedi-ium) 4,4-bipyridinium hexabromo-antimony(iii) (DOSYAM)
   3.213   3.376   1.979       5.073     -38.406       Annabergite (Ni3(AsO4)2 8(H2O))
   1.364   1.433   1.383       5.059       1.393       4-Aminophenylacetic acid (FONGUL)
   4.553   4.783   5.851       5.052      28.509       Barium chromate (BaCrO4) (ICSD 62560)
   1.903   1.999   2.027       5.045       6.516       Sm Complex Sparkle (CORKEZ)
   4.364   4.584   4.073       5.041      -6.668       Antimony(iii) bromide (SbBr3)
   3.365   3.534   2.772       5.022     -17.623       Vanadium(v) pentoxide (V2O5) (ICSD 653926)
   3.870   4.063   6.066       4.987      56.744       BaP2O6
   2.772   2.910   2.920       4.978       5.339       Tribromo-(trimethylarsane)-gallium(iii) (TINJEG)
   1.970   2.068   2.024       4.975       2.741       Nona-aqua-lanthanum tris(trifluoromethanesulfonate) (BUVVIX)
   5.950   6.245   6.389       4.958       7.378       Tin(iv) diselenide (SnSe2) (ICSD 43594)
   7.586   7.962   6.390       4.956     -15.766       Trithallium(i) phosphate (Tl3PO4)
   1.151   1.208   1.150       4.952      -0.087       Adamantane (ADAMAN08)
   4.224   4.433   6.185       4.948      46.425       Boron triiodide (BI3) (ICSD 173375)
   1.438   1.509   1.454       4.937       1.113       ROY (QAXMEH02)
   1.402   1.471   1.394       4.922      -0.571       Isonicotinamide (EHOWIH)
   1.973   2.070   2.025       4.916       2.636       tetrakis(Biuret) strontium(ii) perchlorate BIURSR)
   1.327   1.392   1.408       4.898       6.104       Oxytocin 1XY10001
   2.073   2.174   2.189       4.872       5.596       tris(Tetramethylammonium) (mu-2-bromo)-bis(dibromo-copper(i)) (CUPHEA)
   1.235   1.295   1.326       4.858       7.368       N-Methylacetamide hemihydrochloride -NH-COH- (BOZGAY)
   7.123   7.469   7.055       4.858      -0.955       Indium(iii) oxide (In2O3) (ICSD 14388)
   2.780   2.915   2.670       4.856      -3.957       Glauberite (CaNaSO4)
   1.629   1.708   1.707       4.850       4.788       Potassium tris(acetylacetonato)-cadmium(ii) monohydrate (KACCDM)
   1.797   1.884   1.881       4.841       4.674       Lu Complex Sparkle (LAWREG)
   1.435   1.504   1.369       4.808      -4.599       (15-Crown-5)-(perchlorato-O,O')-sodium (KAPDUA)
   5.016   5.257   4.211       4.805     -16.049       Otavite (CdCO3)
   1.416   1.484   1.426       4.802       0.706       Sildenafil citrate monohydrate
   2.941   3.082   2.699       4.794      -8.228       Zeise's salt - Potassium trichloroethylene platinate monohydrate (KCLEPT12)
   2.619   2.744   3.093       4.773      18.099       cis-1,2-Ethylenediamine-bis(1,2-ethylenediaminato)-osmium(iv) dibromide (BOSRUW)
   1.972   2.066   2.143       4.767       8.671       Catena benzoic acid phosphate water lanthanum(iii) complex (DEJVAQ)
   6.467   6.775   4.998       4.763     -22.715       Gallium(iii) oxide (Ga2O3) (ICSD 27431)
   2.395   2.509   2.449       4.760       2.255       bis(Dibromo-pyridine-gallium) (BAWVEA)
   1.135   1.189   1.196       4.758       5.374       Camphor (UGAHUF)
   2.383   2.495   3.080       4.700      29.249       Eu Complex Sparkle (ICSD 280528)
   2.162   2.263   2.427       4.672      12.257       bis(Hexaaqua-(benzene-1,2-disulfonato)-lutetium(iii)) benzene-1,2-disulfonate tetrahydrate (GIFBUT)
   1.734   1.815   1.788       4.671       3.114       Taurine (TAURIN05)
   1.671   1.749   1.762       4.668       5.446       Cystine (LCYSTI10)
   1.607   1.682   1.687       4.667       4.978       Uracil (URACIL)
   1.522   1.593   1.329       4.665     -12.681       1,2,3-Triaminoguanidine (FASGUB)
   1.937   2.027   1.922       4.646      -0.774       Tm Complex Sparkle (COZHII)
   1.712   1.791   1.574       4.614      -8.061       bis(Phthalocyaninato)-bismuth(iii) dichloromethane solvate (ZUWDAW)
   6.447   6.742   4.819       4.576     -25.252       Strontium tungstate (SrWO4) (ICSD 155425)
   1.424   1.489   1.460       4.565       2.528       mer-tris(8-Hydroxyquinoline)-aluminium(iii) (QATMON)
   1.896   1.982   1.603       4.536     -15.454       catena-((mu-2-4,4'-Bipyridine)-(mu-2-fluoro)-difluoro-vanadium(iii)) (UDISIK)
   1.834   1.917   1.682       4.526      -8.288       hexakis(Thiourea-S)-ruthenium(ii) bis(trifluoromethanesulfonate) (SIZZAC)
   1.595   1.667   1.678       4.514       5.204       Di-isothiocyanato-nonaoxabicyclo heptacosane)-barium dichloromethane solvate (COCLIP)
   2.020   2.111   2.020       4.505       0.000       Lithium oxide (Li2O) (ICSD 173180)
   3.001   3.136   2.649       4.499     -11.729       Tetramethylammonium tetrakis(pentafluorotelluryloxy)borate (CIGFEE)
   2.854   2.982   2.655       4.485      -6.973       Potassium oxovanadium (iv) phosphate(v) (KVPO5) (ICSD 411492)
   1.428   1.492   1.421       4.482      -0.490       Nevirapine-maleic acid
   1.364   1.425   1.389       4.472       1.833       Aspirin carbamazepine (TAZRAO)
   4.546   4.749   6.867       4.465      51.056       Barium iodate (Ba(IO3)2) (ICSD 23276)
   1.801   1.881   1.442       4.442     -19.933       catena-(bis(2-Amino-6-methylpyridine) hexakis(mu-2-chloro)-potassium-ruthenium(iii)) (SIBPOJ)
   1.804   1.884   1.845       4.435       2.273       tris((+-)-2,3-Butanediamine)-rhodium(iii) tribromide (CIFPOW)
   3.159   3.299   3.219       4.432       1.899       Hydroxylapatite (Ca5(PO4)3(OH))
   4.955   5.174   4.839       4.420      -2.341       Tellurium phosphate (Te8O10(PO4)4) (ICSD 100151)
   1.678   1.752   1.658       4.410      -1.192       hexakis(mu-2-Sulfido)-tetrakis(t-butyl-germanium) (JORPAH)
   5.089   5.313   1.330       4.402     -73.865       Silver chromate (Ag2CrO4) (ICSD 160644)
   1.323   1.381   1.384       4.384       4.611       Azuleno-azulene (COLDEM)
   3.011   3.142   3.213       4.351       6.709       catena-((18-Crown-6)-dibromo-bismuth(iii) bis(mu-2-bromo)-dibromo-bismuth(iii)) (KOZMAN)
   1.403   1.464   1.330       4.348      -5.203       Sodium hydrogen acetate
   3.202   3.341   0.000       4.341    -100.000       Fluorapatite (Ca5(PO4)3F)
   1.969   2.054   2.143       4.317       8.837       2,8-dioxo-4,6-diphenyl-4-diioda-3,5,7-trioxanonane (AHORIZ)
   2.576   2.687   2.625       4.309       1.902       bis((mu-2-Bromo)-2,2'-bipyridine-dibromo-bismuth(iii)) acetonitrile solvate (PURQAU)
   7.002   7.303   5.901       4.299     -15.724       Cassiterite (SnO2)
   1.925   2.007   2.010       4.260       4.416       Tribromo-tris(pyridine)-indium(iii) pyridine solvate (BEHWEQ)
   2.659   2.772   2.305       4.250     -13.313       bis(Mesitylene)-thallium tetrateflate-boron (FIVCOC)
   2.269   2.365   2.222       4.231      -2.071       trans-bis(Pyridinium)methane di-iodo-tetrachloro-rhenium(iv) dimethylsulfoxide solvate (NOYRUO)
   2.034   2.120   1.654       4.228     -18.682       18-Crown-6 potassium dichloroaurate(i) (MUVTAY)
   5.717   5.958   0.000       4.215    -100.000       Rhodium(iii) trifluoride (RhF3) (ICSD 62262)
   0.546   0.569   0.576       4.212       5.495       Tetradeuteromethane (ZZZWEQ14)
   2.683   2.796   2.945       4.212       9.765       bis(mu-2-Bromo)-bis(bromopyridine-copper(ii)) (BPYRCU)
   1.283   1.337   1.314       4.209       2.416       1,3-bis((Pyrid-2-ylamino)carbonyl)adamantane (RIZVOL)
   3.857   4.019   5.349       4.200      38.683       Silicon(ii) iodide (SiI2)
   1.324   1.379   1.319       4.154      -0.378       I (XULDUD01)
   8.239   8.578  44.906       4.115     445.042       Lead selenide (PbSe) (ICSD 648528)
   4.262   4.437   8.676       4.106     103.566       Iron(ii) difluoride (FeF2) (ICSD 65702)
   1.831   1.906   1.722       4.096      -5.953       tris(Ethylenediamine)-cobalt(iii) arsenate trihydrate (BIRSUO)
   1.881   1.957   1.888       4.040       0.372       1-Fluoro-2,8,9-trioxa-5-aza-1-germatricycloundecane (GAQMEQ01)
   1.512   1.573   1.572       4.034       3.968       tetrakis(Piroxicam) fumaric acid clathrate (DIKDIL)
   4.861   5.056   1.365       4.012     -71.919       Neon (Ne) (ICSD 65894)
   1.452   1.510   1.370       3.994      -5.647       3,3'-Dithienyl ketone (DTHKET)
   2.308   2.400   3.486       3.986      51.040       Barium ethylenediamine-tetra-acetate hydrate (BAEDTA)
   1.406   1.462   1.491       3.983       6.046       L-Alanine
   1.560   1.622   1.598       3.974       2.436       Berberine sulfate (CISREB)
   5.042   5.242   5.030       3.967      -0.238       Manganese(ii) oxide (MnO) (ICSD 657304)
   2.360   2.453   2.310       3.941      -2.119       18-Crown-6 hydroxonium clathrate aqua-oxo-tetrabromo-tungsten (NANQEY)
   1.430   1.486   1.463       3.916       2.308       Carbamazepine Saccharin
   1.843   1.915   0.288       3.907     -84.373       (h5-Cyclopentadienyl-carboxylic acid)-(h5-cyclopentadienyl-carboxylato)-cobalt(iii) (BOHRAR)
   2.637   2.740   2.834       3.906       7.471       catena-(Guanidinium bis(mu-2-sulfato-O,O')-diaqua-indium(iii)) (SISPOA)
   1.846   1.918   1.976       3.900       7.042       Tri-isopropyl-iodo-phosphonium iodide dichloromethane solvate (DOQVEK)
   1.336   1.388   1.345       3.892       0.674       Nevirapine 1,4-dioxane
   1.715   1.781   1.394       3.848     -18.717       18-Crown-6-bis(hexafluoro-acetylacetonato)-strontium (QUGTIW)
   1.378   1.431   1.500       3.846       8.853       Rutin (KESFOD)
   1.353   1.405   1.251       3.843      -7.539       (15-Crown-5)-(nitrato-O,O')-sodium (JAKCUT)
   4.232   4.393   6.093       3.804      43.974       Titanium(iii) bromide (TiBr3)
   1.604   1.665   1.691       3.803       5.424       Creatininium nitrate (FETNUO)
   1.474   1.530   1.526       3.799       3.528       3-Nitrobenzamide (JACYOB)
   2.670   2.771   3.771       3.783      41.236       Barium oxalate oxalic acid dihydrate (BAHOXH11)
   2.358   2.447   0.808       3.774     -65.734       (Ethylenediamine)-pyridine-trichloro-iridium(iii) (IBEFUR01)
   2.287   2.373   2.269       3.760      -0.787       hexakis(Urea)-vanadium tris(iodide) (HURVTI01)
   2.540   2.635   2.593       3.740       2.087       Trilithium dilanthanum nitrate trihydrate (ICSD 39514)
   4.885   5.066   6.221       3.705      27.349       Cadmium hydroxide (Cd(OH)2)
   5.572   5.778   2.382       3.697     -57.251       Rhodium(iii) tribromide (RhBr3) (ICSD 28245)
   3.327   3.450   3.397       3.697       2.104       Calcium silicate (Ca2SiO4) (ICSD 963)
   1.249   1.295   1.262       3.683       1.041       Naphthalene (NAPHTA32)
   1.434   1.486   1.485       3.626       3.556       (18-Crown-6-potassium) (h5-cyclopentadienyl)-(h7-heptatrienyl)-niobium (KOSMEK)
   1.499   1.553   0.113       3.602     -92.462       bis((Cyclopentadienyl)-(dimethylphosphido)-cobalt) (DAFZAL)
   1.313   1.360   1.263       3.580      -3.808       Lithium acetylide (Li2C2) (ICSD 89535)
   1.685   1.745   1.678       3.561      -0.415       Yb Complex Sparkle (QAKXIJ)
   1.435   1.486   1.400       3.554      -2.439       ROY (QAXMEH03)
   2.376   2.460   2.312       3.535      -2.694       Aluminum phosphide (AlP)
   2.293   2.374   2.472       3.532       7.806       Sulfur trioxide (SO3) (ICSD 654094)
   3.941   4.080   3.877       3.527      -1.624       Hydrozincite (Zn5(CO3)2(OH)6)
   2.865   2.965   1.188       3.490     -58.534       Ethylene-1,2-diammonium hexachloro-iridate(iv) (NAYQOU)
   1.464   1.515   1.501       3.484       2.527       m-Diaminobenzene (REDDEJ)
   1.954   2.022   0.000       3.480    -100.000       catena-(hexakis(mu-2-Methanolato)-di-sodium ditelluride) (ZOMWON)
   1.007   1.042   1.013       3.476       0.596       XI Azetidine (XATMOV)
   1.703   1.762   1.611       3.464      -5.402       (Pentamethyl-cyclopentadienyl)-tin tetrafluoroborate (PMCPSN10)
   1.382   1.429   1.472       3.401       6.512       2-(2-(3-Carboxypyridyl))-4-isopropyl-4-methyl-5-oxo-imidazole (JAZCOC01)
   2.383   2.464   2.646       3.399      11.037       Tetraphenylphosphonium acetylacetonato-tetra-iodo-osmium(iv) (NAPLEV)
   1.385   1.432   1.344       3.394      -2.960       XVI 2-Diazo-3,5-cyclohexadiene-1-one
   1.562   1.615   1.539       3.393      -1.472       Cytosine
   4.303   4.449   5.350       3.393      24.332       Cesium yttrium(iii) hexafluoride (Cs3YF6) (ICSD 19078)
   2.948   3.048   2.873       3.392      -2.544       Potassium hexachloropalladate(iv) (K2PdCl6) (ICSD 65037)
   2.039   2.108   1.679       3.384     -17.656       bis(Aminoguanidinium) hexafluoro-zirconate(iv) (KOJVAG02)
   2.575   2.662   1.952       3.379     -24.194       Sodium Hydrogen Phosphate (Na2HPO4)
   1.606   1.660   1.680       3.362       4.608       V (BOQWIN)
   4.552   4.704   6.086       3.339      33.699       Gallium triiodide (GaI3) (ICSD 413457)
   4.720   4.877   7.312       3.326      54.915       Indium triiodide (InI3) (ICSD 1251069)
   2.195   2.268   2.517       3.326      14.670       Di-iodo-pentakis(tetrahydrofuran)-yttrium(iii) tetra-iodo-bis(tetrahydrofuran)-yttrium(iii) (ERASIZ)
   2.526   2.610   3.087       3.325      22.209       tetrakis(Acetonitrile)-di-iodo-titanium tri-iodide (KADVIU)
   1.182   1.221   1.338       3.299      13.198       1,4-diazabicyclo[2.2.2]octane azelaic acid (UNEGEZ)
   1.428   1.475   1.417       3.291      -0.770       Tennis ball (ZIWSON)
   1.857   1.918   1.795       3.285      -3.339       tetrakis(mu-2-Bromo)-bis((h5-ethyltetramethyl-cyclopentadienyl)-vanadium(iii)) (NAJXUR)
   1.529   1.579   1.595       3.270       4.317       Cytosine (CYTOSM03)
   1.805   1.864   1.641       3.269      -9.086       1,3-Propylenediammonium tetrachloro-manganese(ii) (PYDAMN03)
   4.040   4.172   4.112       3.267       1.782       Sphalerite (ZnS)
   1.746   1.803   1.948       3.265      11.569       4-Fluoro-2-(phosphonomethyl)benzenesulfonic acid monohydrate (KIXQIR)
   2.145   2.215   2.167       3.263       1.026       trans Ammonium tetrabromo-bis(4-methylpyridyl)-tungsten(iii) 4-methylpyridine ammonia solvate (JEPCUC)
   1.952   2.015   1.963       3.227       0.564       Boron sulfide (B2S3) (ICSD 653676)
   1.581   1.632   0.592       3.226     -62.555       bis(diethylenetriamine)-cobalt(iii) hexacyano-cobalt(iii) dihydrate (WEQBIE)
   2.055   2.121   1.405       3.212     -31.630       Cesium iron(iii) sulfate dodecahydrate (CsFe(SO4)2 (H2O)12) (ICSD 201213)
   2.577   2.659   1.922       3.182     -25.417       Sodium hydrogen phosphate (Na2HPO4) (ICSD 81304)
   4.824   4.977   5.331       3.172      10.510       Potassium hexafluoroplatinate(iv) (K2PtF6) (ICSD 16892)
   2.560   2.641   2.938       3.164      14.766       Potassium hexachloromolybdate(III) (K3MoCl6) (ICSD 22134)
   5.720   5.900   5.923       3.147       3.549       Barium oxide (BaO)
   1.161   1.197   1.304       3.101      12.317       epsilon-Amino-n-caproic acid (AMCAPR10)
   1.682   1.734   1.643       3.092      -2.319       8-Azaguanine hydrate (AZGUAN)
   1.817   1.873   1.990       3.082       9.521       tris(1,2-Dimethoxyethane-O,O')-diiodo-strontium(ii) (FOGRUP)
   2.018   2.080   1.014       3.072     -49.752       fac-Tricarbonyl-(1,4,7-trithiacyclononane)-technetium(i) bromide (NUMRES)
   7.074   7.291   7.915       3.068      11.889       Phoenicochroite (Pb2CrO5)
   3.558   3.667   3.305       3.064      -7.111       Calcium disilicate (CaSi2O5) (ICSD 87498)
   1.279   1.318   1.296       3.049       1.329       tris(Tetraethylammonium) tris-(1,2-dicyanoethylene-1,2-dithiolato) indate(iii) (EACEIN)
   1.679   1.730   1.591       3.038      -5.241       tris(Ethane-1,2-diamine-N,N')-copper(ii) bis(trifluoroacetate) (VIWMOE)
   1.714   1.766   1.168       3.034     -31.855       Sodium tetrakis(catecholato)-hafnium(iv) hydrate (HFCATH)
   1.537   1.583   1.869       2.993      21.601       Dibromo-(N,N'-bis(2-(diethylamino)ethyl)pentane-2,4-di-iminato-N,N',N'',N''')-yttrium(iii) toluene solvate (EROZIU)
   1.647   1.696   1.654       2.975       0.425       XXI form 3 Gallic acid monohydrate
   2.067   2.128   2.277       2.951      10.160       Dibromo-(N,N,N',N'-tetramethylethylenediamine) copper(ii) (BTMECU)
   1.493   1.537   1.309       2.947     -12.324       Theophylline
   1.867   1.922   1.451       2.946     -22.282       Trityl hexakis(pentafluorophenoxy)-niobium (QINKIH)
   2.954   3.041   3.299       2.945      11.679       Tetra-acetonitrile-tri-iodo-zirconium acetonitrile-penta-iodo-zirconium (FINBAF)
   2.396   2.466   1.921       2.922     -19.825       Hexa(lithium phosphate) (Li6(P6O18)) (ICSD 1414858)
   6.226   6.404   8.419       2.859      35.223       Platinum(ii) chloride (PtCl2)
   2.191   2.253   2.042       2.830      -6.801       4,6-diphenyl-4l3,6l3-diioda-3,5,7-trioxa-2,8-dithianonane 2,2,8,8-tetraoxide (BACCUF)
   3.191   3.281   4.157       2.820      30.273       p-Phenylenediammonium tetrabromo-gold(iii) bromide monohydrate (GEVHAR)
   2.837   2.917   4.712       2.820      66.091       Potassium yttrium(iii) hexafluoride (K3YF6) (ICSD 416296)
   3.266   3.358   0.000       2.817    -100.000       Thortveitite (Sc2Si2O7)
   1.638   1.684   1.598       2.808      -2.442       Gd Complex Sparkle (YUWZOF)
   6.387   6.566   6.185       2.803      -3.163       Cadmium fluoride (CdF2)
   1.858   1.910   1.660       2.799     -10.657       1,3,5-Trinitro-1,3,5-triazacyclohexane (CTMTNA03)
   2.430   2.498   2.116       2.798     -12.922       Lithium chromate (Li2CrO4) (ICSD 1972)
   5.224   5.370   1.344       2.795     -74.273       Boron arsenide (BAs)-Sphalerite
   2.024   2.080   2.364       2.767      16.798       Oxonium aqua-tetrabromo-oxo-molybdenum 18-crown-6 (KUZTII)
   4.157   4.272   4.145       2.766      -0.289       Zirconium(iv) tetrabromide (ZrBr4) (ICSD 1301292)
  12.364  12.705   1.601       2.758     -87.051       Ruthenium (Ru) (ICSD 650571) hcp
   5.882   6.044   7.564       2.754      28.596       Palladium(ii) iodide (PdI2)
   2.001   2.056   2.096       2.749       4.748       Sulfuric acid hydrate (H2SO4 (H2O)) (ICSD 1413417)
   1.827   1.877   1.859       2.737       1.752       Keggin (PIJFUJ)
   1.178   1.210   1.283       2.716       8.913       Ice-3
   1.888   1.939   1.261       2.701     -33.210       Sodium hydrogen arsenate heptahydrate (Na2HAsO4 7(H2O))
   5.074   5.211   4.350       2.700     -14.269       Keggin Dodecatungstophosphoric acid hexahydrate ((H5 O2)3 P W12 O40)
   1.374   1.411   1.310       2.693      -4.658       Methionine (LMETON02)
   1.767   1.814   1.691       2.660      -4.301       Mordenite (AlNaO2)(SiO2)11)
   3.659   3.756   5.425       2.651      48.265       Germanium(ii) fluoride (GeF2)
   2.377   2.440   2.276       2.650      -4.249       Apophyllite ((CaO)4 (SiO2)8 (H2O)8 KF)
   2.207   2.265   1.695       2.628     -23.199       Cesium tetramethylindate (CMEIND)
   1.509   1.548   1.620       2.584       7.356       (mu-2-2,6-bis(h5-Cyclopentadienylmethyl)pyridine)-bis(2,6-bis(h5-cyclopentadienylmethyl)pyridine-N)-di-yttrium dichloromethane solvate (CAWQAT)
   1.240   1.272   1.246       2.581       0.484       La Complex Sparkle (HINKAQ)
   2.560   2.626   2.888       2.578      12.812       K3MoCl6
   2.095   2.149   0.377       2.578     -82.005       Di-iodo-nitrosyl-bis(trimethylphosphine)-cobalt (FALTAN)
   3.067   3.146   3.724       2.576      21.422       Dimethylammonium hexabromo-rhenium (COJYAB)
   4.639   4.758   7.778       2.565      67.665       Hydrogen iodate (HIO3) (ICSD 66643)
   1.371   1.406   1.294       2.553      -5.616       Nevirapine-Glutaric acid
   2.169   2.224   2.171       2.536       0.092       bis(Pentamethylcyclopentadienyl)stibocenium tetraiodoaluminium (GOMMEA)
   2.182   2.237   2.383       2.521       9.212       bis(Tetra-n-butyl-ammonium) bis(mu-2-bromo)-octabromo-di-osmium (COZZIA)
   2.476   2.538   2.655       2.504       7.229       18-crown-6-di-iodo-mercury(ii) (DENZUR01)
   2.816   2.886   3.126       2.486      11.009       Lithium hexafluoroaluminate (Li3AlF6) (ICSD 34672)
   2.378   2.437   2.249       2.481      -5.425       Fluorapophyllite (KCa4Si8O20 8(H2O)
   2.562   2.624   2.915       2.420      13.778       Tetrabromo-(1,2-bis(dimethylamino)ethane)-germanium(iv) (DITCUF)
   1.992   2.040   2.221       2.410      11.496       Sylvite (KCl)
   4.201   4.302   2.695       2.404     -35.849       Dodecahydroxo-dodecatungstate henicosahydrate (W4O21H18)
   3.517   3.601   3.488       2.388      -0.825       Titanite (CaTiSiO5)
   1.636   1.675   1.780       2.384       8.802       Cellulose 1 beta (ja0257319 s1)
   2.164   2.215   1.629       2.357     -24.723       Halite (NaCl)
   4.762   4.874   5.219       2.352       9.597       Cadmium sulfate (CdSO4) (ICSD 100317)
   8.171   8.359   7.296       2.301     -10.709       Cinnabar (HgS)
   2.481   2.538   2.637       2.297       6.288       bis(4-Cyano-1-methylpyridinium) tetraiodo-zincate (FEYLOL)
   1.344   1.374   1.452       2.232       8.036       18-Crown-6 tetra-aqua-bis(isothiocyanato)-magnesium (FUYCAD)
   2.289   2.340   2.336       2.228       2.053       18-Crown-6-dibromo-mercury(II) (POLKEG)
   5.325   5.443   5.356       2.216       0.582       Germanium (Ge) (ICSD 636535) cubic
   1.447   1.479   1.474       2.211       1.866       ROY (QAXMEH01)
   4.942   5.051   4.667       2.206      -5.565       Tin (ii) bromide (SnBr2)
   3.547   3.625   3.173       2.199     -10.544       Potassium hexachloroplatinate(iv) (K2PtCl6) (ICSD 68765)
   1.335   1.364   0.192       2.172     -85.618       bis(Pentamethyl-cyclopentadienyl)-di-cobalt (VOGKEH)
   2.723   2.782   2.254       2.167     -17.224       Titanium oxide sulfate hydrate (TiO(SO4)(H2O))
   4.819   4.922   4.563       2.137      -5.312       Iron(ii) orthosilicate (Fe2SiO4) (ICSD 41003)
   1.133   1.157   1.299       2.118      14.651       Caprolactam (CAPLAC)
   3.180   3.247   5.783       2.107      81.855       Aluminum trifluoride (AlF3)
   1.285   1.312   1.294       2.101       0.700       NN-Dimethylurea (WIFKEB)
   4.617   4.713   5.295       2.079      14.685       Yttrium(iii) triiodide (YI3) (ICSD 170773)
   4.063   4.146   6.432       2.043      58.307       Potassium hexafluorothallate(iii) (K3TlF6) (ICSD 19068)
   5.588   5.702   2.757       2.040     -50.662       Iridium(iii) trichloride (IrCl3) (ICSD 25716)
   1.134   1.157   1.275       2.028      12.434       N-Acetyl-L-leucine -NH2-CO- (ACLLEU)
   1.297   1.323   1.321       2.005       1.850       2-Amino-4-methylpyrimidine (XAQNUZ)
   3.460   3.529   3.479       1.994       0.549       LiBr
   5.022   5.122   2.110       1.991     -57.985       Vanadium(iii) oxide (V2O3) (ICSD 201106)
   1.992   2.031   2.204       1.958      10.643       Acetonitrile)-(tris((2-pyrazinyl)methyl)amine)-tri-iodo-lanthanum(iii) acetonitrile solvate (EFUBAI)
   2.763   2.817   2.843       1.954       2.895       Polyhalite (K2Ca2Mg(SO4)4 2(H2O))
   1.713   1.746   1.350       1.926     -21.191       Borax (Na2B4O7 10(H2O))
   4.526   4.612   4.842       1.900       6.982       Strontium phosphate (Sr3(PO4)2) (ICSD 410784)
   1.289   1.313   1.265       1.862      -1.862       o-Aminophenol (AMPHOM02)
   1.998   2.035   1.871       1.852      -6.356       bis(15-Crown-5)-rubidium tetrabromo-thallium (HEWNAY)
   2.488   2.534   2.175       1.849     -12.580       Copper ammine nitrate (Cu(NH3)(NO3)2) (ICSD 78922)
   1.861   1.895   2.001       1.827       7.523       bis(Tetramethylammonium) tetrabromo-manganese (VANPEF01)
   1.221   1.243   1.117       1.802      -8.518       bis(mu-2-N,N',N',N''-Tetraisopropylguanidinato-N,N,N'',N'')-bis(h5-pentamethyl-cyclopentadienyl)-di-barium benzene solvate (YOBKEG)
   2.650   2.697   2.225       1.774     -16.038       Sodium potassium trimetaphosphate (Na2KP3O9)
   1.882   1.915   1.568       1.753     -16.684       Potassium 18-crown-6 tris(perfluorophenylthiolato)-isothiocyanato-bismuth(iii) (YULBEM)
   1.916   1.949   2.035       1.722       6.211       tris(Glycinato-N,O)-cobalt(iii) (SEZMEQ)
   7.811   7.943   6.796       1.690     -12.994       Zinc tungstate (ZnWO4)
   1.965   1.998   0.619       1.679     -68.499       Fluorine (F2) (ICSD 22271)
   1.991   2.024   1.339       1.657     -32.747       bis(Pyridine-2,6-dicarboxylato)-silver(ii) monohydrate (PYRCAG)
   2.537   2.578   2.238       1.616     -11.786       Beta quartz (SiO2)
   1.922   1.953   0.959       1.613     -50.104       Fluorine (F2) (ICSD 16262) orthorhombic
   3.786   3.846   4.694       1.585      23.983       Methyltri-iodophosphonium iodide (HEDGIG)
   1.579   1.604   1.648       1.583       4.370       Nicotinamide adenine dinucleotide tetrahydrate (CEVYEH11)
   1.959   1.990   2.027       1.582       3.471       p-Bromobenzoic acid (BRBZAP01)
   2.294   2.330   2.649       1.569      15.475       tetrakis(Acetonitrile-N)-tribromo-zirconium (acetonitrile-N)-pentabromo-zirconium acetonitrile solvate (FINBEJ10)
   2.964   3.009   2.811       1.518      -5.162       Iron hexachlorozirconate (FeZrCl6) (ICSD 39666)
   2.372   2.408   2.290       1.518      -3.457       Beryllium sulfide (BeS) (ICSD 616412)
   1.680   1.705   0.506       1.488     -69.881       Tetrathiacyclotetradecane-S,S',S'',S''')-rhodium(i) chloride acetonitrile solvate (DAHHEZ)
   3.650   3.704   2.623       1.479     -28.137       Hexacarbonyl-rhenium(i) (mu-2-fluoro)-bis(pentafluoro-rhenium(v)) (FUZJOZ)
   1.828   1.855   1.929       1.477       5.525       Dibromo-bis(dimethyl sulfide)-beryllium (YEQWUN)
   2.692   2.731   3.010       1.449      11.813       catena-((mu-6-Ethylenediphosphonato)-trans-bis(mu-2-fluoro)-diaqua-di-gallium monohydrate) (XUWVEQ)
   1.384   1.404   1.286       1.445      -7.081       (2,2'-(1,3-dithiapropane-1,3-diyl)bis(6-t-butyl-4-methylphenolato))-bis(tetrahydrofuran)-((trimethylsilyl)methyl)-lutetium tetrahydrofuran solvate (JOJQAB)
   2.634   2.672   2.763       1.443       4.897       bis(Tetramethylammonium) tetraiodo-mercury (JOKHIA)
   2.357   2.391   2.576       1.443       9.291       catena-(Imidazolium potassium bis(mu-2-oxalato)-cadmium) (MAZYER)
   3.277   3.324   3.809       1.434      16.234       Copper(ii) tetrammine duo-diiodide (Cu(NH3)4I2) (ICSD 4072)
   1.345   1.364   1.416       1.413       5.279       1,3-bis((Pyrid-2-ylamino)carbonyl)adamantane a-ketoglutaric acid (RIZWUS)
   1.911   1.937   1.921       1.361       0.523       tetrakis(mu-2-Acetato)-bis(aqua-copper(ii)) (CUAQAC)
   1.412   1.431   1.338       1.346      -5.241       2,2'-Dithenyl (DTENYL)
   1.898   1.923   1.369       1.317     -27.871       (15-Crown-5)-trichloro-lanthanum(iii) (YICCES)
   4.713   4.775   4.324       1.316      -8.254       Cesium oxide (Cs2O) (ICSD 27919)
   3.135   3.176   0.000       1.308    -100.000       Erythrite (Co3(AsO4)2 8(H2O))
   4.090   4.143   3.118       1.296     -23.765       Sodium plumbate (Na6PbO4) (ICSD 21059)
   2.411   2.442   1.608       1.286     -33.306       Sodium oxide (Na2O) (ICSD 1102678)
   1.795   1.818   1.986       1.281      10.641       Aluminite (Al2SO6 9(H2O))
   1.422   1.440   1.434       1.266       0.844       tetrakis((mu-3-Bromo)-triethylamino-copper) (DEWKEV)
  13.224  13.384   5.790       1.210     -56.216       Hafnium (Hf) (ICSD 53022) hcp
   2.259   2.286   1.486       1.195     -34.219       Tetra-n-propylammonium dicarbonyl-tetraiodo-rhodium(iii) (PRAIRH)
   5.039   5.097   4.506       1.151     -10.577       ZrW2O8
   3.391   3.429   3.365       1.121      -0.767       Hardystonite ((CaO)2(ZnO)(SiO2)2)
   1.560   1.577   1.428       1.090      -8.462       Gd Complex Sparkle (OBUJIE)
   2.058   2.080   2.310       1.069      12.245       bis(Tetra-n-butylammonium) bis(tetrabromo-osmium(iii)) (DUGLIA)
   9.808   9.910   6.746       1.040     -31.219       Bismuth (Bi) (ICSD 64703) hexagonal
   2.104   2.125   1.830       0.998     -13.023       Trithia-tetraphosphatricycloheptane (ZEGSUZ01)
   3.280   3.312   3.305       0.976       0.762       Diopside (MgCaSi2O6)
   2.908   2.936   3.123       0.963       7.393       Prehnite (CaO)2(Al2O3)(SiO2)3(H2O)
   1.357   1.370   1.357       0.958       0.000       Yb Complex Sparkle (YIZHUK)
   4.396   4.438   5.850       0.955      33.076       Carbon tetraiodide (ZZZKDW01)
   2.652   2.677   3.098       0.943      16.817       bis(mu-2-Isopropylthio-S,S)-tetraiodo-di-gallium (DIGZAU)
   3.324   3.355   3.626       0.933       9.085       catena-[heptakis(Ethylene-1,2-diammonium) bis(oxalate) hexakis(mu-2-iodo)-dodecaiodo-tetra-lead tetrahydrate] (CEWCEN)
   1.933   1.951   2.137       0.931      10.554       bis(N,N,N',N'-Tetramethylguanidinium) tetrabromo-nickel (CEPXIF)
   1.652   1.667   1.097       0.908     -33.596       Ethylenediammonium ethylenediamine-tetrafluoro-chromium(iii) chloride (DIYFEW)
   2.655   2.679   2.884       0.904       8.625       Tetraethylammonium tetrabromo-di-mu-bromo-diplatinum(ii) (ETABPT01)
   2.133   2.152   2.186       0.891       2.485       catena-(Di-n-propylammonium tris(mu-3-sulfido)-heptakis(mu-2-sulfido)-mercapto-hexa-indium) (JIWQUB)
   5.543   5.592   2.249       0.884     -59.426       Cobalt(ii) diiodide (CoI2) (ICSD 557169)
   1.473   1.486   1.494       0.883       1.426       ROY (QAXMEH12)
   2.780   2.804   2.329       0.863     -16.223       NaF
   2.806   2.830   2.660       0.855      -5.203       Raadeite (Mg7(PO4)2(OH)8)
   3.884   3.916   4.269       0.824       9.912       Magnesium dibromide (MgBr2)
   1.357   1.368   1.357       0.811       0.000       Yb ComplexSparkle (YIZHUK)
   2.842   2.865   4.265       0.809      50.070       Aminoguanidinium hexa-bromo-copper(ii) (TIVJEN)
   1.368   1.379   1.328       0.804      -2.924       (18-Crown-6)-potassium bis(Chloro-(2,3,4,5-tetramethylphospholyl-P)-indium) (JEZDUN)
   2.760   2.782   2.835       0.797       2.717       mer-Tri-iodo-tris(pyridine)-osmium(iii) (GOBCAB)
   7.815   7.876  12.295       0.781      57.326       Gold(i) chloride (AuCl) (ICSD 6052)
   2.517   2.536   2.664       0.755       5.840       catena-(Potassium (mu-4-2-ethylimidazole-4,5-dicarboxylato)-cadmium(ii)) (KOLXAL)
   5.059   5.097   3.486       0.751     -31.093       Iron dichromate (FeCr2O4) (ICSD 171121)
   3.070   3.093   3.522       0.749      14.723       Potassium perbromate KBrO4) (ICSD 15222)
   2.601   2.620   0.949       0.730     -63.514       Oldhamite (CaS)
   5.355   5.394   8.051       0.728      50.345       Iron(ii) diiodide (FeI2)
   4.697   4.731   4.150       0.724     -11.646       Scandium(iii) triiodide (ScI3)
   1.520   1.531   1.153       0.724     -24.145       Potassium hydroxide tetrahydrate (KOH 4(H2O)) (ICSD 36598)
   2.650   2.669   2.290       0.717     -13.585       Disodium potassium cyclo-triphosphate (Na2KP3O9) (ICSD 2346)
   3.842   3.869   4.813       0.703      25.273       Ammonium triiodide (NH4I3) (ICSD 2110220)
   1.579   1.590   1.563       0.697      -1.013       Ho Complex Sparkle (ECOJEL)
   1.618   1.629   1.646       0.680       1.731       (Diethyl ether)-lithium heptamethyl-tungsten (RETNEJ)
   4.125   4.153   4.029       0.679      -2.327       Wurtzite (ZnS)
   4.019   4.045   1.020       0.647     -74.621       Xenon trifluoride (Xe2F6) (ICSD 18128)
   4.019   4.045   1.020       0.647     -74.621       Xenon(II) xenon(IV) fluoride (XeF2XeF4) (ICSD 18128)
   2.428   2.443   2.534       0.618       4.366       Tricarbonyl-(h5-(2-(trimethylammonio)ethyl)cyclopentadienyl)-iodo-tungsten(ii) iodide (LIMZIR)
   1.946   1.958   1.991       0.617       2.312       Betainium hexafluoro-tantalum(iv) dihydrate (CEYCEO)
   3.289   3.309   3.152       0.608      -4.165       Lithium niobium chloride ((Nb6Cl12)Cl2 (LiCl)2) (ICSD 50232)
   2.664   2.679   3.196       0.563      19.970       bis(Dimethylammonium) hexabromo-tin(iv) (BUJPUR)
   3.733   3.754   1.546       0.563     -58.586       Aluminum arsenide (AlAs)
   1.457   1.465   1.020       0.549     -29.993       Sodium Acetate Trihydrate (NAACET06)
   4.613   4.638   4.441       0.542      -3.729       Zirconium(iv) tetrafluoride (ZrF4)
   2.593   2.607   3.071       0.540      18.434       Variscite (AlPO4(H2O)2)
   1.685   1.694   0.886       0.534     -47.418       Hexamminecobalt(iii) hexacyanocobaltate(iii) (Co(NH3)6 Co(CN)6) (ICSD 2560)
   5.687   5.715   0.288       0.492     -94.936       Silver(i) iodide (AgI)
   2.711   2.723   3.179       0.443      17.263       Potassium hexafluorosilicate (K2SiF6) (ICSD 73722)
   3.013   3.026   2.804       0.431      -6.937       Beryllium oxide (BeO) (ICSD 391224)
  10.477  10.515   6.537       0.363     -37.606       Thallium(i) oxide(Tl2O) (ICSD 77699)
   2.235   2.243   3.152       0.358      41.029       Osmocene (Os(Cp)2) (SINWER)
   2.827   2.837   3.049       0.354       7.853       bis(Thiourea)-gold(i) chloride (AFAWUZ)
   2.428   2.436   2.347       0.329      -3.336       7-Methyl-1,3,5-triarsa-2,4,9-trithia-adamantane (MARSTA)
   2.237   2.244   2.019       0.313      -9.745       Ethylenediammonium bis(mu-2-fluoro)-decafluoro-di-zirconium (ENFZRA10)
   2.629   2.637   2.472       0.304      -5.972       Beryl ((Al2O3)(BeO)3(SiO2)6)
   1.682   1.687   0.000       0.297    -100.000       Disodium hydrogen orthophosphate heptahydrate (H15Na2O11P)
   5.318   5.333   5.298       0.282      -0.376       Gallium arsenide (GaAs)
   1.450   1.454   1.410       0.276      -2.759       (2)-(bis(1,5-naphtho)-38-crown-10)-(N,N'-bis-(3-carboxypropyl)-4,4'-bipyridinium)-pseudorotaxane bis(hexafluorophosphate) (LEZZAS)
   8.116   8.138   6.180       0.271     -23.854       Bismuth oxide bromide (BiOBr) (ICSD 61225)
   4.451   4.463   4.451       0.270       0.000       Adamite (Zn2(AsO4)(OH))
   0.780   0.782   1.021       0.256      30.897       BH3NH3
   1.957   1.962   1.897       0.255      -3.066       Polymeric tris-acetone sodium di-iodide [Na(C3H6O)3I2]n (GADMOO) (2,2,4)
   1.992   1.997   2.521       0.251      26.556       catena-(1,3-Propanediammonium (mu-2-fluoro)-bis(mu-2-hydrogen phosphato)-gallium) (EDEPOS)
   2.454   2.460   2.236       0.244      -8.883       Tribromo-nitrosyl-diethylsulfido-(diethylsulfoxide-O)-osmium(ii) (SOGYAO)
   3.461   3.469   6.003       0.231      73.447       Titanium(iii) fluoride (TiF3)
   1.334   1.337   1.275       0.225      -4.423       Picrato-valinomycin-cesium (DOWDAU)
   1.368   1.371   1.372       0.219       0.292       2-Hydroxybenzamide 4-acetoamidobenzoic acid
   1.842   1.846   1.685       0.217      -8.523       Glycerol trinitrate (CORYIR)
   3.196   3.202   2.858       0.188     -10.576       Diselenium(ii) chloride (Se2Cl2)
   1.789   1.792   2.002       0.168      11.906       Disodium adenosine-triphosphate trihydrate (ADENTP)
   1.439   1.441   1.582       0.139       9.937       Tetramethyl-tetra-aza-diphosphabicyclooctane-3,7-dione (BAMWUH)
   1.538   1.540   1.035       0.130     -32.705       Guanidinium trans-tetrafluoro-bis(pyridine-N)-chromium(iii) (PUXPUT)
   1.077   1.078   1.208       0.093      12.163       ((N-Methyl-N-(nitroso-O')-hydroxylamido-O)-dimethyl-aluminium-O')-trimethyl-aluminium (ALMEAL)
   2.644   2.646   2.464       0.076      -6.808       Emerald ((Al2O3)(BeO)3(SiO2)6)
   1.435   1.436   1.405       0.070      -2.091       bis(1,4-bis(1-Azonia-3-azacyclohexen-2-yl)benzene) hexacyano-ruthenium(ii) octahydrate (WUGSEW01)
   4.341   4.344   4.683       0.069       7.878       Potassium niobium bromide ((Nb6Br12)Br2 (KBr)4) (ICSD 49667)
   1.819   1.820   2.162       0.055      18.857       Aqua-(1,4,7,10-tetrathiacyclododecane)-copper(ii) diperchlorate (CEFXAM)
   5.793   5.795   5.613       0.035      -3.107       Dy Complex Sparkle (ICSD 200095)
   3.041   3.042   2.976       0.033      -2.137       Glitter (C)
   6.063   6.064   4.968       0.016     -18.060       Arkelite (ZrO2)
   0.216   0.216   0.216       0.000       0.000       Helium (He) (ICSD 44396)
   1.469   1.469   1.458       0.000      -0.749       m-Hydroxybenzoic acid (BIDLOP01)
   3.200   3.200   3.124       0.000      -2.375       Forsterite (Mg2SiO4)
   0.859   0.859   1.523       0.000      77.299       Potassium (K) (ICSD 44670)
   3.484   3.484   3.228       0.000      -7.348       Hemimorphite (H2Zn2SiO5)
   2.595   2.595   3.616       0.000      39.345       Strontium (Sr) fcc (ICSD 44721)
   6.200   6.200   9.155       0.000      47.661       Cadmium telluride (CdTe)
   8.938   8.938  10.237       0.000      14.533       Lead oxide (Pb3O4) (ICSD 4106)
   4.259   4.258   3.929      -0.023      -7.748       Willemite (Zn2SiO4)
   3.542   3.541   5.448      -0.028      53.811       Barium nitrite (Ba(NO2)2) (ICSD 29510)
   3.404   3.403   6.038      -0.029      77.380       Potassium hexafluoroantimonate (KSbF6) (ICSD 632)
   2.027   2.026   1.506      -0.049     -25.703       Ammonium bis(1,2-dicyanoethylene-1,2-dithiolato-S,S')-palladium monohydrate (SAHFOW)
   1.737   1.736   0.673      -0.058     -61.255       Magnesium (Mg) hcp (ICSD 76748)
   1.338   1.337   1.444      -0.075       7.922       IV (BOQQUT01)
   2.593   2.591   2.285      -0.077     -11.878       Chloro-osmocenium hexafluorophosphate (WEHLEA)
   3.457   3.454   3.397      -0.087      -1.736       bct-Carbon P=20Gp (C)
   2.228   2.226   2.318      -0.090       4.039       Tri-sodium hexakis(formato-O)-molybdenum(iii) (GICNAH)
   3.309   3.306   5.694      -0.091      72.076       Potassium iodate (triclinic) (KIO3) (ICSD 20198)
   4.298   4.294   5.568      -0.093      29.549       Iodoform (CHI3) (IODOFO)
   2.125   2.123   2.189      -0.094       3.012       Dicarbonyl-iodo-methyl-bis(trimethylphosphine)-osmium (SUJVOI)
   1.992   1.990   1.831      -0.100      -8.082       Trimethylenediamine-dioxo-technetium(v) iodide monohydrate (NIPRIN)
   2.175   2.172   2.297      -0.138       5.609       18-Crown-6-dibromo-lead(ii) (RUMQEV)
   1.258   1.256   1.214      -0.159      -3.498       bis(Triethylammonium) dioxonium octacyano-molybdenum(iv) (TEAMOC)
   2.181   2.177   2.322      -0.183       6.465       Tetraethylammonium cis-tetrachlorodifluoroosmate(v) (CAXSAV)
   1.615   1.612   0.963      -0.186     -40.372       bis(2-Thio-6-picoline N-oxide)-copper(ii) (CAQCAY)
  11.195  11.171   7.024      -0.214     -37.258       Mercury oxide (HgO) (ICSD 15890)
   1.319   1.316   1.374      -0.227       4.170       Tetramethyl diphosphine disulfide (TMDPDS)
   3.365   3.357   3.303      -0.238      -1.842       bct-Carbon (C)
   4.600   4.589   3.418      -0.239     -25.696       Manganese titanate (MnTiO3) (ICSD 60006)
   2.874   2.867   2.791      -0.244      -2.888       Cummingtonite ((MgO)7(SiO2)8(H2O))
   5.670   5.655   5.935      -0.265       4.674       Indium arsenide (InAs)
   1.875   1.869   1.210      -0.320     -35.467       bis(2-(Aminomethyl)pyridine-N,N')-silver(i) perchlorate (RAWTIT)
   4.298   4.284   6.301      -0.326      46.603       Dibarium Magnesium Phosphate (Ba2MgP2O8)
   2.921   2.911   2.557      -0.342     -12.461       Coesite (SiO2)
   3.516   3.503   3.440      -0.370      -2.162       Diamond (C)
   4.188   4.172   4.185      -0.382      -0.072       Tm Complex Sparkle (ICSD 69336)
   4.433   4.416   5.630      -0.383      27.002       Barium hexafluorosilicate (BaSiF6) (ICSD 201510)
   1.026   1.022   1.054      -0.390       2.729       Nitrogen (N2) (ICSD 15472)
   1.975   1.967   2.228      -0.405      12.810       Bromo-(15-crown-5)-triaqua-barium bromide monohydrate (LIFDAG)
   2.963   2.950   2.670      -0.439      -9.889       Oxonium hexafluoroarsenate(V) (AsF6 (H3O)) (ICSD 61236)
   5.651   5.626   1.303      -0.442     -76.942       Iridium(iii) trichloride (IrCl3) (ICSD 23171)
   1.544   1.537   1.459      -0.453      -5.505       Mo(IV)(CN)8 (PYCMOA)
   1.446   1.439   1.433      -0.484      -0.899       Nicotinamide (NICOAM01)
   1.445   1.438   1.410      -0.484      -2.422       9-(2-Hydroxyethyl)adenine (FABFUJ)
   8.793   8.750   0.000      -0.489    -100.000       Cobalt (Co) (ICSD 44989) fcc
   2.757   2.743   0.424      -0.508     -84.621       Ammonium trans-di-iodo-bis(glyoximato-N,N')-cobalt(iii) (KIDRIY)
   1.929   1.918   1.322      -0.570     -31.467       Kanemite (Na2O)(SiO2)4(H2O)7
   1.353   1.345   1.325      -0.591      -2.069       15-Crown-5-sodium hexakis(phenylthiolato-S)-tantalum (KIGGEM)
   1.511   1.502   1.457      -0.596      -3.574       8-Azaguanine (AZGUAN01)
   3.244   3.224   4.479      -0.617      38.070       Barium nitrate (Ba(NO3)2) (ICSD 35495)
   3.072   3.053   2.574      -0.618     -16.211       Neighborite (NaMgF3)
   3.225   3.205   3.336      -0.620       3.442       Iron(iii) sulfate Fe2(SO4)3) (ICSD 31341)
   7.302   7.254   5.661      -0.657     -22.473       Thallium(i) carbonate (Tl2CO3) (ICSD 4239)
   1.791   1.779   0.726      -0.670     -59.464       tris(mu-2-Chloro)-bis((h5-pentamethylcyclopentadienyl)-rhodium(iii)) tetrafluoroborate (ASUKOO)
   6.093   6.052   0.000      -0.673    -100.000       Vanadium (V) (ICSD 171003) bcc
   2.065   2.051   2.182      -0.678       5.666       Magnesium acetylide (MgC2) (ICSD 88057)
   1.792   1.779   1.679      -0.725      -6.306       Guanine
   1.876   1.861   1.714      -0.800      -8.635       bis(h5-Cyclopentadienyl)-(2,2'-bipyridyl-N,N')-niobium bis(hexafluorophosphate) (VOSXUW)
   8.630   8.560   2.261      -0.811     -73.801       Coloradoite (HgTe)
   4.883   4.843   6.354      -0.819      30.125       Molybdenum(iii) tribromide (MoBr3)
   6.070   6.018   5.982      -0.857      -1.450       Calcium plumbate (Ca2PbO4) (ICSD 36629)
   1.966   1.949   1.680      -0.865     -14.547       bis((18-Crown-6)-rubidium) bis(mu-2-chloro)-tetrachloro-di-copper (JUMJEG)
   1.490   1.477   1.559      -0.872       4.631       Malonic acid bis(isonicotinamide) (ULAWEJ)
   5.454   5.406   7.680      -0.880      40.814       BaFI
   2.998   2.971   3.028      -0.901       1.001       Chiolite (Na5Al3F14) (ICSD 26419)
   5.039   4.992   5.555      -0.933      10.240       Tellurium(iv) tetraiodide (TeI4) (ICSD 79)
   1.979   1.960   1.462      -0.960     -26.124       Trityl hexakis(pentafluorophenoxy)-tantalum (QINKON)
   4.671   4.625   5.186      -0.985      11.025       Chromium(iii) oxide (Cr2O3) (ICSD 173470)
   2.943   2.914   2.868      -0.985      -2.548       Dipotassium (pentaformato-O,O')-bismuth (CAVZUU)
   2.514   2.489   2.285      -0.994      -9.109       Beryllium sulfate (BeSO4) (ICSD 44801)
   2.205   2.183   1.467      -0.998     -33.469       Zirconium(iii) trichloride (ZrCl3)
   1.372   1.358   1.302      -1.020      -5.102       (1-(tris(dimethylamino)phosphoranylideneammonium)-8-(tris(dimethylamino)phosphoranylideneamino)naphthalene) hexafluorophosphate (SAXLAF)
   2.966   2.935   2.538      -1.045     -14.430       Phenakite (Be2SiO4)
   2.094   2.072   1.685      -1.051     -19.532       bis(15-Crown-5-sodium) bis(tetraselenido)-zinc (SAMZUB)
   3.198   3.164   2.922      -1.063      -8.630       Lithium hexafluorochromium(iv) (Li2CrF6)
   3.999   3.956   3.910      -1.075      -2.226       Niobium chloride iodide ((Nb6Cl12)I2) (ICSD 65968)
   2.777   2.747   2.432      -1.080     -12.423       Talc (MgO)3(SiO2)4(H2O)
   1.934   1.913   2.024      -1.086       4.654       Ho Complex Sparkle (CAQFUV)
   2.852   2.821   3.762      -1.087      31.907       Phosphonium iodide (PH4I)
   2.604   2.575   2.278      -1.114     -12.519       Bertrandite ((BeO)4(SiO2)2(H2O)
   1.787   1.766   1.706      -1.175      -4.533       Uric acid monohydrate (GEJQAO)
   2.198   2.172   2.319      -1.183       5.505       Dibromo-bis(diglyme-O,O',O'')-lanthanum(iii) tetrabromo-(diglyme-O,O',O'')-lanthanum(iii) (RIGYUB)
   1.426   1.409   1.319      -1.192      -7.504       (2)-(N,N'-Diethyl-4,4'-bipyridiniumdibenzena-decaoxacyclo-octacosaphane)-rotaxane bis(hexafluorophosphate) acetone solvate (GITXOX)
   5.650   5.582   4.569      -1.204     -19.133       Stilleite (ZnSe)
   2.790   2.756   2.666      -1.219      -4.444       Aquamarine ((NaOH)(Al2O3)(BeO)3(SiO2)6)
   2.264   2.236   2.153      -1.237      -4.903       Copper sulfate pentahydrate (CuSO4 5(H2O))
   2.174   2.147   1.632      -1.242     -24.931       catena-((mu-3-cis,trans-1,3,5-Triaminocyclohexane)-silver(i) perchlorate) (ABIREJ)
   2.380   2.350   2.266      -1.261      -4.790       Petalite (LiAlSi4O10)
   2.141   2.114   1.787      -1.261     -16.534       Tetrapotassium tetrametaphosphate tetrahydrate (K4H8P4O16)
   2.141   2.113   1.775      -1.308     -17.095       KPO3 2(H2O)
   3.670   3.622   2.874      -1.308     -21.689       NaI
   2.429   2.397   2.169      -1.317     -10.704       tris(1-Ethyl-3-methylimidazolium) tris(mu-2-bromo)-bis(tribromo-ruthenate(iii)) (DIVGOE10)
   2.581   2.546   2.268      -1.356     -12.127       Orthoclase (KAlSi3O8)
   1.692   1.669   1.618      -1.359      -4.374       Pr Complex Sparkles (VELRUZ)
   3.592   3.543   3.690      -1.364       2.728       Garnet (Al2O3(CaO)3(SiO2)3)
   1.367   1.348   1.394      -1.390       1.975       2,3-Dioxo-N,N'-bis(2-methoxyethyl)terephthalamide hydrochloride diethyl ether solvate -NH-COH- (WEDDOZ)
   1.911   1.883   1.672      -1.465     -12.507       Ethylenediammonium pentafluoro-oxo-vanadium (ENDFVO)
   2.854   2.812   2.817      -1.472      -1.296       (1,4,7-Trithiacyclononane)-tri-iodo-antimony(iii) (JUYKUJ)
   1.489   1.467   1.409      -1.478      -5.373       II (GUFJOG)
   2.220   2.187   1.879      -1.486     -15.360       Lithium sulfate (Li2SO4) (ICSD 23723)
   3.076   3.030   1.624      -1.495     -47.204       Krypton (Kr) (ICSD 9785)
   1.571   1.547   1.513      -1.528      -3.692       Ethylenediammonium orthofluoroberyllate (KIPPEE)
   1.497   1.474   1.493      -1.536      -0.267       18-Crown-6 trans-tetrafluoro-diaqua-silicon dihydrate (YORRIG01)
   1.102   1.085   1.212      -1.543       9.982       tris(Diethyl ether)-lithium hexamethyl-niobium(v) (POZJAP)
   1.843   1.814   0.198      -1.574     -89.257       (Cyclopentadienyl-carboxylic acid)-(cyclopentadienyl-carboxylato)-cobalt(iii) (BOHRAR)
   1.996   1.964   2.018      -1.603       1.102       tetrakis(Tetrahydroborato)-hafnium (FUZVOL)
   4.179   4.112   1.438      -1.603     -65.590       Palladium(ii) chloride (PdCl2)
   3.601   3.543   3.689      -1.611       2.444       Grossular ((CaO)3 (Al2O3) (SiO2)3)
   1.486   1.462   1.471      -1.615      -1.009       (18-Crown-6)-potassium bis(pyridine)-tetrakis(isothiocyanato)-indium(iii) pyridine solvate (YUXXIY)
   2.265   2.227   2.682      -1.678      18.411       bis(Di-iodo-(diethyl ether)-aluminium(ii)) (NIZWIC)
   1.662   1.634   1.503      -1.685      -9.567       Lithium naphthalene sulfonate
   2.191   2.154   2.042      -1.689      -6.801       Dichloro-oxo-(N,N',N''-trimethyl-1,4,7-triazacyclononane-N,N',N'')-tungsten(v) hexafluorophosphate (DIBVEP)
   1.894   1.862   1.989      -1.690       5.016       bis(Ethylenediammonium) bis((mu-2-sulfido)-disulfido-germanium) (WADWEE)
   3.466   3.407   3.270      -1.702      -5.655       Tricalcium bisphosphate (Ca3(PO4)2) (ICSD 200202)
   4.109   4.038   3.864      -1.728      -5.963       Perovskite (MgSiO3)
   2.008   1.973   1.706      -1.743     -15.040       Tri-potassium bis(nitrilotriacetato)-indium(iii) pentahydrate (ZUFXAZ)
   1.737   1.706   1.648      -1.785      -5.124       tris(2,2'-Bipyridine)-ruthenium(ii) bis(hexafluorophosphate) (BPYRUF10)
   6.489   6.372   5.753      -1.803     -11.342       Mercury(ii) sulfate (HgSO4) (ICSD 25773)
   1.661   1.630   1.610      -1.866      -3.070       bis(15-Crown-5)-potassium bis(1,2-dicyanoethene-1,2-dithiolato-S,S')-gold(i) (CEBHAT)
   2.303   2.260   2.905      -1.867      26.140       Boron (B)
   6.091   5.977   6.370      -1.872       4.581       Lead(ii) iodide (PbI2)
   2.248   2.205   2.371      -1.913       5.472       catena-(((((((Hydroxy(phenyl)iodanyl)oxy)(phenyl)-iodanyl)oxy)-sulfonyl)oxy)(phenyl)iodane) (NILXUC)
   2.307   2.262   2.326      -1.951       0.824       trans-Dioxo-bis(ethylenediamine)-technetium iodide (BEWREA)
   2.146   2.104   1.423      -1.957     -33.691       Sodium tetrametaphosphate (NaH2PO4)
   2.184   2.141   2.090      -1.969      -4.304       bis(Tetra-n-propylammonium) tetrakis(mu-2-bromo)-hexabromo-triselenate(ii,iv,ii) (JAMBAA)
   4.129   4.045   3.748      -2.034      -9.227       Germanium(iv) dioxide (GeO2) (ICSD 59639)
   2.796   2.739   2.618      -2.039      -6.366       Potassium permanganate (KMnO4)
   3.134   3.070   3.126      -2.042      -0.255       Dy Complex Sparkle (ICSD 1904895)
   2.673   2.618   2.167      -2.058     -18.930       Vanthoffite (MgNa6 (SO4)4)
   1.554   1.522   1.483      -2.059      -4.569       Lu Complex Sparkle (UFIROQ)
   2.889   2.829   3.563      -2.077      23.330       Potassium hexafluoroaluminate (K3AlF6) (ICSD 381848)
   1.659   1.624   1.605      -2.110      -3.255       Tetrathiafulvalenium 1 4 9 10-anthracenetetronide (YEVXIG)
   1.657   1.622   1.650      -2.112      -0.422       Lithium sulfide (Li2S) (ICSD 642291)
   2.260   2.212   1.869      -2.124     -17.301       bis((mu-2-Tetrafluoroborato-F,F')-(nu-5-pentamethyl-cyclopentadienyl))-lead (VALVOT)
   2.902   2.840   3.094      -2.136       6.616       bis(Trimethylammonium) hexaiodo-tellurium(iv) (DIYGOH)
   8.528   8.345   0.000      -2.146    -100.000       Iridium(iii) trifluoride (IrF3) (ICSD 16676)
   2.280   2.231   2.120      -2.149      -7.018       Graphite (C)
   1.809   1.770   1.332      -2.156     -26.368       Gd Complex Sparkle (CULNIG10)
   2.723   2.663   0.000      -2.203    -100.000       bis(Morpholinium) diaqua-hexabromo-di-molybdenum(ii) (BELWEU)
   1.656   1.619   1.558      -2.234      -5.918       trans-Difluoro-bis(ethylenediamine)-chromium(iii) chloride (BAVGUA10)
   3.109   3.038   3.661      -2.284      17.755       tetrakis(mu-2-Acetato)-dichloro-di-osmium (COHNUI)
   6.520   6.371   5.755      -2.285     -11.733       Mercury(ii) sulfate (HgSO4) (ICSD 100316)
   2.309   2.256   2.527      -2.295       9.441       IX (XATMIP)
   7.086   6.923   9.575      -2.300      35.126       Pyromorphite (Pb5(PO4)3(OH))
   4.007   3.914   4.673      -2.321      16.621       Calcium diiodide (CaI2)
   1.763   1.722   1.618      -2.326      -8.225       Aqua titanium(III) EDTA hydrate ((YUCMAK)
   2.272   2.219   1.870      -2.333     -17.694       Sodium tetraborate (Na2B4O7) (ICSD 2040)
   6.129   5.986   7.192      -2.333      17.344       Germanium telluride (GeTe) (hexagonal) (ICSD 56041)
   4.766   4.654   5.094      -2.350       6.882       Zinc iodide (ZnI2)
   2.244   2.191   2.569      -2.362      14.483       Gallium(i) hexamethylbenzene tetrabromo-gallium(iii) (CEFSEL)
   2.347   2.291   2.667      -2.386      13.634       Potassium oxide (K2O) (ICSD 44674)
   1.928   1.881   1.736      -2.438      -9.959       trans-Tetrafluoro-bis(pyridine)-germanium(iv) (HUMCOH01)
   2.272   2.216   2.219      -2.465      -2.333       Disodium bis(oxalato-O,O')-copper(ii) dihydrate (CUOXNA10)
   5.645   5.504   6.163      -2.498       9.176       Lutetium(iii) triiodide (LuI3)
   2.918   2.845   2.692      -2.502      -7.745       Cryolite (Na3AlF6)
   1.957   1.907   1.884      -2.555      -3.730       bis(3-Carboxyanilinium) hexafluorostannate(iv) (FICWAQ)
   1.826   1.779   1.643      -2.574     -10.022       Vermiculite (Mg3Si4O10(OH)2)
   2.666   2.597   2.830      -2.588       6.152       bis(mu-2-Tellurido)-tetrakis(1,2-diaminoethane-N,N')-di-indium(iii) bis(iodide) (BOKLET)
   3.586   3.493   3.427      -2.593      -4.434       Lonsdaleite (C)
   2.226   2.168   1.984      -2.606     -10.872       Leonite (K2Mg(SO4)2 4(H2O))
   2.340   2.279   2.563      -2.607       9.530       Triethylsulfonium tetrakis(iodo)-palladium(ii) (KIBMUE)
   2.875   2.800   0.430      -2.609     -85.043       Carbonyl-(cyclopentadienyl)-di-iodo-cobalt(iii) (MULJIM)
   3.155   3.072   3.201      -2.631       1.458       Ho Complex Sparkle (ICSD 1421578)
   1.936   1.885   1.366      -2.634     -29.442       Boron trifluoride (BF3) (ICSD 20904)
   2.484   2.418   2.129      -2.657     -14.291       catena-Lithium phosphate (LiPO3) (ICSD 1121553)
   3.674   3.576   5.236      -2.667      42.515       Hydrogen iodide (HI) (ICSD 40251)
   2.882   2.805   2.773      -2.672      -3.782       Lithium metaborate (LiBO2) (ICSD 34256)
   2.649   2.578   2.238      -2.680     -15.515       Alpha quartz (SiO2)
   3.202   3.114   3.132      -2.748      -2.186       Enstatite (MgSiO3)
   2.183   2.123   2.092      -2.749      -4.169       Tb Complex Sparkle (ICSD 1522521)
   4.097   3.984   1.014      -2.758     -75.250       Xenon tetrafluoride (XeF4) (ICSD 27467)
   1.736   1.688   1.583      -2.765      -8.813       tetrakis(Tetramethylthiourea)-oxo-rhenium(v) tris(hexafluorophosphate) (FIQLEW)
   3.477   3.380   3.549      -2.790       2.071       Pyrope ((Al2O3)(MgO)3(SiO2)3)
   2.286   2.222   2.070      -2.800      -9.449       (Oxybis((phenyliodanediyl)oxysulfonyloxy))bis(hydroxy(phenyl)iodane) (AHOREV)
   5.133   4.989   0.000      -2.805    -100.000       Barium diiodide(BaI2) (ICSD 15707)
   3.306   3.213   3.981      -2.813      20.417       Copper(II) hexaquo bromate (Cu(H2O)6 BrO3) (ICSD 1402205)
   8.840   8.589   0.000      -2.839    -100.000       Cobalt (Co) (ICSD 76942) hcp
   1.539   1.495   1.494      -2.859      -2.924       tetrakis(N,N-Diethyldithiocarbamato-S,S')-niobium(v) bromide (DEDRAF)
   7.784   7.561   5.332      -2.865     -31.501       Bismuth oxychloride (BiOCl) (ICSD 74502)
   2.368   2.300   2.034      -2.872     -14.105       Lithium nitrate (LiNO3) (ICSD 67981)
   1.566   1.521   1.385      -2.874     -11.558       tetrakis(1,3,4,6,7,8-hexahydro-2H-pyrimido(1,2-a)pyrimidin-1-yl)-niobium(v) hexafluorophosphate (POFHUO)
   1.736   1.686   1.607      -2.880      -7.431       Potassium (tetramethylenediamine-N,N,N',N'-tetra-acetato)-chromium(iii) monohydrate (YITNAQ01)
   3.924   3.807   1.636      -2.982     -58.308       Trifluoroxenon(IV) hexafluoroantimonate (XeF3SbF6) (ICSD 6034)
   2.734   2.651   1.926      -3.036     -29.554       Sodium phosphate (Na3PO4) (ICSD 33718)
   2.569   2.491   2.454      -3.036      -4.476       Lizardite (Mg3Si2O5 (OH)4)
   3.019   2.927   2.858      -3.047      -5.333       Fluor-tremolite (Ca2Mg5Si8O22F2)
   6.458   6.261   7.499      -3.050      16.120       Mercury(ii) bisiodate (Hg(IO3)2) (ICSD 98546)
   4.816   4.669   9.043      -3.052      87.770       BaSbF5
   2.839   2.752   3.108      -3.064       9.475       bis(Tetramethylammonium) tetraiodo-fluoro-nitrosyl-osmium (TEDYEG)
   4.801   4.653   4.896      -3.083       1.979       Greenockite (CdS)
   1.553   1.505   0.419      -3.091     -73.020       cis-Difluoro-bis(1,2-bis(dimethylphosphino)ethane)-ruthenium hydrofluoride (QIWPUH)
   2.869   2.780   2.578      -3.102     -10.143       Tetraselenonaphthalenium chloride (VAMZEO)
   6.089   5.900   7.434      -3.104      22.089       Er Complex Sparkle (ICSD 200097)
   2.261   2.190   2.059      -3.140      -8.934       Nitratine (NaNO3)
   2.251   2.180   2.380      -3.154       5.731       trans-mer-Aqua-di-iodo-tris(1,3,5-triaza-1-methyl-7-phosphatricyclodecane-P)-ruthenium tri-iodide dihydrate (BAQFOP01)
   2.630   2.547   1.990      -3.156     -24.335       Sodium sulfite (Na2SO3) (ICSD 1400216)
   2.501   2.422   2.998      -3.159      19.872       Cordierite (Mg2Al4Si5O18)
   2.183   2.114   1.854      -3.161     -15.071       Beta Tridymite (SiO2)
   2.964   2.870   3.089      -3.171       4.217       catena-(4-Aminopyridinium bis(mu-2-bromo)-dibromo-antimony(iii)) (ENIKIV)
   4.511   4.367   3.949      -3.192     -12.458       CrO(OH)
   2.355   2.279   2.075      -3.227     -11.890       Na3(TiCl6)
   4.857   4.699   4.437      -3.253      -8.647       Iron titanate (FeTiO3) (ICSD 153492)
   1.965   1.901   2.078      -3.257       5.751       bis(Tetraethylammonium) tetraiodo-tellurate(ii) (DAMFIG)
   0.948   0.917   0.903      -3.270      -4.747       Tetramethylsilane (TIVWOL)
   6.199   5.996   7.794      -3.275      25.730       Germanium telluride (GeTe) (cubic) (ICSD 600823)
   2.830   2.737   2.906      -3.286       2.686       Triethylsulfonium hexakis(iodo)-platinum(iv) (KIBMIS)
   2.408   2.328   2.035      -3.322     -15.490       Ti2(C2O4)O3(H2O)3)
   4.773   4.614   7.292      -3.331      52.776       Alforsite (Ba5(PO4)3Cl)
   2.666   2.577   1.994      -3.338     -25.206       Thenardite (Na2SO4) (ICSD 2895)
   2.455   2.373   2.463      -3.340       0.326       Bayerite (Al(OH)3)
   2.768   2.675   1.776      -3.360     -35.838       Illite ((Al2O3)2 (SiO2)8 (H2O)2)
   2.166   2.093   2.316      -3.370       6.925       Pentapotassium octakis(formato)-yttrium (CAVYUT)
   3.352   3.238   3.379      -3.401       0.805       Tetramethylammonium catena(tri-iodo-lead(ii)) (CERBUW)
   1.852   1.789   1.734      -3.402      -6.371       Uric acid (URICAC)
   1.694   1.636   1.361      -3.424     -19.658       bis(15-Crown-5)-cesium heptafluoro-2,4-bis(trifluoromethyl)pentenide (CAZWUW)
   2.568   2.480   2.383      -3.427      -7.204       bis(Dipyridiniomethane) bis(mu-2-iodo)-tetra-iodo-di-copper(i) (DEHKEG)
   1.217   1.175   1.234      -3.451       1.397       bis(Tetrahydrofuran-O)-bis(bis(trimethylsilyl)amido)-barium (KILXOS)
   1.658   1.600   1.660      -3.498       0.121       Dichloro-bis(mu-2-(2-(2-dimethylamino)ethylthio)ethanol)-di-copper(ii) (BICTAI)
   2.664   2.570   1.296      -3.529     -51.351       hexakis(mu-2-Acetato)-triaqua-(mu-3-oxo)-tri-iridium(iii,iii,iv) dinitrate (ZULRUT)
   3.170   3.058   3.323      -3.533       4.826       tris(Iodo)-trimethylarsane-gallium(iii) (TINJAC)
   1.816   1.751   0.276      -3.579     -84.802       tris(1-Pyrrolidinecarbodithioato)-iridium(iii) benzene solvate (PYTCIR)
   1.419   1.368   1.482      -3.594       4.440       ((2S,3S)-1,4-Dimethoxy-2,3-bis((salicylidene)amino)butane)-nickel(ii) (QAPDOB)
   3.004   2.896   3.051      -3.595       1.565       Magnesium sulfate (MgSO4) (ICSD 16759)
   2.980   2.872   2.819      -3.624      -5.403       Tremolite (CaO)2(MgO)5(SiO2)8(H2O)
   2.587   2.493   2.615      -3.634       1.082       Nd Complex Sparkle (ICSD 411290)
   2.474   2.384   2.670      -3.638       7.922       1,2-bis(Iodo)-1,2-diphospha-acenaphthene (GUTJOU)
   2.769   2.668   2.703      -3.648      -2.384       Tb Complex Sparkle (ICSD 1408781)
   1.835   1.768   1.550      -3.651     -15.531       Tetralithium Tetrametaphosphate Pentahydrate (Li4P4O12 5(H2O))
   4.679   4.508   4.702      -3.655       0.492       Iron molybdate (FeMoO4) (ICSD 312170)
   6.439   6.203   0.000      -3.665    -100.000       Cobalt(iii) sesquioxide (Co2O3) (low spin) (ICSD 1300628)
   5.680   5.471   5.336      -3.680      -6.056       Zincite (ZnO)
   2.493   2.401   2.474      -3.690      -0.762       Metaboric acid (cubic) (HBO2) (ICSD 280304)
   1.489   1.434   1.292      -3.694     -13.230       tris(1,3-Propanediamine) chromium(iii) pentacyanonickelate(ii) dihydrate (CRTNCN01)
   1.513   1.457   1.296      -3.701     -14.342       (cryptand)-sodium tris(1,2,3-h-cycloocta-1,3,5-trienyl)-tantalum (OGISAY)
   1.374   1.323   0.723      -3.712     -47.380       Sodium amide (NaNH2) (ICSD 14007)
   2.660   2.561   2.679      -3.722       0.714       trans-Dicarbonyl-dibromo-(2,2'-bipyridine)-osmium (NIKPED)
   2.480   2.387   1.834      -3.750     -26.048       Sodium metaborate (NaBO2) (ICSD 34645)
   9.549   9.188  10.312      -3.781       7.990       Plattnerite (PbO2) (Rutile structure)
   2.565   2.468   2.518      -3.782      -1.832       Pr Complex Sparkle (ICSD 411291)
   6.706   6.449   8.465      -3.832      26.230       Platinum(iv) tetraiodide (PtI4) (ICSD 15173)
   1.942   1.867   1.871      -3.862      -3.656       bis(mu-2-Iodo)-bis(bis(tetrahydrothiophene)-copper(ii)) (FUHCEQ)
   2.740   2.634   2.663      -3.869      -2.810       KBr
   3.011   2.894   2.769      -3.886      -8.037       Tetramethylammonium mercury tribromide (TMAHGB)
   4.281   4.114   3.695      -3.901     -13.688       Stishovite (SiO2)
   1.636   1.572   1.483      -3.912      -9.352       catena-(tris(mu-2-Thiocyanato)-cadmium (18-crown-6)-potassium clathrate) (RAPVAF)
   1.378   1.324   1.125      -3.919     -18.360       Hexamethylguanidinium pentacarbonyl-manganese (VILRUD)
   2.050   1.969   1.517      -3.951     -26.000       Dorfmanite (Na2HPO4 2(H2O))
   4.185   4.018   6.459      -3.990      54.337       Phosphorus(iii) triiodide (PI3) (ICSD 311)
   5.018   4.816   0.000      -4.026    -100.000       Cobalt(ii) bromide (CoBr2)
   3.949   3.790   3.421      -4.026     -13.370       Copper(ii) hydroxide (Cu(OH)2) (ICSD 68459)
   7.081   6.795   9.013      -4.039      27.284       Platinum(iv) tetrafluoride (PtF4) (ICSD 71579)
   3.287   3.153   3.227      -4.077      -1.825       Sodium hexanitroiridate (Na3Ir(NO3)6 (ICSD 39572)
   3.087   2.961   3.287      -4.082       6.479       Lawsonite (CaAl2Si2O7(OH)2 (H2O))
   4.315   4.136   6.080      -4.148      40.904       Witherite (BaCO3)
   2.310   2.214   2.198      -4.156      -4.848       bis(15-Crown-5-sodium) bis(tetraselenido)-mercury (SANBAK)
   3.758   3.600   3.838      -4.204       2.129       Cesium hydroxide hydrate (CsOH H2O) (ICSD 280909)
   3.297   3.157   2.094      -4.246     -36.488       Dioptase Cu6(Si6O18) 6(H2O))
   2.728   2.612   2.190      -4.252     -19.721       Tetramethylnaphthobisditellurole carbon disulfide solvate (NUGSEN01)
   8.556   8.191   6.766      -4.266     -20.921       Thallium(i) fluoride (TlF) (ICSD 90992)
   6.691   6.405   6.289      -4.274      -6.008       Wulfenite (PbMoO4)
   3.949   3.780   4.859      -4.280      23.044       Copper hydroxide (Cu(OH)2)
   1.958   1.874   2.128      -4.290       8.682       Cyano-bis(ethylene-1,2-diamine)-copper(ii) iodide (LEMVIJ)
   3.259   3.119   2.979      -4.296      -8.592       (18-Crown-6)-di-iodo-thallium tetra-iodo-thallium (ZEZFAL)
   4.663   4.461   3.877      -4.332     -16.856       Zircon (ZrSiO4)
   2.616   2.502   2.471      -4.358      -5.543       Albite ((NaAl)(Si3O8)
   2.472   2.364   2.043      -4.369     -17.354       catena-(Tri-sodium (mu-2-fluoro)-(methylenediphosphonate)-magnesium monohydrate) (DEKSIV)
   2.582   2.469   2.570      -4.376      -0.465       Dickite ((Al2O3)(SiO2)2(H2O)2)
   2.118   2.025   1.995      -4.391      -5.807       Chloro-dinitroso-(1-thia-4,7-diazacyclononane-N,N',S)-molybdenum hexafluorophosphate (SAVNOS)
   2.458   2.349   2.619      -4.434       6.550       catena-(Diammonium (mu-2-methylenediphosphonato)-tin(ii)) (EQUWUI)
   4.868   4.652   5.030      -4.437       3.328       Hawleyite (CdS)
   8.576   8.193   0.000      -4.466    -100.000       Iridium(iv) disulfide (IrS2) (ICSD 640950)
   1.608   1.536   1.532      -4.478      -4.726       18-Crown-6-oxonium hexafluoroniobate (SINSAK)
   1.512   1.444   0.222      -4.497     -85.317       bis(Cyclopentadienyl)-cobalt (DCYPCO)
   2.375   2.268   1.468      -4.505     -38.189       Potassium bis(oxalato-O,O')-palladium(ii) tetrahydrate (POXPDH)
   6.036   5.764   8.794      -4.506      45.693       Osmium(iv) tetrabromide (OsBr4)
   2.525   2.411   3.072      -4.515      21.663       Potassium perchlorate (KClO4) (ICSD 1137)
   1.582   1.510   1.378      -4.551     -12.895       catena-(bis(18-Crown-6-potassium) bis(mu-4-thiocyanato-S,S,S,S,N)-bis(mu-2-thiocyanato-S,N)-bis(mu-2-isothiocyanato-N,S)-bismuth-potassium) (WETRIW)
   1.968   1.878   0.537      -4.573     -72.713       Si8H8O12 (ICSD 75244)
   3.947   3.766   5.116      -4.586      29.617       Yttrium(iii) tribromide (YBr3) (ICSD 1300338)
   2.328   2.221   2.357      -4.596       1.246       Trimethylarsonium iodide (HAs(Me)3 I)
   5.715   5.452   5.298      -4.602      -7.297       Cadmium diiodide (CdI2) (ICSD 44791)
   1.463   1.395   1.655      -4.648      13.124       alpha-Chitin (SUSGIW)
   2.614   2.492   2.369      -4.667      -9.373       Potassium phosphate (K3PO4) (ICSD 158801)
   9.934   9.468   9.705      -4.691      -2.305       Mercury fluoride (Hg2F2) (ICSD 72354)
   2.070   1.972   2.077      -4.734       0.338       catena(bis(N,N-Diethyldithiocarbamato)-iodo-antimony(iii)) iodine (ETCSBB)
   3.113   2.965   6.352      -4.754     104.048       Sodium hexafluoroantimonate (NaSbF6) (ICSD 77919)
   3.763   3.584   3.408      -4.757      -9.434       catena-(Di-rubidium (mu-10-dihydrogen tetraphosphatodiborate)-di-indium) (MEQXAI)
   2.435   2.319   2.594      -4.764       6.530       Potassium tetracyanomercurate (K2Hg(CN)4) (ICSD 62084)
   3.253   3.097   4.779      -4.796      46.911       Cesium dihydrogen phosphate (CsH2PO4) (ICSD 79608)
   4.320   4.112   2.071      -4.815     -52.060       Xenon dioxide (XeO2) (ICSD 26625)
   6.124   5.829   6.017      -4.817      -1.747       Phosgenite (Pb2(CO3)Cl2)
   3.207   3.052   3.014      -4.833      -6.018       Magnesium chromate (MgCrO4) (ICSD 312936)
   2.396   2.280   1.921      -4.841     -19.825       Lithium cyclohexaphosphate (Li6(P6O18))
   1.501   1.428   1.011      -4.863     -32.645       bis(mu-2-Diethyldithiocarbamato)-bis(diethyldithiocarbamato)-di-copper(ii) (CETCAM01)
   2.651   2.522   2.651      -4.866       0.000       Tetramethylene-1,4-diammonium bis(mu-2-fluoro)-octafluoro-diaqua-di-hafnium(iv) tetrahydrate (ROLPEN)
   2.075   1.974   1.835      -4.867     -11.566       Lithium sulfate hydrate (Li2SO4 H2O) (ICSD 201531)
   2.484   2.362   2.442      -4.911      -1.691       Ho Complex Sparkle (BEYSAZ)
   3.221   3.062   2.266      -4.936     -29.649       Rubidium chlorate (RbClO3) (ICSD 36260)
   2.584   2.456   2.297      -4.954     -11.107       catena-(N-Hexamethylethylenediamine tetrakis(mu-2-tellurium)) (VEHMEA)
   2.705   2.571   3.004      -4.954      11.054       Potassium dichromate (K2Cr2O7) (ICSD 10371)
   5.358   5.092   4.924      -4.965      -8.100       Zincochromite (ZnCr2O4)
   8.447   8.027   6.193      -4.972     -26.684       Lead tungstate (PbWO4) (ICSD 81550)
   3.398   3.229   3.930      -4.974      15.656       fac-Cesium trichloro-tricarbonyl-osmium(ii) (PENJOO)
   3.090   2.935   3.292      -5.016       6.537       (2,2'-Bipyridine)-di-iodo-mercury(ii) (CUDWIH)
   5.334   5.065   6.831      -5.043      28.065       Chromium(iii) triiodide (CrI3)
   2.607   2.475   2.619      -5.063       0.460       Nacrite ((Al2O3)(SiO2)2(H2O)2)
   1.379   1.309   1.321      -5.076      -4.206       Lithium acetate (Li(CH3COO) 2(H2O))
   1.456   1.382   1.623      -5.082      11.470       Alpha-Chitin
   1.643   1.559   2.045      -5.113      24.467       Sodalite (AlPO4)
   1.872   1.776   1.450      -5.128     -22.543       o-Phenylene-di-ammonium aqua-pentafluoro-chromium(iii) (YASHOP)
   2.599   2.465   2.546      -5.156      -2.039       Kaolinite ((Al2O3)(SiO2)2(H2O)2)
   1.334   1.265   1.035      -5.172     -22.414       bis(Tetraethylammonium) tetrachloro-sulfido-titanium (GERHAM10)
   6.552   6.213   7.562      -5.174      15.415       Rhenium(iii) triiodide (ReI3) (ICSD 1250140)
   2.663   2.525   0.484      -5.182     -81.825       Dicarbonyl-(acetylacetonato-O,O')-iridium(i) (ACRHCO02)
   6.655   6.308   0.000      -5.214    -100.000       Tantalum(iii) trifluoride (TaF3) (ICSD 542010)
   7.442   7.051  10.604      -5.254      42.489       Lead phosphate (Pb3(PO4)2) (ICSD 14247)
   6.383   6.045   6.970      -5.295       9.196       Barium tungstate (BaWO4) (ICSD 23702)
   1.408   1.333   1.423      -5.327       1.065       Methyltriphenylphosphonium permanganate (MEPHMN01)
   5.842   5.530   2.438      -5.341     -58.268       Lead borate (PbB4O7) (ICSD 1614467)
   1.643   1.555   1.298      -5.356     -20.998       Carbon dioxide (CO2) (ICSD 16428)
   4.263   4.034   4.614      -5.372       8.234       Rubidium tribromovanadate(ii) (RbVBr3) (ICSD 201836)
   1.542   1.459   1.604      -5.383       4.021       Potassium hydrogen acetate
   5.107   4.832   0.000      -5.385    -100.000       Iridium(vi) hexafluoride (IrF6) (ICSD 171654)
   1.465   1.386   1.199      -5.392     -18.157       Nitrosyl-tris(trimethylphosphine)-nickel(0) hexafluorophosphate (FINJAN)
   4.207   3.980   1.208      -5.396     -71.286       Zirconium(ii) dichloride (ZrCl2) (ICSD 20144)
   3.167   2.996   2.815      -5.399     -11.115       (mu-2-Pyrazine)-decafluoro-di-antimony (TUSBAK)
   2.180   2.062   1.275      -5.413     -41.514       fac-Tetraethylammonium trichloro-trifluoro-iridium(v) (MAKGUA)
   7.379   6.973   7.293      -5.502      -1.165       Mimetite (Pb5As3O12Cl)
   7.550   7.131   7.469      -5.550      -1.073       Ferberite (FeWO4)
   3.620   3.419   2.657      -5.552     -26.602       Sodium molybdate (Na2MoO4) (ICSD 151970)
   2.388   2.254   1.997      -5.611     -16.374       Phosphonium bromide (PH4Br) (ICSD 031149)
   4.157   3.922   3.529      -5.653     -15.107       Copper oxide sulfate (CuO CuSO4) (ICSD 61513)
   2.364   2.229   0.000      -5.711    -100.000       Thomsonite (Na2O)(CaO)4(Al2O3)5(SiO2)10(H2O)12
   1.996   1.882   1.886      -5.711      -5.511       catena-(bis(Tetramethylammonium) (mu-3-sulfido)-hexakis(mu-2-sulfido)-tri-tin monohydrate) (YAZNOC)
   5.921   5.582   9.039      -5.725      52.660       Thallium tetrafluoroaluminate (TlAlF4)
   2.279   2.147   0.332      -5.792     -85.432       Bromo-methyl-bis(carbonyl-cyclopentadienyl-rhodium) (MLDRHB10)
   2.447   2.305   2.452      -5.803       0.204       p-Iodobenzoic acid (BENMOW04)
   1.911   1.800   1.528      -5.808     -20.042       bis(1,4,7-Trithiacyclononane-S,S',S'')-ruthenium bis(trifluoromethanesulfonate) (FENDUX)
   2.871   2.704   3.735      -5.817      30.094       Potassium 1,2-diseleno-oxalate (SEOXAK)
   2.846   2.680   1.922      -5.833     -32.467       Pyrophyllite (AlSi2O5(OH))
   2.211   2.082   2.542      -5.834      14.971       tetrakis(mu-2-Acetato)-di-molybdenum (MOLACE02)
   1.541   1.451   1.395      -5.840      -9.474       Hydrogen hexacyanoferrate (H4Fe(CN)6)
   2.388   2.248   2.000      -5.863     -16.248       Phosphonium bromide (PH4Br) (ICSD 1622038)
   2.466   2.321   2.084      -5.880     -15.491       Tetramethylammonium cesium (mu-2-fluoro)-aqua-heptafluoro-dioxo-di-vanadium (SARLUS)
  11.665  10.976  61.113      -5.907     423.901       Iridium(iv) dioxide (IrO2) (ICSD 81028)
   4.286   4.030   8.756      -5.973     104.293       Molybdenum(iii) trifluoride (MoF3)
   1.722   1.619   1.572      -5.981      -8.711       Potassium bis((18-crown-6)-potassium) tritellurido-gallium acetonitrile solvate (SURDAK)
   1.736   1.632   1.228      -5.991     -29.263       bis(Guanidinium) hexafluoro-titanium (KOYXOL)
   2.069   1.945   1.837      -5.993     -11.213       Metaboric acid (HBO2) (ICSD 280303)
   3.086   2.900   2.578      -6.027     -16.461       Wadelite (K2Si4O9)
   1.982   1.862   1.383      -6.054     -30.222       Yegorovite (Na4[Si4O8(OH)4] 7(H2O))
   2.226   2.090   2.203      -6.110      -1.033       Hydrated potassium dawsonite (KAl(CO3)(OH)2 H2O)
   4.190   3.934   5.022      -6.110      19.857       Diselenium(ii) bromide (Se2Br2)
   2.710   2.544   2.883      -6.125       6.384       Gd Complex Sparkle (ICSD 109886)
   2.089   1.961   1.827      -6.127     -12.542       Sulfur (S)
   1.367   1.283   1.321      -6.145      -3.365       2,3-Dioxo-N,N'-bis(2-methoxyethyl)terephthalamide hydrochloride diethyl ether solvate -NH2-CO- (WEDDOZ)
   4.468   4.193   4.226      -6.155      -5.416       Barite (BaSO4)
   2.862   2.685   3.143      -6.184       9.818       Aluminum sulfate (Al2(SO4)3) (ICSD 73249)
   1.337   1.254   1.204      -6.208      -9.948       tris(Diethyl ether)-lithium hexamethyl-tantalum(v) (POZHUH)
   1.767   1.657   1.660      -6.225      -6.055       hexakis(Imidazole)-ruthenium(ii) bis(trifluoromethanesulfonate) (BIXCEQ)
   2.554   2.395   2.489      -6.226      -2.545       bromo-bis(tetramethylcyclopentadienyl)-osmium(iv) bis(mu-2-bromo)-dibromo-bis(cyclo-1,5-octadiene)-di-osmium(iii) (KEMPOI)
   3.780   3.543   4.115      -6.270       8.862       Azurite ((CuO)3(CO2)2(H2O))
   2.302   2.155   2.210      -6.386      -3.997       2,4,6-Trimethyl-2,4,6-triarsa-1,3,5-trithiacyclohexane (JEGDAA)
   7.187   6.725   9.379      -6.428      30.500       Pyromorphite (Pb5(PO4)3(Cl))
   3.888   3.638   2.554      -6.430     -34.311       Copper sulfate (CuSO4)
   3.420   3.199   3.374      -6.462      -1.345       Spinel (MgAl2O4)
   6.091   5.696   6.195      -6.485       1.707       Barium titanate (BaTiO3)
   4.450   4.159   2.905      -6.539     -34.719       Selenium dioxide (SeO2) (ICSD 412233)
   1.951   1.823   1.813      -6.561      -7.073       2-Chloro-1,3,6,2-trithia-arsocane (CTRTAS)
   8.024   7.491   5.465      -6.643     -31.892       Mercury dibromide (HgBr2)
   3.546   3.310   3.196      -6.655      -9.870       Magnesium titanate (Mg2TiO4) (ICSD 549417)
   1.857   1.733   1.323      -6.677     -28.756       Tris(ethylenediamine)-cobalt(iii) tetrathioarsenate(v) (GEPGEO)
   2.934   2.735   3.002      -6.783       2.318       bis(Dimethyldibromo-antimony)methane (CEHGAX)
   3.970   3.696   1.260      -6.902     -68.262       Xenon difluoride dioxide (XeF2O2) (ICSD 10203)
   2.840   2.643   2.910      -6.937       2.465       trans-Dicarbonyl-di-iodo-(2,2'-bipyridine)-osmium (NIKPIH)
   5.052   4.701   0.000      -6.948    -100.000       Tantalum(v) pentabromide (TaBr5) (ICSD 1301641)
   3.389   3.153   3.717      -6.964       9.678       Copper trihydroxide nitrate (Cu2(OH)3(NO3)) (ICSD 201478)
   3.539   3.292   4.616      -6.979      30.432       Topaz (Al2SiO4F2)
   4.495   4.179   4.353      -7.030      -3.159       Cesium deuteroxide (CsOD) (ICSD 60971)
   1.407   1.308   1.305      -7.036      -7.249       4-Methyl-triphosphatricycloheptane (FATYUU)
   3.895   3.620   3.517      -7.060      -9.705       Ilmenite (MgTiO3)
   3.757   3.491   4.322      -7.080      15.039       Atacamite (Cu2Cl(OH)3)
   1.918   1.782   2.443      -7.091      27.372       Potassium nitrite (KNO2) (ICSD 36202)
   2.112   1.962   1.628      -7.102     -22.917       (3,6-Dimethyl-3,6-diazaoctane-1,8-dithiolato-N,N',S,S')-oxo-technetium(v) pertechnetate (GEBLOO)
   1.735   1.611   1.569      -7.147      -9.568       tris(Ethylenediammonium) bis(cyclo-hexathioarsenate(iii)) ethylenediamine solvate (DAKKIJ)
   7.579   7.033   5.085      -7.204     -32.907       Nickel (Ni) (ICSD 76668) hcp
   1.714   1.590   1.407      -7.235     -17.911       bis(1,4,7-Trithiacyclononane-S,S',S'')-technetium bis(tetrafluoroborate) acetonitrile solvate (WACXIH)
   2.201   2.041   2.278      -7.269       3.498       Dibromo-dimethyl-acetylacetonato-antimony(v) (MBACSB10)
   2.736   2.536   2.810      -7.310       2.705       Sodium hexafluorosilicate (Na2SiF6) (ICSD 16598)
   2.503   2.320   1.941      -7.311     -22.453       Li2Si2O5
   2.034   1.885   1.973      -7.325      -2.999       Diammonium tetrafluoro-dimethyl-tin(iv) (LEVHUP)
   1.665   1.543   1.515      -7.327      -9.009       catena(bis(mu-2-Adiponitrile-N,N')-silver(i) perchlorate) (AGPADP)
   4.640   4.298   4.625      -7.371      -0.323       CsF
   2.421   2.242   1.861      -7.394     -23.131       (2,2'-Bipyrimidine)-chloro-(dimethyl sulfoxide)-platinum(ii) hexafluorophosphate (USOWIJ)
   2.454   2.271   2.101      -7.457     -14.385       Dawsonite ((Na2O)(Al2O3)(CO2)2(H2O)2)
   2.796   2.587   3.155      -7.475      12.840       Dimethylindium bromide (DMINBR)
   2.284   2.113   2.373      -7.487       3.897       Potassium carbonate (K2CO3) (ICSD 1816695)
   2.530   2.340   1.926      -7.510     -23.874       Lithium silicate (Li2SiO3) (ICSD 853)
   4.895   4.527   5.500      -7.518      12.360       Antimony(iii) iodide (SbI3)
   4.587   4.241   4.142      -7.543      -9.701       Tungsten chloride oxide (WO2Cl2) (ICSD 28510)
   4.740   4.382   5.484      -7.553      15.696       Arsenic(iii) iodide (AsI3)
   4.600   4.246   5.490      -7.696      19.348       Hexaiodobenzene (HIBENZ11)
   2.650   2.445   2.941      -7.736      10.981       Sm Complex Sparkle (ICSD 409528)
   2.365   2.182   2.232      -7.738      -5.624       Potassium metaborate KBO2) (ICSD 1000173)
   3.239   2.988   3.203      -7.749      -1.111       Silicon carbide (SiC)
   6.099   5.626   6.996      -7.755      14.707       Crocoite (PbCrO4)
   1.479   1.364   1.411      -7.776      -4.598       XIV N-(Dimethylthiocarbamoyl)benzothiazole-2-thione
   7.400   6.823  10.631      -7.797      43.662       Pyromorphite (Pb5(PO4)3(F))
   2.421   2.232   2.400      -7.807      -0.867       Gibbsite (Al(OH)3)
   2.499   2.303   2.453      -7.843      -1.841       Potassium aluminum carbonate hydroxide (KAlCO3 (2(OH))
   2.063   1.901   2.417      -7.853      17.159       catena-((mu-8-Rhodizonato)-di-potassium) (ZZZHDA01)
  10.223   9.418  41.275      -7.874     303.746       Molybdenum (Mo) (ICSD 643958) bcc
   1.266   1.166   1.243      -7.899      -1.817       Sm Complex Sparkle (XAGVOQ)
   5.840   5.377   5.890      -7.928       0.856       Arsenic (As) (ICSD 16516) hexagonal
   1.901   1.750   2.026      -7.943       6.575       (Dibenzo-18-crown-S6)-ruthenium bis(hexafluorophosphate) nitromethane solvate (SIJVAI)
   2.995   2.757   2.924      -7.947      -2.371       trans-Tetrabromo-bis(tetrahydrothiophene)-osmium (GOMXEL)
  10.822   9.957   7.087      -7.993     -34.513       Bismuth (Bi) (ICSD 52724) cubic
   3.219   2.958   3.250      -8.108       0.963       Moissanite (SiC)
   2.984   2.741   2.281      -8.143     -23.559       bis(Methyl isocyanide)-gold(i) hexafluorophosphate (LUVJIV)
   3.177   2.916   2.346      -8.215     -26.157       Spodumene ((LiAl(SiO3)2)
   2.649   2.431   0.180      -8.230     -93.205       bis(mu-2-Chloro)-bis(1,5-cyclo-octadiene)-di-iridium(i) (QQQCXA02)
   1.587   1.456   1.429      -8.255      -9.956       tetrakis(Tetraethylammonium) bis(pentasulfido)tellurate(ii) bis(heptasulfido)tellurate(ii) (CALYET)
   3.347   3.067   3.530      -8.366       5.468       Tanzanite ((CaO)4(Al2O3)3(SiO2)6(H2O))
   4.249   3.893   3.688      -8.378     -13.203       Rutile (TiO2)
   2.011   1.842   2.243      -8.404      11.537       Potassium cyanide (KCN) (ICSD 27350)
   7.505   6.873   7.241      -8.421      -3.518       Lead orthosilicate (Pb2SiO4) (ICSD 26343)
   2.920   2.674   2.335      -8.425     -20.034       Di-potassium dioxo-bis(oxalato-O,O')-osmium(vi) dihydrate (BOGPOD)
   4.252   3.892   4.100      -8.467      -3.575       Cesium carbonate (Cs2CO3) (ICSD 14156)
   4.262   3.898   3.552      -8.541     -16.659       Xenotime (YPO4)
   5.782   5.285   7.435      -8.596      28.589       Iron(ii) oxide (FeO)
   4.662   4.261   4.614      -8.601      -1.030       Cesium phosphate (Cs3PO4) (ICSD 161678)
   3.749   3.426   3.566      -8.616      -4.881       Benitoite ((BaO)(TiO2)(SiO2)3)
   1.457   1.331   1.327      -8.648      -8.922       Lithium hydroxide (LiOH) (ICSD 27543)
   1.846   1.686   1.356      -8.667     -26.544       bis(Ethylenediamine) copper(ii) bis(tetrafluoroborate) (CUTFBE10)
   3.489   3.186   3.428      -8.684      -1.748       Boron Nitride (BN)
   2.792   2.548   2.872      -8.739       2.865       Dipyridinomethane cis-dibromo-tetrafluoro-osmium(iv) (NILVOT)
   2.318   2.115   1.854      -8.758     -20.017       Alpha Crystobalite (SiO2)
   6.170   5.629   5.346      -8.768     -13.355       Descloizite (PbZn(VO4)(OH))
   3.430   3.129   2.873      -8.776     -16.239       Lithium titanium oxide (Li2TiO3) (ICSD 15150)
   2.930   2.672   2.557      -8.805     -12.730       Titanium(iv) oxosulfate (TiO(SO4))
   2.658   2.423   2.248      -8.841     -15.425       Niningerite (MgS)
   4.518   4.117   3.965      -8.876     -12.240       Arsenic(v) pentoxide (As2O5) (ICSD 987)
   5.787   5.271   6.134      -8.917       5.996       Bismuth triiodide (BiI3) (ICSD 78791)
   3.115   2.831   3.559      -9.117      14.254       Chromium(iii) sulfate (Cr2(SO4)3) (ICSD 73248)
   1.637   1.487   1.236      -9.163     -24.496       4,4'-Bis(perfluorostyryl)stilbene (QERWUF)
   5.664   5.142   7.171      -9.216      26.607       Hafnium(iv) tetraiodide (HfI4)
   4.533   4.115   3.531      -9.221     -22.105       Lead nitrate (Pb(NO3)2) (ICSD 62698)
   2.618   2.376   4.860      -9.244      85.638       Berlinite (AlPO4)
   3.850   3.493   3.650      -9.273      -5.195       Uvarovite (Ca3Cr2Si3O12)
   1.820   1.651   1.618      -9.286     -11.099       Tetrafluoro-(1,2-bis(dimethylamino)ethane)-germanium(iv) (DITCAL)
   2.315   2.100   2.370      -9.287       2.376       Mercallite (KHSO4)
   4.950   4.490   6.815      -9.293      37.677       Titanium(iii) iodide (TiI3)
   2.257   2.047   1.543      -9.304     -31.635       Thermonatrite (Na2CO3(H2O))
   1.498   1.358   0.816      -9.346     -45.527       Decamethyl-cobaltocenium hexafluorophosphate (DIMJIS01)
   2.375   2.153   2.110      -9.347     -11.158       Natroxalate (Na2(C2O4))
   4.510   4.088   4.388      -9.357      -2.705       CsI
   5.751   5.212   5.181      -9.372      -9.911       Tungsten(vi) oxide hydrate (H2WO4) (ICSD 201806)
   1.639   1.485   1.653      -9.396       0.854       bis(Triethylammonium) bis(mu-2-sulfido)-(ethane-1,2-dithiolato-S,S')-disulfido-di-molybdenum(v) (DOLPAV)
   4.342   3.932   3.974      -9.443      -8.475       Di-iodo(ethylenediamine) mercury(ii) iodo(ethylenediamine) mercury(ii) tri-iodo-mercury(ii) (ENTIHG)
   1.645   1.489   1.453      -9.483     -11.672       Dicycle 18-crown-6 potassium dicyano-gold (COXCUN)
   3.696   3.345   4.834      -9.497      30.790       Potassium periodate (KIO4) (ICSD 83376)
   3.339   3.019   3.060      -9.584      -8.356       Lime (CaO)
   4.945   4.469   4.663      -9.626      -5.703       Nickel(ii) bromide (NiBr2)
   2.542   2.295   2.835      -9.717      11.526       trans-bis(Acetylacetonato)-dibromo-osmium (RILRUZ)
   2.166   1.955   2.024      -9.741      -6.556       (18-Crown-6)-potassium bis(trifluoromethyl)-iodo-mercury (AQEPIV)
   3.028   2.733   2.416      -9.742     -20.211       Lithium molybdate (Li2MoO4) (ICSD 92904)
   1.170   1.056   1.115      -9.744      -4.701       Lithium amide (LiNH2) (ICSD 51679)
   5.751   5.188   5.177      -9.790      -9.981       Tungstic acid (tungstite) (H2WO4) (ICSD 2110209)
   1.530   1.380   1.403      -9.804      -8.301       Lithium hydroxide hydrate (LiOH (H2O))
   2.586   2.332   2.000      -9.822     -22.660       Hanksite (KCl)2(Na2O)22(SO3)18(CO2)4
   1.447   1.304   0.797      -9.883     -44.921       Diphenylacetylene bis(cyclopentadienyl nickel) (DPAPNI)
   3.239   2.918   4.072      -9.910      25.718       Sillimanite (Al2SiO5)
   3.115   2.806   3.446      -9.920      10.626       Molybdenum oxide dihydrate(MoO5H4)
  12.072  10.874   6.368      -9.924     -47.250       Thallium (Tl) (ICSD 52525) hcp
   7.283   6.555   6.199      -9.996     -14.884       Tungsten(vi) trioxide (WO3)
   4.491   4.042   4.939      -9.998       9.976       Magnesium diiodide (MgI2)
   2.156   1.940   0.000     -10.019    -100.000       Trona (NaHCO3) (Na2CO3) 2(H2O)
   1.955   1.759   0.252     -10.026     -87.110       Potassium tetracarbonyl-cobalt (FUBZAD)
   3.884   3.492   4.931     -10.093      26.957       Triiodo-trimethylphosphine-gold(iii) (ABANOH)
   3.252   2.922   2.879     -10.148     -11.470       Ammonium lanthanum sulfate (ICSD 20895)
   3.215   2.888   3.052     -10.171      -5.070       tris(Guanidinium) hexafluoro-tantalum (YAVZEB01)
   2.002   1.798   1.839     -10.190      -8.142       tris(O-Methyl dithiocarbonato-S,S')-antimony(iii) (FEXLUP)
   1.462   1.313   1.462     -10.192       0.000       Theophylline urea
   1.655   1.486   0.776     -10.211     -53.112       bis(mu-2-N,N-Diethyldithiocarbamato)-di-copper(i) (CUETSC)
   5.040   4.525   8.506     -10.218      68.770       Cesium hexafluorobismuthate (CsBiF6) (ICSD 15122)
   4.085   3.667   5.470     -10.233      33.905       Nitrogen iodide ammonia (N2H3I3) (ICSD 27416)
   1.990   1.783   1.913     -10.402      -3.869       Potassium formate (POTFRM)
   4.132   3.702   3.612     -10.407     -12.585       Brookite (TiO2)
   2.640   2.364   2.605     -10.455      -1.326       Tetramethylammonium fluorotetraoxoosmate (XAKBUG)
   1.652   1.478   1.525     -10.533      -7.688       tris(1-Pyrrolidinecarbodithioato)-antimony(iii) (PYCTSB)
   3.969   3.550   9.133     -10.557     130.108       Cobalt(iii) fluoride (CoF3)
   1.818   1.626   1.596     -10.561     -12.211       Hexamethylpiperidinium heptafluorotellurate (ROLSOA)
   1.562   1.397   1.302     -10.563     -16.645       Orthoboric acid
   2.777   2.483   2.907     -10.587       4.681       bis(bis(mu-2-Iodo)-(h4-1,3,5-trimethylcyclohexa-2,5-diene-1,4-diyl)-niobium) iodide (ZOWYAL)
   4.265   3.813   4.585     -10.598       7.503       Cesium chromate (Cs2CrO4) (ICSD 300021)
  10.773   9.629  10.100     -10.619      -6.247       Tungsten dioxide (WO2) (ICSD 80829)
   5.546   4.957   5.446     -10.620      -1.803       Arsenic (As) (ICSD 609832) orthorhombic
   6.393   5.711   4.098     -10.668     -35.899       Tin(ii) oxide (SnO) (ICSD 16481)
   2.295   2.050   2.282     -10.675      -0.566       Sodalite ((Na2O)3(NaCl)2(Al2O3)3(SiO2)6)
   1.910   1.706   1.778     -10.681      -6.911       Hydroxonium 18-Crown-6 clathrate hexafluorotantalate (SINSEO)
   1.862   1.663   2.498     -10.687      34.157       Potassium hexacyanoferrate (K3Fe(CN)6) (ICSD 23047)
   2.205   1.969   2.078     -10.703      -5.760       Hexamethylenediammonium hexafluoro-hafnium (RENPAB)
   2.405   2.144   2.413     -10.852       0.333       Potassium oxalate (QQQAZJ05)
   1.968   1.754   1.820     -10.874      -7.520       Potassium beryllium bis(malonate) hemihydrate (MALBEK)
   2.341   2.086   2.053     -10.893     -12.302       Potassium dihydrogenphosphate (KH2PO4) (ICSD 87895)
   9.340   8.318  10.721     -10.942      14.786       Litharge (PbO)
   1.880   1.673   1.539     -11.011     -18.138       1-Ethyl-3-methylimidazolium hexafluoroniobate-(MESBIW)
   8.307   7.391   6.717     -11.027     -19.140       Palladium(ii) oxide (PdO) (ICSD 24692)
   2.547   2.266   1.888     -11.033     -25.874       Natrite (Na2CO3)
   1.566   1.393   1.288     -11.047     -17.752       N,N-Dimethylaniline hexafluorobenzene (DMAFBZ01)
   1.756   1.561   1.493     -11.105     -14.977       Difluoropermethyltantalocene tetrafluoroborate (BAZNIZ)
   2.044   1.817   1.660     -11.106     -18.787       bis(Tetramethylammonium) hexafluoroplatinate(iv) (TMAPTF01)
   2.289   2.034   2.456     -11.140       7.296       Potassium carbonate (hexagonal) (K2CO3) (ICSD 1816694)
   2.115   1.879   0.000     -11.158    -100.000       Potassium (mu-2-acetato-O,O')-bis(mu-2-hydroxo)-(mu-2-N,N,N',N'-ethylenediaminetetra-acetato-N,N',O,O',O'',O''')-di-molybdenum(iii) bis(molybdenum(iii)) (HAENMO)
   6.896   6.126   5.335     -11.166     -22.636       Magnesium tungstate (MgWO4)
   4.957   4.400   7.071     -11.237      42.647       Iodine (I2)
   3.870   3.430   4.108     -11.370       6.150       Zinkosite (ZnSO4)
   4.004   3.548   3.639     -11.389      -9.116       Titanium(iii,iv) oxide (Ti3O5) (ICSD 75193)
   2.370   2.097   2.754     -11.519      16.203       Potassium hydrogen fluoride (KHF2) (ICSD 18094)
   4.887   4.324   7.706     -11.520      57.684       Magnesium hydrogen fluoride tetrafluoroaurate hexafluoroaurate (MgHF(AuF4)(AuF6)) (ICSD 415872)
   2.505   2.216   2.005     -11.537     -19.960       Tetra-potassium bis((mu-2-oxo)-bis(oxalato-O,O')-technetium(iv)) trihydrate (SOSSAU)
   4.859   4.297   3.653     -11.566     -24.820       Copper(ii) difluoride (CuF2)
   3.088   2.730   3.027     -11.593      -1.975       Euclase ((BeO)2(Al2O3)(SiO2)2(H2O))
   2.391   2.112   2.416     -11.669       1.046       Iodo-bis(ethylenediamine)-aqua-nickel(ii) iodide (IENANI)
   1.811   1.599   1.392     -11.706     -23.136       tetrakis(Imidazolidine-2-thione)-tellurium(ii) hexafluorosilicate (QAMCAJ)
   5.764   5.089   7.594     -11.711      31.749       Copper(i) iodide (CuI)
   1.570   1.386   0.922     -11.720     -41.274       pi-Allyl-di(thiourea) nickel(ii) chloride (ALTUNI10)
   5.346   4.719   5.341     -11.728      -0.094       Chromium(iii) oxide (Cr2O3) (ICSD 201104)
   1.964   1.733   1.269     -11.762     -35.387       Perchlorato-bis(1,4-oxathian)-silver(i) (CIJBIG)
   5.999   5.288   6.472     -11.852       7.885       Nickel(ii) iodide (NiI2)
   7.729   6.812   0.000     -11.864    -100.000       Platinum(ii) iodide (PtI2)
   2.754   2.427   2.373     -11.874     -13.834       Sodium aluminate (NaAlO2)
   2.542   2.240   2.341     -11.880      -7.907       Potassium silicate (K2SiO3) (ICSD 1321814)
   2.020   1.780   0.714     -11.881     -64.653       Sodium hydroxide (NaOH)
   5.157   4.536   4.911     -12.042      -4.770       Copper(i) bromide (CuBr)
   3.770   3.315   3.702     -12.069      -1.804       Xenon (Xe) (ICSD 9786)
   2.667   2.345   2.513     -12.073      -5.774       Arcanite (K2SO4)
   2.780   2.443   1.788     -12.122     -35.683       Rubidium formate (RbHCO2) (ICSD 172203)
   1.706   1.499   0.298     -12.134     -82.532       Tetramethyl-(pentamethyl-cyclopentadienyl)-iridium (BAHWOW)
   1.845   1.621   1.972     -12.141       6.883       bis(Methylammonium) tetrathiomolybdate(vi) (ADEGEW)
   2.393   2.102   2.416     -12.160       0.961       Dimethyl-(acetylacetonato)-gold(iii) (XIRPAQ)
   2.019   1.773   1.460     -12.184     -27.687       trans-Potassium bis(oxalato-O,O')-diaqua-chromium trihydrate (KOXACR)
   2.609   2.291   2.150     -12.189     -17.593       2-Chloro-1,3-dithia-2-stibacyclopentane (CLSSBP10)
   3.376   2.964   3.267     -12.204      -3.229       Diaspore (AlO(OH))
   3.895   3.419   3.379     -12.221     -13.248       Anatase (TiO2)
   1.911   1.676   1.644     -12.297     -13.972       (Nitrato-O)-bis(pyridine-4-carbonitrile-N)-silver(i) (FOHJIV)
   1.989   1.744   1.850     -12.318      -6.988       catena-((mu-8-Croconato)-di-aqua-di-potassium) (XEYYUV)
   6.173   5.412   5.748     -12.328      -6.885       Mercury(ii) iodide (HgI2) (ICSD 412988)
   1.735   1.519   1.421     -12.450     -18.098       catena(bis(Tetraethylammonium) (mu-3-thio)-hexakis(mu-2-thio)-tri-tin(iv)) (GIRHIY)
   2.050   1.794   1.614     -12.488     -21.268       Bis(cyanido)(ethane-1,2-diamine-N,N')silver(ii) (SILKEE)
   1.666   1.457   0.867     -12.545     -47.959       Tetramethylammonium diaqua-tetrafluoro-manganese(iii) (TMAFMN)
   2.469   2.156   2.354     -12.677      -4.658       Cesium EDTA-antimonate(iii) monohydrate (BAWGIP)
   1.995   1.742   1.685     -12.682     -15.539       bis(p-Cyclopentadienyl)hydroxy-methylamino molybdenum(iv) hexafluorophosphate (CHAMOF)
   1.854   1.618   1.664     -12.729     -10.248       beta-Alaninium EDTA-antimonate(iii) (BAWQIZ)
   6.234   5.440   6.372     -12.737       2.214       Hafnium(iii) triiodide (HfI3)
   2.076   1.811   1.542     -12.765     -25.723       Trichloro-(tetramethylthiourea)-antimony(iii) (BAHZUF)
   6.906   6.022   2.187     -12.800     -68.332       Iridium(iii) tribromide (IrBr3) (ICSD 14212)
   3.496   3.045   2.742     -12.900     -21.568       H5As3O10
   2.835   2.469   2.711     -12.910      -4.374       Alunite (KAl3(SO4)2(OH)6)
   4.914   4.279   6.146     -12.922      25.071       Zirconium(iv) tetraiodide (ZrI4) (ICSD 8068)
   2.962   2.579   2.073     -12.930     -30.014       Tetramethylammonium catena(di-iodo-silver(i)) (CEZHEU)
   7.761   6.757   4.611     -12.936     -40.588       Copper(ii) tungstate (CuWO4) (ICSD 84558)
   1.797   1.564   1.219     -12.966     -32.165       18-Crown-6-cesium dicyano-silver(i) (GOKZOV)
   6.930   6.025   6.043     -13.059     -12.799       Vanadinite (Pb5(VO4)3Cl)
   2.760   2.398   2.696     -13.116      -2.319       RbCl
   1.770   1.537   0.978     -13.164     -44.746       Ammine-(salicylaldehyde thiosemicarbazonato)-nickel(ii) (AMSCNI11)
   4.451   3.865   4.887     -13.166       9.796       Zirconium(iii) tribromide (ZrBr3)
   3.590   3.117   3.164     -13.175     -11.866       bis(Dichloro-tungstocenium) hexakis(mu-2-fluoro)-dodecakisfluoro-tetra-tungsten (JUTPET)
   2.335   2.027   2.029     -13.191     -13.105       bis((h5-Cyclopentadienyl)-(mu-2-fluoro)-(pentafluoro-arsenic))-vanadium(iv) (VUFFIL)
   5.907   5.127   5.902     -13.205      -0.085       Lead(ii) chloride (PbCl2)
   2.491   2.160   2.170     -13.288     -12.886       (mu-2-Oxo)-tetrakis(h5-cyclopentadienyl)-dimethyl-di-tungsten bis(hexafluorophosphate) (ZISMAP)
   6.173   5.350   5.859     -13.332      -5.087       Mercury diiodide (HgI2)
   1.110   0.962   1.059     -13.333      -4.595       Tetramethyldiphosphane (KAKGEI)
   2.728   2.364   1.966     -13.343     -27.933       Disodium silicate (Na2SiO3) (ICSD 74640)
   2.264   1.961   1.790     -13.383     -20.936       bis(tris(Dimethylamino)sulfonium) bis(mu-2-fluoro)-tetrakis(trifluoromethyl)-mercury (TUQSUT)
   1.896   1.641   0.615     -13.449     -67.563       bis(chloro-(1,3,4,5-tetramethylimidazol-2-ylidene)-silver(i)) (HEBMIL)
   2.661   2.302   3.037     -13.491      14.130       Potassium bis(oxalato)-tin(ii) monohydrate (KSNOXL)
   2.438   2.108   2.129     -13.536     -12.674       tris(2-Ammonioethyl)amine heptafluoro-tantalum fluoride (QAJJIV)
   3.559   3.075   5.242     -13.599      47.289       Ruthenium(viii) tetroxide (RuO4) (ICSD 415303)
   6.321   5.450   6.235     -13.779      -1.361       Anglesite (PbSO4) (ICSD 109432)
   1.469   1.266   1.294     -13.819     -11.913       Tetraphosphabicyclooctane (XEYZEG)
   7.654   6.596   6.241     -13.823     -18.461       Mercury bromide (HgBr) (ICSD 1405393)
   3.592   3.094   3.001     -13.864     -16.453       Kosmochlor (Si2CrNaO6)
   3.574   3.078   3.745     -13.878       4.785       Potassium dihydrogen arsenate (KHAs2O6)
   2.183   1.879   1.692     -13.926     -22.492       bis(Guanidinium) sulfato-trifluoro-antimony(iii) (BEYXAE)
   1.552   1.334   1.244     -14.046     -19.845       trans-Dichloro-tetrakis(trimethylphosphine)-technetium(iii) hexafluorophosphate (QESMOQ)
   4.658   4.000   5.599     -14.126      20.202       Titanium(ii) dibromide (TiBr2) (ICSD 26078)
   5.937   5.096   7.074     -14.165      19.151       Ho Complex Sparkle (ICSD 200096)
   2.019   1.732   2.453     -14.215      21.496       Potassium nitrite (KNO2) (ICSD 86117)
   2.025   1.737   2.426     -14.222      19.802       Potassium nitrite (KNO2) (ICSD 1906878)
   1.719   1.474   0.855     -14.252     -50.262       bis(1,1-Dimethylethylene-2,2-dithiolato-S,S')-copper(ii) (COYZOG)
   2.155   1.847   1.560     -14.292     -27.610       18-Crown-6 potassium tricarbonyl-tri-iodo-ruthenium (FEHGEE)
   4.571   3.915   4.143     -14.351      -9.363       Titanium(iii) oxide (Ti2O3) (ICSD 9646)
   2.896   2.480   3.416     -14.365      17.956       Potassium catena(tris(mu-2-formato)-cadmium) (CAHMUT)
   1.845   1.579   1.261     -14.417     -31.653       (6-Methyl-2-pyridinecarboxylato-N,O)-(6-methyl-2-pyridinecarboxylic acid-N,O)-silver(i) (UBEGOX)
   5.072   4.340   5.819     -14.432      14.728       Lanthanum(iii) tribromide (LaBr3)
   4.129   3.533   3.837     -14.434      -7.072       Copper(i) chloride (CuCl)
   2.643   2.259   2.584     -14.529      -2.232       Nepheline ((KNa3O2)(Al2O3)2(SiO2)4)
   5.626   4.807   9.075     -14.557      61.305       Molybdenum(iii) triiodide (MoI3)
   6.359   5.428   6.113     -14.641      -3.869       Lead silicate (PbSiO3) (ICSD 250220)
   5.034   4.296   4.097     -14.660     -18.613       Yttrium(iii) oxide (Y2O3) (ICSD 81861)
   3.547   3.026   1.843     -14.688     -48.041       1,4-Diselenane bis(iodine) (DSEIOD)
   2.777   2.368   2.112     -14.728     -23.947       Sodium chromate (Na2CrO4) (ICSD 26330)
   2.443   2.083   2.372     -14.736      -2.906       Potassium carbonate (K2CO3) (ICSD 10191)
   3.393   2.892   3.844     -14.766      13.292       Triethylsulfonium tetraiodoaurate (GEJQIV)
   6.894   5.867   6.387     -14.897      -7.354       Zinc oxide (ZnO) (Cubic) (ICSD 38222)
   2.192   1.865   1.305     -14.918     -40.465       Titanium(iv) nitrate (Ti(NO3)4)
   5.083   4.321   0.000     -14.991    -100.000       Boleite (KPb26Ag9Cu24Cl62(OH)48)
   3.865   3.285   5.616     -15.006      45.304       Potassium iodate (hexagonal) (KIO3) (ICSD 97995)
   1.921   1.629   1.872     -15.200      -2.551       Calcium bis(dithio-oxalato-S,S')-nickel hexahydrate (CUPREK)
   3.143   2.664   3.801     -15.240      20.935       Andalusite (Al2SiO5)
   3.069   2.601   1.800     -15.249     -41.349       Rubidium perchlorate (RbClO4) (ICSD 63363)
   2.588   2.193   2.008     -15.263     -22.411       Lithium disodium phosphate (LiNa2PO4) (ICSD 69967)
   3.219   2.727   1.043     -15.284     -67.599       Iodo-di(cyclopentadienyl)-ruthenium tri-iodide (RUTCIT10)
   2.880   2.438   1.839     -15.347     -36.146       Rubidium hydrogen sulfate (RbHSO4) (ICSD 36326)
   3.686   3.119   3.278     -15.383     -11.069       Zirconium(iv) sulfate (ZrS2O8) (ICSD 16001)
   3.989   3.374   3.927     -15.417      -1.554       Corundum (Al2O3)
   3.170   2.681   3.636     -15.426      14.700       bis((mu-2-Methylamido)-dimethyl-gold(iii)) (DEVLUL)
   3.174   2.684   2.701     -15.438     -14.902       Titanium(ii) dichloride (TiCl2) (ICSD 23177)
   3.960   3.346   3.938     -15.505      -0.556       Rhodium(V) pentafluoride (RhF5) (ICSD 10173)
   2.684   2.266   2.462     -15.574      -8.271       bis(Acetonitrile)-fluoro-tetramethyl-tungsten hexafluoro-tungsten (RETNAF)
   1.941   1.634   1.225     -15.817     -36.888       Potassium hydroxide hydrate (KOH (H2O)) (ICSD 47114)
   1.941   1.634   0.918     -15.817     -52.705       Potassium hydroxide hydrate (KOH H2O) (ICSD 1706151)
   3.535   2.975   3.627     -15.842       2.603       Cesium hydrogen carbonate (CsHCO3) (ICSD 300259)
   5.239   4.408   5.925     -15.862      13.094       Tantalum(v) pentabromide (TaBr5) (ICSD 109324)
   6.554   5.507   0.000     -15.975    -100.000       Lutetium phosphate (LuPO4) (ICSD 79761)
   1.985   1.667   0.190     -16.020     -90.428       Cyclopentadienyl-disulfur-dinitride-cobalt (BEMGIJ01)
   3.667   3.078   4.292     -16.062      17.044       Kyanite (Al2SiO5)
   2.130   1.786   1.787     -16.150     -16.103       Phosphorus sulfide (P4S3) (ICSD 417154)
   2.167   1.817   2.026     -16.151      -6.507       Kalicinite (KHCO3)
   1.940   1.626   1.466     -16.186     -24.433       tris(18-Crown-6 Diammine potassium) undeca-antimonide ammonia solvate (DELHAE)
   3.638   3.049   3.229     -16.190     -11.242       Cyano-(methylisocyanide)-gold(i) (CYMIAU)
   7.599   6.368   3.418     -16.199     -55.020       Mercury bromide (Hg2Br2) (ICSD 31174)
   5.909   4.949   1.778     -16.246     -69.910       Gallium (Ga) (ICSD 634202)
   4.048   3.385   2.896     -16.378     -28.458       Cesium sulfate (Cs2SO4) (ICSD 1617377)
   2.048   1.712   1.884     -16.406      -8.008       Ammonium hexafluorosilicate (2(NH4)SiF6) (ICSD 1120016)
   2.989   2.498   1.467     -16.427     -50.920       Scandium (Sc) (ICSD 52411) hcp
   3.510   2.931   3.697     -16.496       5.328       Tribromo-(trimethylphosphine) gold (BRMPAU)
   7.537   6.291   7.827     -16.532       3.848       Er Complex Sparkle (ICSD 34473)
   3.532   2.944   2.388     -16.648     -32.390       Nickel(ii) chloride (NiCl2)
   3.349   2.786   3.452     -16.811       3.076       RbBr
   3.345   2.782   1.612     -16.831     -51.809       CsHSO4
   3.754   3.121   0.624     -16.862     -83.378       Ruthenium(iii) trichloride (RuCl3) (ICSD 414040)
   4.370   3.633   2.970     -16.865     -32.037       Yttrium (Y) (ICSD 95167) hcp
   3.646   3.028   0.981     -16.950     -73.094       Xenon hexafluoride (XeF6) (ICSD 416320)
   5.305   4.404   6.116     -16.984      15.287       Niobium(v) pentaiodide (NbI5) (ICSD 10457)
   3.835   3.183   2.184     -17.001     -43.051       Scandium(iii) oxide (Sc2O3) (ICSD 41264)
   1.497   1.242   1.106     -17.034     -26.119       bis(h5-Pentamethyl-cyclopentadienyl)-lutetium-dimethylphosphonio-bis(methanide) (CIXTUY)
   5.124   4.249   4.053     -17.077     -20.902       Disodium tungstate (Na2WO4)
   3.981   3.301   5.698     -17.081      43.130       Potassium iodate (cubic) (KIO3) (ICSD 28545)
   3.102   2.571   3.228     -17.118       4.062       Potassium molybdate (K2MoO4) (ICSD 16154)
   3.004   2.489   3.107     -17.144       3.429       Brazilianite (NaAl3(PO4)2(OH)4)
   8.244   6.816   5.681     -17.322     -31.089       Lead tungstate (PbWO4) (ICSD 16189)
   2.003   1.654   1.903     -17.424      -4.993       bis(Tetramethylammonium) hexafluoro-osmium(iv) (UFEPEA)
   2.421   1.999   1.822     -17.431     -24.742       Lithiophosphate (Li3PO4)
   1.755   1.448   0.974     -17.493     -44.501       bis(Hydrogen dimethylglyoximato)-nickel (NIMGLO12)
   1.879   1.550   1.848     -17.509      -1.650       Dimethylarsino dimethyldithioarsinate (DMSARS01)
   3.025   2.494   0.995     -17.554     -67.107       Tetramethylammonium catena-((mu-4-bromo)-bis(mu-2-bromo)-di-silver(i)) (FAGGOJ)
   2.838   2.339   2.289     -17.583     -19.345       Phosphorus, black (P) (ICSD 36438)
   1.938   1.596   1.621     -17.647     -16.357       Ammonia - boron trifluoride (NH3BF3) (ICSD 94885)
   2.864   2.357   2.253     -17.703     -21.334       Lithium sodium potassium cesium silicate (Li12Na2KCsSi4O16)
   2.417   1.989   1.514     -17.708     -37.360       (tetrachlorophthalato)-ammine-silver diammine-silver monohydrate (RIVTUM)
   4.415   3.633   4.062     -17.712      -7.995       Magnesium dichromate (MgCr2O4) (ICSD 160953)
   8.912   7.332   3.807     -17.729     -57.282       Nickel (Ni) (ICSD 64989) fcc
   2.841   2.335   1.991     -17.811     -29.919       Rubidium hydroxide hydrate (RbOH (H2O)) (ICSD 47115)
   3.626   2.980   4.152     -17.816      14.506       Cesium nitrate (CsNO3) (ICSD 60579)
   2.838   2.332   2.901     -17.829       2.220       bis(mu-2-(Dimethyldimethylene-phosphoranyl-C,C))-iodomethyl-di-gold(ii) (BIBPIL)
   3.550   2.917   2.848     -17.831     -19.775       RbI
   2.917   2.394   4.439     -17.929      52.177       bis(mu-2-Acetato)-tetramethyl-di-gold(iii) (MIRFUP)
   5.028   4.117   5.120     -18.119       1.830       Gold(iii) trichloride (AuCl3) (ICSD 22146)
   5.000   4.093   5.538     -18.140      10.760       Cesium iodate (CsIO3) (ICSD 61009)
   3.530   2.879   3.484     -18.442      -1.303       tetrakis((mu-2-Hydroxo)-dimethyl-gold) (DMAUHT)
   2.375   1.936   0.000     -18.484    -100.000       tris(dithioacetato)-iridium (CEDFEX)
   2.420   1.971   1.809     -18.554     -25.248       Trimethylselenonium iodide (METSEI01)
   4.263   3.471   3.664     -18.578     -14.051       Cr2SiO4
   2.736   2.225   2.722     -18.677      -0.512       Tarapacaite (K2CrO4)
   2.901   2.358   1.803     -18.718     -37.849       Dirubidium oxalate hydrate (Rb2C2O4 H2O) (ICSD 240494)
   5.006   4.067   5.277     -18.757       5.414       Cesium iodate cubic (CsIO3) (ICSD 308773)
   5.040   4.091   6.395     -18.829      26.885       Titanium(iv) tetraiodide (TiI4) (ICSD 39820)
   5.185   4.207   7.165     -18.862      38.187       Zirconium(iii) triiodide (ZrI3)
   4.399   3.569   5.219     -18.868      18.641       Sodium iodate (NaIO3) (ICSD 20168)
   3.120   2.528   3.019     -18.974      -3.237       KI
   6.632   5.373  12.003     -18.984      80.986       Lutetium(iii) trifluoride (LuF3)
   3.312   2.680   3.204     -19.082      -3.261       Iodo-(ethane-1,2-dithiolato)-antimony (AFOFAD)
   1.587   1.284   0.624     -19.093     -60.681       chloro-(1,3-bis(adamantyl)imidazol-2-ylidene)-silver(i) (HEBMUX)
   9.522   7.699  11.100     -19.145      16.572       Lutetium(iii) oxide (Lu2O3) (ICSD 151762)
   3.368   2.722   4.333     -19.181      28.652       Cesium perchlorate (CsClO4) (ICSD 63364)
   4.999   4.031  10.434     -19.364     108.722       Molybdenum disulfide (MoS2) (ICSD 601647)
  21.443  17.280  20.562     -19.414      -4.109       Platinum (Pt) (ICSD 649490) fcc
   1.864   1.502   1.450     -19.421     -22.210       tris(Dithiolene)-vanadium(iv) (NAMPOG)
   3.922   3.157   4.486     -19.505      14.380       Pyridinium tetrakis(iodo)-gold(iii) (UCILUO)
   2.109   1.697   2.470     -19.535      17.117       Niter (KNO3)
   5.491   4.396   5.095     -19.942      -7.212       Selenium (Se) (ICSD 200685)
   4.747   3.798   5.359     -19.992      12.892       Rubidium hexafluorothallate(iii) (Rb3TlF6) (ICSD 19075)
   2.844   2.273   3.483     -20.077      22.468       Lanthanum(iii) sulfate nonahydrate (La2(SO4)3 9(H2O)) (ICSD 1408775)
   2.310   1.846   2.608     -20.087      12.900       Dibromo-(2-(2-aminoethyl)pyridine) copper(ii) (BAEPYC)
  11.420   9.123  19.348     -20.114      69.422       Lead (Pb) (ICSD 77863)
   3.295   2.629   3.103     -20.212      -5.827       Jadeite ((Na2O)(Al2O3)(SiO2)2)
   4.175   3.331   5.148     -20.216      23.305       Sodium periodate (NaIO4) (ICSD 14287)
   2.398   1.912   2.146     -20.267     -10.509       1-Ethyl-3-methylimidazolium hexafluorotantalate (MESBOC)
   4.031   3.211   4.446     -20.342      10.295       Malachite (Cu2CO3(OH)2)
   3.447   2.744   4.682     -20.395      35.828       Lanthanum(iii) nitrate (La(NO2)3) (ICSD 281587)
   3.377   2.684   2.755     -20.521     -18.419       bis(Diammine-silver(i)) dioxalato-platinum(ii) (TEJKOJ)
   4.706   3.739   3.979     -20.548     -15.448       Molybdenum(vi) trioxide (MoO3)
   5.166   4.103   3.272     -20.577     -36.663       Osmium(viii) tetroxide (OsO4)
   3.735   2.966   3.602     -20.589      -3.561       Beryllium hexaaluminate (BeAl6O10) (ICSD 95408)
   7.180   5.672   1.374     -21.003     -80.864       Ruthenium(iv) dioxide (RuO2) (ICSD 84619)
   2.959   2.334   2.076     -21.122     -29.841       Copper(II) fluoride, dihydrate (CuF2 2(H2O)) (ICSD 31768)
   4.036   3.175   1.725     -21.333     -57.260       Cesium tris(tetrafluorooxoxenon(VI)) fluoride (Cs(XeOF4)3F) (ICSD 49680)
   2.597   2.041   2.222     -21.409     -14.440       Di-potassium bis(tartrato)-di-antimony trihydrate (DKSBTR)
   3.012   2.367   2.588     -21.414     -14.077       Me3AsI2 (ZODJOR)
   0.691   0.542   0.962     -21.563      39.219       Lithium borohydride (XIHFAW)
   3.757   2.936   4.172     -21.853      11.046       Bromo-dimethylsulfido-gold(i) (GIGWAU)
  22.575  17.622   0.000     -21.940    -100.000       Iridium (Ir) (ICSD 640730) fcc
   4.199   3.269   4.398     -22.148       4.739       Dipotassium tungstate (K2WO4)
   2.605   2.027   2.430     -22.188      -6.718       Lithium aluminum oxide (LiAlO2) (ICSD 1400353)
   2.655   2.065   2.139     -22.222     -19.435       Rubidium amide (RbNH2) (ICSD 50484)
   1.652   1.279   1.596     -22.579      -3.390       Potassium amide (KNH2) (ICSD 24519)
   2.023   1.564   1.509     -22.689     -25.408       1-ethyl-3-methylimidazolium hexafluoroantimonate (AQEYIE)
   7.344   5.677   2.423     -22.699     -67.007       Iridium(iii) triiodide (IrI3) (ICSD 541775)
   4.436   3.422   5.344     -22.858      20.469       Lanthanum(iii) hydroxide (La(OH)3) (ICSD 548159)
   1.979   1.525   1.616     -22.941     -18.343       Phosphorus, white (P) (ICSD 406793)
   3.781   2.911   3.366     -23.010     -10.976       Chrysoberyl ((BeO)(Al2O3))
   5.095   3.922   0.063     -23.023     -98.763       Osmium(vi) hexafluoride (OsF6)
   1.243   0.955   0.275     -23.170     -77.876       Sodium borohydride (NaBH4) (ICSD 1621293)
   3.378   2.591   2.811     -23.298     -16.785       Er Complex Sparkle (ICSD 413883)
   4.658   3.572   4.513     -23.315      -3.113       Stibnite (Sb2S3)
   8.648   6.617   3.977     -23.485     -54.012       Cadmium (Cd) (ICSD 619641) hcp
   5.475   4.184   7.293     -23.580      33.205       Vanadium(ii) diiodide (VI2)
   4.109   3.138   6.476     -23.631      57.605       Cesium hexafluoroantimonate (CsSbF6) (ICSD 201886)
   2.765   2.108   2.524     -23.761      -8.716       Hexamethyldistibonium bis(hexafluoroantimonate) sulfur dioxide (BOFPER)
   3.303   2.517   2.014     -23.797     -39.025       Rubidium metaborate (RbBO2) (ICSD 1005205)
   8.583   6.534   7.215     -23.873     -15.938       Niobium (Nb) (ICSD 76416) bcc
   1.103   0.839   0.246     -23.935     -77.697       Disilyl ether ((SiH3)2O)
   3.782   2.876   4.666     -23.956      23.374       Rubidium yttrium(iii) hexafluoride (Rb3YF6) (ICSD 19077)
   4.006   3.041   3.258     -24.089     -18.672       Antimony sulfate (Sb2(SO4)3) (ICSD 618)
   3.572   2.709   3.393     -24.160      -5.011       Periclase (MgO)
   1.964   1.481   1.497     -24.593     -23.778       bis(3-Hydroxypyridine-N)-(nitrato-O,O')-silver(i) (MAPNEX)
   4.277   3.223   4.705     -24.643      10.007       Aluminum antimonide (AlSb)
   4.628   3.482   3.267     -24.762     -29.408       Rubidium iodate (RbIO3) (ICSD 2825)
   2.268   1.703   2.306     -24.912       1.675       2,2'-Bipyridyl potassium dicyano-gold(i) (PCAUPY)
   2.186   1.640   1.898     -24.977     -13.175       catena-(Butane-1,4-diammonium (mu-2-1-hydroxyethyldiphosphonato)-antimony(iii)) (AHEKED)
   8.939   6.703   6.656     -25.014     -25.540       Copper (Cu) (ICSD 627113)
   4.628   3.467   3.368     -25.086     -27.226       Rubidium iodate hexagonal (RbIO3) (ICSD 1401730)
   4.060   3.041   4.037     -25.099      -0.567       LiI
   2.217   1.660   1.531     -25.124     -30.943       Potassium deuteriooxide (KOH) (ICSD 65163)
   2.624   1.962   2.428     -25.229      -7.470       Scandium(iii) trifluoride (ScF3)
   5.891   4.382   0.000     -25.615    -100.000       Silver iodate (AgIO3) (ICSD 14100)
   1.243   0.924   0.406     -25.664     -67.337       Potassium borohydride (KBH4) (ICSD 99264)
   1.944   1.444   1.575     -25.720     -18.981       tetrakis(mu-2-1,3,4,6,7,8-Hexahydropyrimido(1,2-a)pyrimidinato)-tetra-silver(i) (UMIFEB)
   3.991   2.961   3.842     -25.808      -3.733       CsCl
   2.246   1.661   1.693     -26.046     -24.622       (1,1,3,3-Tetraoxo-1,3,2-benzodithiazolido)-acetonitrile-silver(i) (WAKMAW)
   2.790   2.059   1.129     -26.201     -59.534       (5-Carboxy-1H-imidazole-4-carboxylato)-diammine-silver(i) (DUKMOM)
   1.686   1.244   1.139     -26.216     -32.444       mu-2-(h5,h5-Cyclopentadienyl)-bis((h5-cyclopentadienyl)-nickel(ii)) tetrafluoroborate (TCPNIB10)
   3.217   2.366   3.310     -26.453       2.891       Lithium iodide hydrate (LiI H2O) (ICSD 86231)
   4.548   3.328   4.440     -26.825      -2.375       Rubidium triiodovanadate(ii) (RbVI3) (ICSD 26455)
   3.266   2.379   2.528     -27.159     -22.596       Cesium hexafluoro-2,2,2-trifluoroethoxy-tungsten(vi) acetonitrile solvate (JONCAQ)
   1.822   1.327   1.055     -27.168     -42.097       bis(Tetraoxacyclododecane)-silver hexafluoroarsenate (CIJWIB)
   8.241   5.997   5.176     -27.230     -37.192       Cadmium oxide (CdO) (ICSD 620206)
   5.663   4.113   5.148     -27.371      -9.094       Niobium(iii) triiodide (NbI3) (ICSD 109145)
   1.620   1.170   1.024     -27.778     -36.790       bis(Cyclo-octadiene)-silver(i) tetrafluoroborate (OCDAGB)
   4.852   3.501   2.121     -27.844     -56.286       Silver hexafluoroantimonate (AgSbF6) (ICSD 411795)
   3.690   2.660   2.085     -27.913     -43.496       Rubidium chromate (Rb2CrO4) (ICSD 280457)
   7.601   5.471   8.075     -28.023       6.236       Galena (PbS)
   6.281   4.519   0.705     -28.053     -88.776       Rhodium(iii) triiodide (RhI3) (ICSD 541773)
  12.004   8.635   5.710     -28.066     -52.433       Palladium (Pd) (ICSD 648680) fcc
   1.711   1.225   0.714     -28.404     -58.270       (mu-3-Ethylidyne)-tris((cyclopentadienyl)-nickel) (GINJIW)
   3.821   2.729   3.974     -28.579       4.004       Tribromo-dimethylsulfido-gold(iii) (GIGWEY)
   2.799   1.999   0.849     -28.582     -69.668       tris(mu-2-Iodo)-bis(h5-pentamethylcyclopentadienyl)-di-iridium hexafluorophosphate (GUSJEJ)
   3.216   2.293   2.630     -28.700     -18.221       Disodium selenate (Na2SeO4) (ICSD 150706)
  14.437  10.278   8.702     -28.808     -39.724       Mercury (Hg) (ICSD 104296) hcp
   1.897   1.347   1.083     -28.993     -42.910       Ammine-(2,2'-bipyridine)-silver(i) nitrate (KUQPOC)
   2.851   2.019   2.271     -29.183     -20.344       Rubidium sulfide (Rb2S) (ICSD 1009010)
   6.750   4.756   5.943     -29.541     -11.956       Antimony(v) pentoxide (Sb2O5) (ICSD 1422)
   1.970   1.385   2.108     -29.695       7.005       Molybdenum hexacarbonyl (Mo(CO)6) (ICSD 30809)
   2.198   1.542   1.544     -29.845     -29.754       Iodo-(1,4,7-trithiacyclononane-S,S',S'')-copper(i) (FITDUH)
   2.784   1.945   0.997     -30.136     -64.188       (mu-2-Hydrogen 1H-imidazole-4,5-dicarboxylate-N,N')-bis(ammine)-di-silver(i) (DUKMOM01)
   3.995   2.776   7.064     -30.513      76.821       Rubidium hexafluoroantimonate (RbSbF6) (ICSD 408071)
   1.976   1.368   1.482     -30.769     -25.000       di-pyridine-silver(i) perchlorate (NEVRAI)
  19.254  13.279   0.000     -31.033    -100.000       Tungsten (W) (ICSD 43667) bcc
   3.200   2.203   3.446     -31.156       7.688       RbF
  22.594  15.551  25.027     -31.172      10.768       Osmium (Os) (ICSD 747701) hcp
  12.425   8.536   8.330     -31.300     -32.958       Rhodium (Rh) (ICSD 52064) fcc
   2.466   1.681   2.027     -31.833     -17.802       bis(bis(Ethylenedithio)-tetrathiafulvalene) di-iodo-gold(i) (DECCUJ02)
   7.740   5.275   6.212     -31.848     -19.742       Mercury iodide (Hg2I2) (ICSD 36197)
   3.560   2.424   1.856     -31.910     -47.865       Rubidium nitrate (hexagonal) (RbNO3) (ICSD 1614238)
   1.711   1.162   1.234     -32.086     -27.878       Argon (Ar) (ICSD 77918)
   1.530   1.037   0.565     -32.222     -63.072       Oxygen (O2) (ICSD 18311)
   3.127   2.117   1.927     -32.299     -38.375       Rhodium(vi) hexafluoride (RhF6) (ICSD 1300606)
   2.106   1.425   0.509     -32.336     -75.831       bis(5,7-Dimethyl-1,8-naphthyridin-2(1H)-one)-di-silver(i) (HEVXOW)
   2.547   1.721   2.671     -32.430       4.868       Silver nitrate-pyrazine complex (AGPYRZ)
   5.587   3.768   5.580     -32.558      -0.125       Antimony(iii) trioxide (Sb4O6) (ICSD 16851)
   3.899   2.629   0.000     -32.572    -100.000       Brochantite (Cu4(SO4)(OH)6)
   2.928   1.973   0.000     -32.616    -100.000       Turquoise (CuAl6(PO4)4(OH)8 5(H2O))
   5.053   3.404   1.846     -32.634     -63.467       Lithium hexafluorobismuthate (LiBiF6) (ICSD 15119)
   3.719   2.503   1.676     -32.697     -54.934       catena-(bis(Methylenedithiotetraselenafulvalene) polyiodide) (IWOFAB)
   2.184   1.465   1.601     -32.921     -26.694       Sodium hydrogen fluoride (NaHF2) (ICSD 415006)
   5.857   3.927   0.000     -32.952    -100.000       Cobalt(ii) difluoride (CoF2) (ICSD 73460)
   2.979   1.994   2.274     -33.065     -23.666       Rubidium acetylide (Rb2C2) (ICSD 51529)
   3.238   2.165   0.641     -33.138     -80.204       Hexaoxacyclododecane-di-silver silver tris(hexafluoro-arsenic) (CADXOU)
   3.633   2.428   2.213     -33.168     -39.086       Rubidium sulfate (Rb2SO4) (ICSD 203159)
   5.368   3.587   9.805     -33.178      82.656       Tantalum(V) pentafluoride (TaF5) (ICSD 171155)
   1.015   0.671   0.256     -33.892     -74.778       Sodium (Na) (ICSD 644901)
   3.342   2.200   1.920     -34.171     -42.549       Rubidium oxalate (Rb2C2O4) (ICSD 1003511)
   2.152   1.416   1.586     -34.201     -26.301       Cyano-(ethane-1,2-diamine)-silver(i) (FILSEZ)
   3.825   2.514   2.405     -34.275     -37.124       Rubidium phosphate (Rb3PO4) (ICSD 161677)
   3.341   2.170   2.089     -35.049     -37.474       Rubidium carbonate (Rb2CO3) (ICSD 414122)
   4.550   2.942   0.932     -35.341     -79.516       Xenon trioxide (XeO3) (ICSD 26627)
   3.254   2.103   3.215     -35.372      -1.199       Aluminum nitride (AlN)
   2.782   1.796   1.514     -35.442     -45.579       Zirconium(iv) tetrachloride (ZrCl4) (ICSD 26049)
   2.585   1.665   1.197     -35.590     -53.694       (mu-2-Phthalato-O,O')-diammine-di-silver(i) (RABVUL)
   1.977   1.273   0.726     -35.610     -63.278       (2,2'-Bipyridine-N,N')-(trifluoroacetato-O)-silver(i) (MAYBAQ)
   1.999   1.283   0.325     -35.818     -83.742       tetrakis(mu-2-Dithioacetato-O,O')-di-nickel(ii) (DEPPAP)
   3.353   2.151   2.083     -35.848     -37.877       Rubidium deuteriooxide (RbOD) (ICSD 60976)
   2.118   1.355   0.665     -36.025     -68.602       bis(2-Imidazolidinethione-S)-(thiocyanato-S)-silver(i) (SCYNAG01)
   2.870   1.831   2.883     -36.202       0.453       Tetramethylammonium auride (ICICAY)
   1.882   1.199   2.337     -36.291      24.176       Chromium hexacarbonyl (Cr(CO)6))
   9.784   6.227   0.000     -36.355    -100.000       Lutetium (Lu) (ICSD 642414)
   7.200   4.573  18.295     -36.486     154.097       Chromium (Cr) (ICSD 64711) bcc
   2.042   1.290   0.890     -36.827     -56.415       Chloro-trithia-9-crown-3-silver(i) (JAVWIM)
   3.836   2.423   2.421     -36.835     -36.887       Potassium fluorotrioxoxenate (KXeO3F) (ICSD 15219)
   1.805   1.132   1.044     -37.285     -42.161       Hydrogen fluoride (HF) (ICSD 1940)
   8.237   5.154  11.097     -37.429      34.721       Tantalum(v) pentoxide (Ta2O5) (ICSD 95462)
  19.290  12.033  17.549     -37.621      -9.025       Gold (Au) (ICSD 52249)
   2.022   1.252   1.283     -38.081     -36.548       Dinitrato-(2,2'-bipyridyl) silver(ii) (NDPYAG)
   1.823   1.127   1.441     -38.179     -20.954       bis(mu-2-Triethyl betaine)-bis((nitrato)-silver(i)) (KUDKOJ)
   5.567   3.428   3.381     -38.423     -39.267       Osmium(v) pentafluoride (OsF5) (ICSD 14117)
   3.412   2.095   2.737     -38.599     -19.783       Sodium selenate (Na2SeO3) (ICSD 280941)
   3.655   2.234   2.984     -38.878     -18.358       bis(1,2,4-Triseleno-3,5-diazolium) bis(hexafluoroarsenate) (KAZBIW)
   4.933   3.002   5.623     -39.145      13.987       Dimethylgold-bis(mu-2-bromo)-dibromo-gold (MEBRAU)
   2.916   1.773   1.908     -39.198     -34.568       (mu-2-Oxo)-bis(difluoro-urea-antimony) (UROFSB10)
   2.422   1.471   0.206     -39.265     -91.495       (mu-2-Propane-1,3-diamine)-dicyano-di-silver(i) (FILSOJ)
   3.539   2.138   2.123     -39.587     -40.011       Rubidium deuteriooxide (RbOD) (ICSD 60974)
   4.357   2.595   1.977     -40.441     -54.625       Cesium xenon heptafluoride (CsXeF7) (ICSD 404986)
   1.496   0.887   1.388     -40.709      -7.219       Cyano-bis(piperidine-N)-silver(i) (JEYDIB)
   3.679   2.178   2.099     -40.799     -42.946       Rubidium fluoride carbonate (Rb3FCO3) (ICSD 66029)
   2.679   1.571   2.825     -41.359       5.450       Copper(ii) nitrate (Cu(NO3)3) (ICSD 28447)
   4.508   2.640   8.574     -41.437      90.195       Titanium (Ti) (ICSD 653280) hcp
   4.203   2.459   5.513     -41.494      31.168       Barium (Ba) (ICSD 108091) bcc
   5.300   3.092   0.688     -41.660     -87.019       Ruthenium(iii) tribromide (RuBr3) (ICSD 413691)
   6.829   3.980   6.343     -41.719      -7.117       Tantalum bromide (Ta6Br14) (ICSD 402031)
   7.567   4.405   0.000     -41.787    -100.000       Iron (Fe) (ICSD 631733) bcc
   5.512   3.192   7.703     -42.090      39.750       Bismuth pentafluoride (BiF5) (ICSD 25023)
   1.805   1.041   0.196     -42.327     -89.141       bis(Pentadienyl)-di-nickel (PDYDNI)
   4.106   2.341   0.000     -42.986    -100.000       Silver(i) syn-anti-methane-disulfonate (MEDSUL)
   2.139   1.199   2.330     -43.946       8.929       Aqua-(4-chlorobenzoato-O)-silver(i) (RACZIF)
   3.532   1.950   3.991     -44.790      12.995       Niobium(v) pentafluoride (NbF5) (ICSD 26647)
   3.929   2.147   4.098     -45.355       4.301       Potassium silver carbonate (KAgCO3) (ICSD 1903697)
   4.028   2.171   2.080     -46.102     -48.361       Rubidium oxide (Rb2O) (ICSD 77676)
   5.698   3.071   7.660     -46.104      34.433       Silver periodate (AgIO4)
   3.301   1.743   0.687     -47.198     -79.188       bis(mu-2-Aminomethylnitrosolate)-di-silver(i) (KUXWAB)
   7.109   3.735  14.535     -47.461     104.459       Osmium(iii) triiodide (OsI3)
   1.805   0.924   0.257     -48.809     -85.762       bis((mu-2-Carbonyl)-(cyclopentadienyl)-nickel) (CBCNIB)
   5.501   2.814   1.263     -48.846     -77.041       Silver sulfate (Ag2SO4) (ICSD 27655)
  16.702   8.403  14.015     -49.689     -16.088       Tantalum (Ta) (ICSD 652900) bcc
   2.442   1.183   1.097     -51.556     -55.078       Acetonitrile-perfluoroisopropyl-silver (DUJXEL)
   7.474   3.605   7.777     -51.766       4.054       Manganese (Mn) (ICSD 44932) complex
   2.745   1.247   2.317     -54.572     -15.592       tetrakis((mu-2-trans-Perfluoro-1-methyl-1-propenyl)-silver) (LAJJEL)
   6.974   3.112   7.271     -55.377       4.259       Tantalum iodide (Ta6I14) (ICSD 300282)
  10.501   4.587   0.889     -56.318     -91.534       Silver (Ag) (ICSD 64706)
   5.912   2.582   7.342     -56.326      24.188       Gold(iii) tribromide (AuBr3) (ICSD 4069)
   7.136   3.072  15.142     -56.951     112.192       Zinc (Zn) (ICSD 653504) hcp
   3.758   1.552   2.616     -58.701     -30.389       Tantalum(v) pentachloride (TaCl5) (ICSD 409433)
   2.261   0.909   0.661     -59.797     -70.765       bis(mu-2-Benzoato-O,O')-di-silver(i) (BZOAGA)
   1.718   0.684   1.670     -60.186      -2.794       bis(mu-2-6-Isopropyltropolonato-O,O')-di-silver(i) (IPACEH)
   7.941   3.061   0.000     -61.453    -100.000       Silver tungstate (Ag2WO4) (ICSD 1802521)
   1.644   0.614   1.320     -62.652     -19.708       (Hexafluoroacetylacetonato)-bis(trimethylphosphine)-silver (LEFWIC)
   3.466   1.289   3.604     -62.810       3.982       bis(mu-2-Trifluoroacetato-O,O')-di-silver (AGTFAC01)
   5.136   1.864   4.081     -63.707     -20.541       Tungsten oxide tetrafluoride (WOF4) (ICSD 10393)
   4.362   1.567   0.000     -64.076    -100.000       Tantalum(iv) tetrachloride (TaCl4) (ICSD 402406)
   2.553   0.905   1.557     -64.552     -39.013       bis(Dihydroxybenzoato)-di-silver(i) (KAMTUN)
   1.160   0.392   1.196     -66.207       3.103       Valinomycin (CACYEK10)
   2.869   0.939   0.000     -67.271    -100.000       cis,cis,cis-1,4,7-Cyclononatriene silver nitrate complex (CNTAGN10)
   4.688   1.284   3.626     -72.611     -22.654       Tungsten(vi) hexafluoride (WF6) (ICSD 4027)
   4.073   1.109   0.690     -72.772     -83.059       Silver cyanide (AgCN)
   1.967   0.466   2.103     -76.309       6.914       Iron(ii) dichloride tetrahydrate (FeCl2 4(H2O))
   7.270   1.672   1.315     -77.001     -81.912       Silver(i) oxide (Ag2O) (ICSD 281041)
   4.903   1.081   0.493     -77.952     -89.945       Acetylide-octa-silver hexanitrate (SOVNEW01)
   6.073   1.200   1.834     -80.240     -69.801       Silver carbonate (Ag2CO3)
   2.561   0.479   0.359     -81.296     -85.982       bis-(mu-2-2,6-Dihydroxybenzoato)-silver(i) (LAYCOD)
   7.024   1.096   1.878     -84.396     -73.263       Silver(i) fluoride (AgF)
   5.151   0.726   0.000     -85.906    -100.000       catena((mu-6-Oxalato)-di-silver) (AGOXAL)
   2.506   0.340   0.906     -86.433     -63.847       bis(mu-2-2-Hydroxybenzoato-O,O')-di-silver(i) (KAMTOH03)
   2.299   0.065   2.314     -97.173       0.652       bis((Hexa-ammine)-iridium(iii)) trioxalate tetrahydrate (XEDNID)
   1.051   0.022   1.194     -97.907      13.606       1,2,3-tris(trans-9-Octadecenoyl)glycerol (WISRAR)
   4.692   0.067   4.122     -98.572     -12.148       Catena-di-mu-chloro-dichloroosmium(IV) (OsCl4)
   4.184   0.032   0.030     -99.235     -99.283       Cesium hexachloroiridate(iv) (Cs2IrCl6) (ICSD 69142)
   4.307   0.019   0.045     -99.559     -98.955       Rubidium hexabromomolybdate(iv) (Rb2MoBr6) (ICSD 545162)