Time stamp: Sun Jul 12 17:28:18 2020 HoF Errors: < 2 kcal/mol   < 5 kcal/mol   < 10 kcal/mol   < 20 kcal/mol   < 50 kcal/mol.   Geometries: 0: good, 100: bad

Comparison of Structures of 319 Fluorine-containing Solids predicted using PM7 and PM6-D3H4 with X-Ray

(All solids - Periodic Table - Home - Accuracy - Manual)

Average unsigned error in PM7 HoF: 19.09 kcal/mol, for 54 solids
Average unsigned error in PM6-D3H4 HoF: 67.42 kcal/mol, for 51 solids

     #     GUI   Heat of formation (Kcal/formula unit) Geometry        Species
                    Ref.        PM7     PM6-D3H4      PM7 PM6-D3H4 
   317  (JSmol)               -64.3      -66.0       44.2   44.3   Hydrogen fluoride (HF) (ICSD 1940)
   318  (JSmol)  -147.2      -168.4     -140.5       44.8    4.3   LiF
   319  (JSmol)  -110.9       -80.3      -69.7       49.1   58.8   Ammonium fluoride (NH4F)
   320  (JSmol)              -137.3     -137.1       47.8   14.1   p-Fluorobenzoic acid (PFBZAD01)
   321  (JSmol)     0.0       -17.4       -0.1       22.8   58.9   Fluorine (F2) (ICSD 16262) orthorhombic
   322  (JSmol)               -17.5       -0.1        5.0   57.9   Fluorine (F2) (ICSD 22271)
   323  (JSmol)  -245.4      -239.2     -219.4       37.6    7.3   Beryllium difluoride (BeF2)
   324  (JSmol)              -277.2     -272.4        7.0   30.3   Boron trifluoride (BF3) (ICSD 20904)
   325  (JSmol)  -323.6      -320.4     -312.2       21.5   23.8   Ammonia - boron trifluoride (NH3BF3) (ICSD 94885)
   326  (JSmol)              -169.6     -164.8       16.1   20.2   (S)-2,2,2-Trifluoro-1-(9-anthryl)ethanol (SOCLIF)
   327  (JSmol)  -543.4      -562.1     -497.5       36.7   31.1   Lithium tetrafluoroberyllate (Li2BeF4) (ICSD 37163)
   328  (JSmol)              -421.6     -387.7       19.4   17.6   Ethylenediammonium orthofluoroberyllate (KIPPEE)
   329  (JSmol)              -163.2        0.0       22.3   43.8   4,4'-Bis(perfluorostyryl)stilbene (QERWUF)
   330  (JSmol)              -250.9     -245.0       14.0   21.1   Hexafluorobenzene (HFBENZ02)
   331  (JSmol)              -233.9     -219.5       24.7   24.4   N,N-Dimethylaniline hexafluorobenzene (DMAFBZ01)
   332  (JSmol)              -793.3     -662.5       34.4   30.5   tris(Guanidinium) pyrofluoroberyllate (SEYHOT)
   346  (JSmol)  -137.8      -134.6     -125.8        1.4   25.9   NaF
   347  (JSmol)  -220.0      -186.1     -184.9       54.0   51.8   Sodium hydrogen fluoride (NaHF2) (ICSD 415006)
   348  (JSmol)  -440.9      -453.0     -477.7       30.1   19.3   Sodium tetrafluoroborate (NaBF4) (ICSD 36067)
   369  (JSmol)  -268.7      -254.9     -256.0       47.1   43.1   Sellaite (MgF2)
   370  (JSmol)             -1278.8    -1263.3       20.2   22.5   tris(Hexafluoroacetylacetonato) magnesium 1-dimethylammonium-8-dimethylamino-naphthalene (NAFAMG10)
   371  (JSmol)              -339.1     -408.1        9.4   30.3   Neighborite (NaMgF3)
   384  (JSmol)  -361.0      -353.1     -417.3       33.8   71.6   Aluminum trifluoride (AlF3)
   385  (JSmol)  -808.7      -833.4     -811.5        9.6   27.1   Lithium hexafluoroaluminate (Li3AlF6) (ICSD 34672)
   388  (JSmol)  -792.8      -788.8     -882.4       11.4   20.1   Cryolite (Na3AlF6)
   393  (JSmol) -1812.0     -1802.4    -2033.3        2.5   27.6   Chiolite (Na5Al3F14) (ICSD 26419)
   408  (JSmol)              -935.3     -911.7        9.2   18.9   18-Crown-6 trans-tetrafluoro-diaqua-silicon dihydrate (YORRIG01)
   409  (JSmol)  -640.9      -614.2     -581.2       35.9   31.5   Ammonium hexafluorosilicate (2(NH4)SiF6) (ICSD 1120016)
   412  (JSmol)  -695.4      -679.5     -773.3       14.0   19.6   Sodium hexafluorosilicate (Na2SiF6) (ICSD 16598)
   420  (JSmol)              -728.3     -855.8       11.6   41.7   Topaz (Al2SiO4F2)
   460  (JSmol)              -382.8     -386.3       32.6    7.2   Phosphorus pentafluoride (PF5)
   461  (JSmol)              -562.1     -534.9       25.6   28.0   Lithium hexafluorophosphate (LiPF6) (ICSD 74830)
   462  (JSmol)              -363.9     -348.4       40.1   11.6   tetrakis(Trifluoromethyl)diphosphane (HIRCEQ)
   463  (JSmol)              -714.2     -707.4       14.4   20.1   (2)-(N,N'-Diethyl-4,4'-bipyridiniumdibenzena-decaoxacyclo-octacosaphane)-rotaxane bis(hexafluorophosphate) acetone solvate (GITXOX)
   464  (JSmol)              -742.2     -745.1       14.1   17.5   (2)-(bis(1,5-naphtho)-38-crown-10)-(N,N'-bis-(3-carboxypropyl)-4,4'-bipyridinium)-pseudorotaxane bis(hexafluorophosphate) (LEZZAS)
   469  (JSmol)              -551.3     -601.4       52.6   12.6   Sodium hexafluorophosphate (NaPF6) (ICSD 1408764)
   476  (JSmol)              -587.6     -495.1       25.4   11.9   Wagnerite (Mg2PO4F)
   490  (JSmol)              -827.8     -878.9       17.5   30.1   catena-(Tri-sodium (mu-2-fluoro)-(methylenediphosphonate)-magnesium monohydrate) (DEKSIV)
   497  (JSmol)              -472.2     -527.0       29.4   21.6   (1-(tris(dimethylamino)phosphoranylideneammonium)-8-(tris(dimethylamino)phosphoranylideneamino)naphthalene) hexafluorophosphate (SAXLAF)
   547  (JSmol)              -297.4     -306.6       12.3   26.0   Sulfur hexafluoride (SF6) (ICSD 63332)
   554  (JSmol)             -1306.3    -1248.3       26.5   23.9   Sulfoborite (Mg3SO4(B(OH)4)2(OH)F)
   557  (JSmol)              -460.6     -466.6       16.2   26.1   4-Fluoro-2-(phosphonomethyl)benzenesulfonic acid monohydrate (KIXQIR)
   613  (JSmol)              -336.1     -331.1       21.1   15.6   Fluoxetine hydrochloride benzoic acid
   637  (JSmol)              -685.2     -679.3       22.1   16.6   Fluoxetine hydrochloride fumaric acid
   638  (JSmol)              -716.8     -713.0       20.8   15.8   Fluoxetine hydrochloride succinic acid
   639  (JSmol)              -247.9     -237.4       26.0   17.8   Fluoxetine hydrochloride
   680  (JSmol)  -135.6      -142.1     -188.0       17.6   29.2   KF
   681  (JSmol)  -221.0      -198.6     -227.8       35.8   21.7   Potassium hydrogen fluoride (KHF2) (ICSD 18094)
   689  (JSmol)              -573.4     -648.9       28.8   29.1   Potassium hexafluorophosphate (KPF6) (ICSD 1616491)
   709  (JSmol)  -706.5      -722.1     -851.1        1.1   22.5   Potassium hexafluorosilicate (K2SiF6) (ICSD 73722)
   714  (JSmol)  -795.0      -844.2    -1072.4       12.4   29.0   Potassium hexafluoroaluminate (K3AlF6) (ICSD 381848)
   734  (JSmol)  -293.5      -261.5     -212.4       30.5   16.8   Fluorite (CaF2)
   765  (JSmol)             -2918.4    -2790.6       11.4   19.9   Fluor-tremolite (Ca2Mg5Si8O22F2)
   776  (JSmol)             -3026.2    -2892.8        8.3   23.6   Apophyllite ((CaO)4 (SiO2)8 (H2O)8 KF)
   777  (JSmol)             -3026.1    -2890.3       16.8   32.2   Fluorapophyllite (KCa4Si8O20 8(H2O)
   779  (JSmol)             -1609.3        -.-       16.0    -.-   Fluorapatite (Ca5(PO4)3F)
   784  (JSmol)              -342.9     -408.0       38.9   12.1   Scandium(iii) trifluoride (ScF3)
   785  (JSmol)              -616.5     -580.4        8.6    7.9   tris(Guanidinium) hexafluoro-scandium(iii) (HEYRUZ)
   786  (JSmol)              -563.2     -432.5       26.8   41.9   catena-((mu-3-Methylphosphonato)-(mu-2-fluoro)-aqua-scandium) (UDEHOB)
   787  (JSmol)             -1692.7    -1572.1       19.9   33.9   Nona-aqua-scandium(iii) tris(trifluoromethanesulfonate) (NINMIG)
   801  (JSmol)  -343.0      -315.7     -436.6       23.6   64.9   Titanium(iii) fluoride (TiF3)
   802  (JSmol)  -394.2      -401.8     -488.4       34.5   69.6   Titanium(iv) fluoride (TiF4)
   803  (JSmol)              -590.5     -540.9       20.3   44.5   bis(Guanidinium) hexafluoro-titanium (KOYXOL)
   826  (JSmol)              -160.5     -126.5       57.2   49.3   Vanadium(ii) difluoride (VF2)
   827  (JSmol)              -186.6     -188.9       31.0   25.2   catena-((mu-2-4,4'-Bipyridine)-(mu-2-fluoro)-difluoro-vanadium(iii)) (UDISIK)
   828  (JSmol)  -335.4      -333.2     -295.9       65.0   19.8   Vanadium (iv) tetrafluoride (VF4) (ICSD 65785)
   829  (JSmol)              -482.2     -457.2       13.1   28.5   Ethylenediammonium pentafluoro-oxo-vanadium (ENDFVO)
   830  (JSmol)              -422.9     -376.3       69.2   23.5   Vanadium(V) pentafluoride (VF5)
   831  (JSmol)              -672.4     -802.0       14.9   77.3   Sodium hexafluorovanadate(iii) (Na3VF6) (ICSD 27347)
   832  (JSmol)             -1012.5    -1009.9       35.2   25.7   bis(Trifluoromethanesulfonate) hexa-aqua-vanadium(ii) (VEPSUE)
   853  (JSmol)              -210.3     -233.0       28.6   39.0   Pyridinium fluorochromate (NONYUK)
   854  (JSmol)  -185.9      -219.3     -147.7       63.7   47.2   Chromium(ii) difluoride (CrF2) (ICSD 31827)
   855  (JSmol)  -277.0      -278.0     -276.6       78.4   35.7   Chromium(iii) trifluoride (CrF3)
   856  (JSmol)              -229.7     -300.5       25.1   35.9   Guanidinium trans-tetrafluoro-bis(pyridine-N)-chromium(iii) (PUXPUT)
   857  (JSmol)               185.9      183.0       16.5   12.7   hexakis(6-Isocyanoazulene-C)-chromium tetrafluoroborate (GUZCOT)
   858  (JSmol)              -430.5     -440.9       32.0   38.6   o-Phenylene-di-ammonium aqua-pentafluoro-chromium(iii) (YASHOP)
   859  (JSmol)              -582.2     -616.1       21.3   23.6   Lithium hexafluorochromium(iv) (Li2CrF6)
   866  (JSmol)              -255.8     -256.1       12.3   13.5   trans-Difluoro-bis(ethylenediamine)-chromium(iii) chloride (BAVGUA10)
   867  (JSmol)              -404.9     -372.1       15.5   43.5   Ethylenediammonium ethylenediamine-tetrafluoro-chromium(iii) chloride (DIYFEW)
   898  (JSmol)              -207.0      -72.1       52.9   60.8   Manganese(ii) difluoride (MnF2)
   899  (JSmol)              -546.8     -285.2       27.0   53.4   Tetramethylammonium diaqua-tetrafluoro-manganese(iii) (TMAFMN)
   922  (JSmol)  -170.0      -132.6     -425.5       45.9   70.9   Iron(ii) difluoride (FeF2) (ICSD 65702)
   923  (JSmol)              -214.7     -545.9       56.4   68.5   Iron(iii) trifluoride (FeF3)
   924  (JSmol)              -469.8     -431.2       18.5   22.3   tris(Guanidinium) hexafluoro-iron(iii) (FULHOJ)
   962  (JSmol)  -165.4      -110.1        -.-       54.4    -.-   Cobalt(ii) difluoride (CoF2) (ICSD 73460)
   963  (JSmol)              -217.0    -1497.2       11.5   95.5   Cobalt(iii) fluoride (CoF3)
   966  (JSmol)              -489.0     -421.8       10.8   44.1   Decamethyl-cobaltocenium hexafluorophosphate (DIMJIS01)
   992  (JSmol)  -156.7      -126.1      -90.9       42.8    8.9   Nickel(ii) fluoride (NiF2)
   997  (JSmol)              -690.7     -744.3       12.8   22.9   Nitrosyl-tris(trimethylphosphine)-nickel(0) hexafluorophosphate (FINJAN)
  1012  (JSmol)              -292.6     -306.7       31.2   36.4   mu-2-(h5,h5-Cyclopentadienyl)-bis((h5-cyclopentadienyl)-nickel(ii)) tetrafluoroborate (TCPNIB10)
  1018  (JSmol)              -242.4     -236.4       37.1   57.4   Copper(II) fluoride, dihydrate (CuF2 2(H2O)) (ICSD 31768)
  1019  (JSmol)  -129.7      -108.8     -103.0       27.8   60.7   Copper(ii) difluoride (CuF2)
  1026  (JSmol)              -848.9     -746.2        8.7   30.1   bis(Ethylenediamine) copper(ii) bis(tetrafluoroborate) (CUTFBE10)
  1030  (JSmol)              -673.7     -617.2       20.1   16.2   tris(Ethane-1,2-diamine-N,N')-copper(ii) bis(trifluoroacetate) (VIWMOE)
  1070  (JSmol)              -112.6        -.-       22.4    -.-   Zinc fluoride (ZnF2)
  1089  (JSmol)  -278.0      -277.4     -207.4       31.1   10.0   Gallium trifluoride (GaF3) (ICSD 22197)
  1091  (JSmol)              -554.7     -453.8       31.2   30.1   tris(Guanidinium) hexafluoro-gallium (BUYFOQ01)
  1092  (JSmol)              -719.5    -1064.1       14.1   43.0   catena-(1,3-Propanediammonium (mu-2-fluoro)-bis(mu-2-hydrogen phosphato)-gallium) (EDEPOS)
  1097  (JSmol)              -854.4    -1824.2       18.4   76.2   catena-((mu-6-Ethylenediphosphonato)-trans-bis(mu-2-fluoro)-diaqua-di-gallium monohydrate) (XUWVEQ)
  1099  (JSmol)              -245.1     -240.1       17.4   17.9   1-Fluoro-2,8,9-trioxa-5-aza-1-germatricycloundecane (GAQMEQ01)
  1101  (JSmol)              -425.8     -433.8       26.9   18.5   Biguanidinium hexafluoro-germanium (NEQFUL)
  1106  (JSmol)              -167.1     -187.8       35.4   50.8   Germanium(ii) fluoride (GeF2)
  1109  (JSmol)              -315.9     -301.6       28.6   24.5   Tetrafluoro-(1,2-bis(dimethylamino)ethane)-germanium(iv) (DITCAL)
  1110  (JSmol)              -263.8     -271.1       18.2   20.1   trans-Tetrafluoro-bis(pyridine)-germanium(iv) (HUMCOH01)
  1114  (JSmol)              -613.9     -844.7       28.8   38.2   Potassium hexafluorogermanate (K2GeF6) (ICSD 30310)
  1121  (JSmol)              -233.3     -178.9       74.8   32.3   Arsenic(iii) fluoride (AsF3)
  1123  (JSmol)              -498.3     -475.0       36.7   22.9   Lithium hexafluoroarsenate (LiAsF6) (ICSD 74831)
  1124  (JSmol)              -445.1     -440.3       26.7   25.5   Oxonium hexafluoroarsenate(V) (AsF6 (H3O)) (ICSD 61236)
  1132  (JSmol)              -478.5     -616.3       17.3   49.7   Potassium hexafluoroarsenate (KAsF6) (ICSD 2362)
  1141  (JSmol)              -726.4     -760.6       17.1   16.7   bis((h5-Cyclopentadienyl)-(mu-2-fluoro)-(pentafluoro-arsenic))-vanadium(iv) (VUFFIL)
  1154  (JSmol)              -221.5     -193.5       34.0   42.2   Selenium(iv) tetrafluoride (SeF4) (ICSD 85451)
  1164  (JSmol)              -271.1     -230.7       48.3   20.7   bis(1,2,4-Triseleno-3,5-diazolium) bis(hexafluoroarsenate) (KAZBIW)
  1174  (JSmol)              -248.2     -248.6       16.8   11.7   Munchnone (BFAXZO)
  1202  (JSmol)               -53.3      -51.2       18.8   18.1   XIII 1,3-dibromo-2-chloro-5-fluorobenzene
  1258  (JSmol)              -227.8     -235.2       66.9   66.5   Krypton difluoride (KrF2) (ICSD 23534)
  1261  (JSmol)  -133.3      -134.9     -153.9       59.8   11.7   RbF
  1288  (JSmol)              -383.5     -393.7       59.4   57.1   Rubidium fluoride carbonate (Rb3FCO3) (ICSD 66029)
  1291  (JSmol)             -1199.3    -1162.3       24.6   24.7   18-Crown-6-bis(hexafluoro-acetylacetonato)-strontium (QUGTIW)
  1295  (JSmol)  -290.7      -246.4     -262.6       46.0    5.8   Strontium fluoride (SrF2)
  1320  (JSmol)              -610.1     -707.5       61.1   78.9   Lithium yttrium(iii) tetrafluoride (LiYF4) (ICSD 73709)
  1326  (JSmol)  -411.1      -424.2     -479.1       37.9   17.5   Yttrium(iii) trifluoride (YF3) (ICSD 15961)
  1328  (JSmol)              -903.8     -892.2       15.2   16.1   tris(Guanidinium) difluoro-(ethylenediaminetetra-acetato)-yttrium(iii) monohydrate (JIJTIF10)
  1331  (JSmol)              -821.0    -1197.9        8.0   57.3   Potassium yttrium(iii) hexafluoride (K3YF6) (ICSD 416296)
  1336  (JSmol)              -841.1    -1104.1       50.7   57.6   Rubidium yttrium(iii) hexafluoride (Rb3YF6) (ICSD 19077)
  1342  (JSmol)              -619.5     -579.7       27.0   29.1   Ethylenediammonium bis(mu-2-fluoro)-decafluoro-di-zirconium (ENFZRA10)
  1348  (JSmol)  -456.8      -466.2     -460.9        2.2    7.3   Zirconium(iv) tetrafluoride (ZrF4)
  1349  (JSmol)              -572.6     -524.1       35.4   34.8   bis(Aminoguanidinium) hexafluoro-zirconate(iv) (KOJVAG02)
  1351  (JSmol)              -709.3     -611.4       33.2   35.7   tris(Guanidinium) heptafluoro-zirconium (DADVIN)
  1353  (JSmol)              -989.4     -985.4       22.9   26.2   bis(15-Crown-5-sodium) difluoro-tetrachloro-zirconium(iv) ((JAVKAS)
  1359  (JSmol)              -471.2     -497.1       23.5   29.4   1-Ethyl-3-methylimidazolium hexafluoroniobate-(MESBIW)
  1360  (JSmol)              -804.5     -693.0       18.8   44.5   18-Crown-6-oxonium hexafluoroniobate (SINSAK)
  1363  (JSmol)              -220.9     -298.4       16.1   61.6   Niobium(iii) trifluoride (NbF3) (ICSD 60246)
  1366  (JSmol)  -433.5      -422.0     -492.4       71.3   62.8   Niobium(v) pentafluoride (NbF5) (ICSD 26647)
  1367  (JSmol)             -1452.8    -1405.7       11.4   28.0   Trityl hexakis(pentafluorophenoxy)-niobium (QINKIH)
  1368  (JSmol)              -836.3     -841.5       24.4   21.3   bis(h5-Cyclopentadienyl)-(2,2'-bipyridyl-N,N')-niobium bis(hexafluorophosphate) (VOSXUW)
  1369  (JSmol)              -885.8     -904.5       21.8   23.8   catena-(bis(Ethane-1,2-diammonium) bis(mu-2-phosphato)-fluoro-oxo-niobium) (HEYBOD)
  1370  (JSmol)              -565.8     -410.4       15.3   24.2   tetrakis(1,3,4,6,7,8-hexahydro-2H-pyrimido(1,2-a)pyrimidin-1-yl)-niobium(v) hexafluorophosphate (POFHUO)
  1381  (JSmol)              -608.2     -532.2       42.5   45.4   Chloro-dinitroso-(1-thia-4,7-diazacyclononane-N,N',S)-molybdenum hexafluorophosphate (SAVNOS)
  1390  (JSmol)              -163.8     -303.7       13.1   72.5   Molybdenum(iii) trifluoride (MoF3)
  1391  (JSmol)  -372.3      -380.6        -.-       44.8    -.-   Molybdenum(vi) hexafluoride (MoF6) (ICSD 36219)
  1404  (JSmol)              -400.0     -480.1       18.5   24.7   bis(p-Cyclopentadienyl)hydroxy-methylamino molybdenum(iv) hexafluorophosphate (CHAMOF)
  1405  (JSmol)              -444.2     -474.5       14.0   15.9   p-Cycloheptatrienylium-tricarbonyl-molybdenum(0) tetrafluoroborate (CYHMOC10)
  1420  (JSmol)              -294.8     6937.9       35.4    -.-   Technetium(vi) hexafluoride (TcF6) (ICSD 1211848)
  1422  (JSmol)              -893.2     -723.5       20.4   30.1   bis(1,4,7-Trithiacyclononane-S,S',S'')-technetium bis(tetrafluoroborate) acetonitrile solvate (WACXIH)
  1424  (JSmol)              -449.1     -494.3       31.7   35.2   trans-Dichloro-tetrakis(trimethylphosphine)-technetium(iii) hexafluorophosphate (QESMOQ)
  1425  (JSmol)              -736.0     -785.1       15.6   11.2   tris(2,2-Bipyridyl)-technetium(ii) bis(hexafluorophosphate) (SUDZOG)
  1430  (JSmol)              -910.2    -1026.8       41.2   30.1   (Dibenzo-18-crown-S6)-ruthenium bis(hexafluorophosphate) nitromethane solvate (SIJVAI)
  1435  (JSmol)              -575.4     -668.1       29.8   27.7   bis(1,4,7-Trithiacyclononane-S,S',S'')-ruthenium bis(trifluoromethanesulfonate) (FENDUX)
  1438  (JSmol)              -668.3       25.2       29.0   79.9   cis-Difluoro-bis(1,2-bis(dimethylphosphino)ethane)-ruthenium hydrofluoride (QIWPUH)
  1439  (JSmol)              -495.1     -503.2       26.9   14.5   hexakis(Imidazole)-ruthenium(ii) bis(trifluoromethanesulfonate) (BIXCEQ)
  1440  (JSmol)              -688.8     -709.9       27.9   25.9   hexakis(Thiourea-S)-ruthenium(ii) bis(trifluoromethanesulfonate) (SIZZAC)
  1443  (JSmol)              -768.3     -815.3       22.0   17.7   tris(2,2'-Bipyridine)-ruthenium(ii) bis(hexafluorophosphate) (BPYRUF10)
  1447  (JSmol)               -21.9     -554.6       39.9   80.3   Rhodium(V) pentafluoride (RhF5) (ICSD 10173)
  1449  (JSmol)                 6.6        -.-       18.2    -.-   Rhodium(iii) trifluoride (RhF3) (ICSD 62262)
  1450  (JSmol)                -4.7     -511.4       44.3   91.0   Rhodium(vi) hexafluoride (RhF6) (ICSD 1300606)
  1459  (JSmol)              -396.3     -201.3       15.4   66.7   tris(mu-2-Chloro)-bis((h5-pentamethylcyclopentadienyl)-rhodium(iii)) tetrafluoroborate (ASUKOO)
  1466  (JSmol)              -114.0      -84.3       46.7    4.2   Palladium(ii) fluoride (PdF2)
  1472  (JSmol)              -734.7     -642.7       23.3   21.8   Tetrakis(Acetonitrile)-palladium(ii) bis(tetrafluoroborate) (KUXSIF)
  1480  (JSmol)              -179.2     -597.2       77.9   85.1   (2,2'-Bipyridine-N,N')-(trifluoroacetato-O)-silver(i) (MAYBAQ)
  1482  (JSmol)              -421.2     -852.4       74.5   87.1   (Hexafluoroacetylacetonato)-bis(trimethylphosphine)-silver (LEFWIC)
  1485  (JSmol)              -340.6    -1065.4       74.7   92.7   Acetonitrile-perfluoroisopropyl-silver (DUJXEL)
  1500  (JSmol)   -48.9         9.9     -256.1       92.5   93.5   Silver(i) fluoride (AgF)
  1505  (JSmol)              -277.5     -538.8       44.4   84.2   bis(Cyclo-octadiene)-silver(i) tetrafluoroborate (OCDAGB)
  1514  (JSmol)              -206.0    -1019.0       81.5   92.8   bis(mu-2-Trifluoroacetato-O,O')-di-silver (AGTFAC01)
  1521  (JSmol)              -310.5    -1268.8       73.7   98.0   tetrakis((mu-2-trans-Perfluoro-1-methyl-1-propenyl)-silver) (LAJJEL)
  1522  (JSmol)              -408.8    -1227.7       43.4   92.1   Hexaoxacyclododecane-di-silver silver tris(hexafluoro-arsenic) (CADXOU)
  1523  (JSmol)              -666.5     -758.1       30.5   54.9   bis(Tetraoxacyclododecane)-silver hexafluoroarsenate (CIJWIB)
  1526  (JSmol)              -692.1    -1752.4       63.8   88.9   (Hexafluoroacetylacetonato)-trimethylphosphine-silver (LEFWEY)
  1542  (JSmol)  -167.4      -150.9     -231.2        4.5    6.1   Cadmium fluoride (CdF2)
  1560  (JSmol)              -265.9     -227.4       62.2    7.1   Indium trifluoride (InF3) (ICSD 38306)
  1566  (JSmol)              -512.0     -452.4       14.3    7.9   tris(Guanidinium) hexafluoro-indium(iii) (BUYFUW02)
  1570  (JSmol)              -416.7     -419.1       38.2   45.4   Indium hexafluoroarsenate (InAsF6) (ICSD 417952)
  1578  (JSmol)              -387.0     -345.0       32.5   13.8   (Pentamethyl-cyclopentadienyl)-tin tetrafluoroborate (PMCPSN10)
  1581  (JSmol)              -302.8     -299.5       24.8   18.2   Diammonium tetrafluoro-dimethyl-tin(iv) (LEVHUP)
  1583  (JSmol)              -619.7     -787.8       28.3   43.1   Potassium hexafluorostannate (K2SnF6) (ICSD 376982)
  1587  (JSmol)              -192.3     -151.3       72.2   27.6   Tin(ii) fluoride (SnF2)
  1589  (JSmol)              -281.9     -280.6       46.2   20.2   Tin(iv) tetrafluoride (SnF4) (ICSD 78894)
  1590  (JSmol)              -580.8     -620.7       18.0   21.1   bis(3-Carboxyanilinium) hexafluorostannate(iv) (FICWAQ)
  1604  (JSmol)              -592.3     -612.4       20.0   34.5   (Trifluoromethylsulfonic acid-O)-pentafluoro-antimony (SOVWEF)
  1605  (JSmol)              -264.4     -248.1       31.9   32.6   (mu-2-Pyrazine)-decafluoro-di-antimony (TUSBAK)
  1606  (JSmol)              -387.6     -383.5       34.2   37.2   1-ethyl-3-methylimidazolium hexafluoroantimonate (AQEYIE)
  1611  (JSmol)  -218.8      -239.3     -219.5       27.6   52.5   Antimony(iii) fluoride (SbF3)
  1614  (JSmol)              -494.5     -464.8       23.0   27.9   Lithium hexafluoroantimonate (LiSbF6) (ICSD 23924)
  1615  (JSmol)              -474.4     -599.8       13.2   64.9   Potassium hexafluoroantimonate (KSbF6) (ICSD 632)
  1616  (JSmol)              -450.7     -575.8       14.1   67.9   Sodium hexafluoroantimonate (NaSbF6) (ICSD 77919)
  1619  (JSmol)              -484.4     -416.5       31.8   42.7   bis(Guanidinium) sulfato-trifluoro-antimony(iii) (BEYXAE)
  1628  (JSmol)              -456.2     -627.4       45.1   60.5   Rubidium hexafluoroantimonate (RbSbF6) (ICSD 408071)
  1629  (JSmol)              -309.5     -337.4       37.9   65.5   Silver hexafluoroantimonate (AgSbF6) (ICSD 411795)
  1630  (JSmol)             -1065.0    -1097.1       15.9   16.5   (Perfluoroisopropyl)oxonium (mu-2-fluoro)-bis(pentafluoro-antimonate) (GOBDEG)
  1631  (JSmol)              -471.5     -440.2       44.7   52.7   (mu-2-Oxo)-bis(difluoro-urea-antimony) (UROFSB10)
  1636  (JSmol)              -881.5     -913.8       21.9   16.0   bis((mu-2-Oxo)-(mu-2-trifluoroacetato-O,O')-trifluoro-antimony(v)) (OFAFSB01)
  1638  (JSmol)             -1013.7     -987.3       15.1   15.1   Hexacarbonyl-ruthenium(ii) bis(hexafluoroantimonate(v)) (LARPAW)
  1640  (JSmol)              -830.3     -856.0       34.4   34.0   Hexamethyldistibonium bis(hexafluoroantimonate) sulfur dioxide (BOFPER)
  1643  (JSmol)              -430.9     -413.8       26.9   27.7   Hexamethylpiperidinium heptafluorotellurate (ROLSOA)
  1649  (JSmol)              -359.4     -358.7       62.8   59.1   Tellurium(iv) tetrafluoride (TeF4) (ICSD 85452)
  1650  (JSmol)              -304.1     -280.3       40.9   14.1   Tellurium(vi) hexafluoride (TeF6) (ICSD 67609)
  1654  (JSmol)              -534.0     -555.3       29.6   32.7   tetrakis(Imidazolidine-2-thione)-tellurium(ii) hexafluorosilicate (QAMCAJ)
  1656  (JSmol)              -308.2     -346.3       45.4   42.7   tetrakis(Thiourea-S)-tellurium(ii) bis(hydrogen difluoride) (ZZZMJK02)
  1663  (JSmol)              -634.5     -638.7       30.5   51.0   Tetrapyridinium bis((mu-2-oxo)-trifluorotellurate(iv)) bis(pentafluorotellurate(iv)) (WAVZID)
  1668  (JSmol)             -1240.8    -1191.3       17.1   20.8   Tetramethylammonium tetrakis(pentafluorotelluryloxy)borate (CIGFEE)
  1797  (JSmol)              -170.3      -86.7       58.7   62.0   Potassium fluorotrioxoxenate (KXeO3F) (ICSD 15219)
  1799  (JSmol)              -197.7      108.3       57.8   95.7   Xenon difluoride dioxide (XeF2O2) (ICSD 10203)
  1800  (JSmol)              -171.3      104.0       31.8   55.7   Xenon dioxide (XeO2) (ICSD 26625)
  1801  (JSmol)              -169.0       11.8       68.3    -.-   Xenon hexafluoride (XeF6) (ICSD 416320)
  1802  (JSmol)   -62.5       -45.7       12.1       20.6    -.-   Xenon tetrafluoride (XeF4) (ICSD 27467)
  1803  (JSmol)              -108.7       13.8       15.3    -.-   Xenon trifluoride (Xe2F6) (ICSD 18128)
  1805  (JSmol)              -108.7       13.8       15.3    -.-   Xenon(II) xenon(IV) fluoride (XeF2XeF4) (ICSD 18128)
  1806  (JSmol)              -482.0     -288.5       58.4   78.3   Trifluoroxenon(IV) hexafluoroantimonate (XeF3SbF6) (ICSD 6034)
  1810  (JSmol)              -545.8     -673.9       39.6   61.3   Cesium hexafluorophosphate (CsPF6) (ICSD 1703996)
  1818  (JSmol)  -132.3      -115.7     -157.3       12.0    0.6   CsF
  1822  (JSmol)              -919.0     -896.7       19.6   35.5   Tetramethylammonium cesium (mu-2-fluoro)-aqua-heptafluoro-dioxo-di-vanadium (SARLUS)
  1823  (JSmol)             -1209.8    -1196.3       16.1   32.0   bis(15-Crown-5)-cesium heptafluoro-2,4-bis(trifluoromethyl)pentenide (CAZWUW)
  1825  (JSmol)             -1816.3    -1994.6       27.7   60.5   Cesium tetrakis(hexafluoroacetylacetonato)-yttrate(iii) (CYSFAC10)
  1829  (JSmol)              -451.9     -583.6       35.5   51.1   Cesium hexafluoroantimonate (CsSbF6) (ICSD 201886)
  1833  (JSmol)              -317.0     -267.8       68.5   98.1   Cesium xenon heptafluoride (CsXeF7) (ICSD 404986)
  1834  (JSmol)              -718.7     -121.4       59.7   88.7   Cesium tris(tetrafluorooxoxenon(VI)) fluoride (Cs(XeOF4)3F) (ICSD 49680)
  1841  (JSmol)              -812.8    -1061.8       41.8   39.3   Cesium yttrium(iii) hexafluoride (Cs3YF6) (ICSD 19078)
  1844  (JSmol)             -1010.1    -1230.0       32.5   51.6   BaCaAlF7
  1845  (JSmol)              -264.9     -464.0       23.5   57.4   BaFCl
  1853  (JSmol)              -676.3     -850.7       20.7   28.5   Barium hexafluorosilicate (BaSiF6) (ICSD 201510)
  1867  (JSmol)              -845.0    -1121.4       12.1   22.4   Diaqua-(1,10-diaza-18-crown-6)-tetrafluorosuccinato-barium (MUJBEY)
  1868  (JSmol)  -288.9      -286.7     -306.9       25.6    1.2   Frankdicksonite (BaF2)
  1869  (JSmol)              -903.4     -986.8       31.8   39.9   Podlesnoite (BaCa2(CO3)2F2)
  1871  (JSmol)              -985.2    -1150.0       25.3   16.5   aqua-bis(hexafluoropentane-2,4-dione)-barium (KOWPOB)
  1877  (JSmol)              -249.4     -431.0       21.5   66.1   BaBrF
  1882  (JSmol)              -515.9     -911.9       14.4   65.4   BaSbF5
  1883  (JSmol)              -215.4     -442.2       19.8   48.7   BaFI
  1889  (JSmol)             -1998.3    -2595.4       35.2   52.3   Usovite (Ba2CaMgAlF14)
  1897  (JSmol)               143.6      -92.7       12.3   12.2   La Complex Sparkle (HINKAQ)
  1907  (JSmol)              -362.5    -1171.9       16.2   68.8   Lanthanum(iii) trifluoride (LaF3)
  1908  (JSmol)             -1558.6    -1805.2       21.3   71.2   Nona-aqua-lanthanum tris(trifluoromethanesulfonate) (BUVVIX)
  1914  (JSmol)              -762.7    -1618.3       14.7   62.5   Cesium potassium lanthanum hexafluoride (Cs2KLaF6)
  1926  (JSmol)             -1436.1    -1566.2       21.6   22.3   Pr Complex Sparkles (BUVWIY01)
  1930  (JSmol)             -1219.5    -1492.8       17.8   15.2   Pr Complex Sparkles (VELRUZ)
  1932  (JSmol)             -1366.4    -1533.8       13.8   16.9   Nd Complex Sparkle (BUVWOE01)
  1939  (JSmol)             -1379.9    -1547.5       23.6   22.0   Sm Complex Sparkle (BUVWUK01)
  1947  (JSmol)             -1363.4    -1374.8       23.5   25.0   Eu Complex Sparkle (BUVXAR11)
  1953  (JSmol)             -1317.7    -1514.3       22.7   22.6   Gd Complex Sparkle (BUVVOD01)
  1961  (JSmol)             -1333.0    -1380.4       21.6   24.6   Tb Complex Sparkle (BUVXEV01)
  1970  (JSmol)             -1283.2    -1406.7       25.7   28.4   Dy Complex Sparkle (BUVXIZ01)
  1979  (JSmol)             -1334.7    -1505.5       18.5   16.6   Ho Complex Sparkle (BUVXOF01)
  1981  (JSmol)              -783.4    -1128.9       12.2   15.4   Ho Complex Sparkle (ECOJEL)
  2002  (JSmol)             -1226.1    -1444.3       29.1   26.4   Yb Complex Sparkle (BUVYEW01)
  2014  (JSmol)             -1265.8    -1472.5       25.0   25.8   Lu Complex Sparkle (BUVVUJ)
  2020  (JSmol)              -959.1    -1287.7       13.0   16.3   Lu Complex Sparkle (UFIROQ)
  2027  (JSmol)              -139.8     -625.2       68.2   65.1   Lutetium(iii) trifluoride (LuF3)
  2029  (JSmol)             -1648.2    -1607.9       23.2   14.3   Nona-aqua-lutetium tris(trifluoromethanesulfonate) (BUVVUJ)
  2045  (JSmol)  -461.4      -457.1     -502.2       33.7   48.0   Hafnium(iv) tetrafluoride (HfF4)
  2046  (JSmol)              -655.5     -675.7       22.7   31.6   Hexamethylenediammonium hexafluoro-hafnium (RENPAB)
  2048  (JSmol)              -759.7     -761.6       14.4   26.0   Tetramethylene-1,4-diammonium bis(mu-2-fluoro)-octafluoro-diaqua-di-hafnium(iv) tetrahydrate (ROLPEN)
  2049  (JSmol)              -833.7     -770.1       18.4   23.3   bis(Guanidinium) difluoro-(ethylenediaminotetra-acetato)-hafnium(iv) monohydrate (ZULSEE)
  2051  (JSmol)              -769.7     -995.1       22.4   79.6   catena-(Di-rubidium(i) bis(mu-2-fluoro)-(mu-2-oxalato)-bis(aqua-trifluro-hafnium(iv)) dihydrate) (YEWJAL)
  2057  (JSmol)              -511.2     -513.7       31.2   22.7   1-Ethyl-3-methylimidazolium hexafluorotantalate (MESBOC)
  2060  (JSmol)              -848.3     -856.2       34.5   27.0   Betainium hexafluoro-tantalum(iv) dihydrate (CEYCEO)
  2061  (JSmol)              -481.9     -483.9       29.2   33.1   Difluoropermethyltantalocene tetrafluoroborate (BAZNIZ)
  2062  (JSmol)              -844.4     -843.3       24.8   27.7   Hydroxonium 18-Crown-6 clathrate hexafluorotantalate (SINSEO)
  2064  (JSmol)  -455.0      -454.4     -609.1       70.0   68.3   Tantalum(V) pentafluoride (TaF5) (ICSD 171155)
  2065  (JSmol)              -329.0        -.-        8.6    -.-   Tantalum(iii) trifluoride (TaF3) (ICSD 542010)
  2070  (JSmol)              -941.5    -1284.5       35.5   63.8   Trisodium octafluorotantalate (Na3TaF8) (ICSD 26611)
  2071  (JSmol)             -1486.8    -1474.9        8.6   30.3   Trityl hexakis(pentafluorophenoxy)-tantalum (QINKON)
  2074  (JSmol)              -681.3     -695.1       26.8   28.8   tris(2-Ammonioethyl)amine heptafluoro-tantalum fluoride (QAJJIV)
  2076  (JSmol)              -534.7     -534.9       27.6   31.5   tris(Guanidinium) hexafluoro-tantalum (YAVZEB01)
  2084  (JSmol)              -617.7     -608.4       13.7   22.9   Dichloro-oxo-(N,N',N''-trimethyl-1,4,7-triazacyclononane-N,N',N'')-tungsten(v) hexafluorophosphate (DIBVEP)
  2098  (JSmol)  -336.3      -326.5     -338.1       71.0   31.1   Tungsten oxide tetrafluoride (WOF4) (ICSD 10393)
  2102  (JSmol)              -378.5     -402.4       73.4   24.9   Tungsten(vi) hexafluoride (WF6) (ICSD 4027)
  2110  (JSmol)              -713.3     -762.4       37.7   50.0   Cesium hexafluoro-2,2,2-trifluoroethoxy-tungsten(vi) acetonitrile solvate (JONCAQ)
  2112  (JSmol)              -885.2     -986.2       31.7   23.2   (mu-2-Oxo)-tetrakis(h5-cyclopentadienyl)-dimethyl-di-tungsten bis(hexafluorophosphate) (ZISMAP)
  2114  (JSmol)              -566.5     -438.9       19.5   24.9   bis(Acetonitrile)-fluoro-tetramethyl-tungsten hexafluoro-tungsten (RETNAF)
  2115  (JSmol)              -692.8     -788.4       31.1   24.9   bis(Dichloro-tungstocenium) hexakis(mu-2-fluoro)-dodecakisfluoro-tetra-tungsten (JUTPET)
  2124  (JSmol)              -314.5     -288.2       39.3   59.0   Rhenium(vi) hexafluoride (ReF6) (ICSD 1211852)
  2125  (JSmol)              -392.9     -367.6       44.1   23.8   Rhenium(vii) heptafluoride (ReF7) (ICSD 78311)
  2129  (JSmol)             -1326.9    -1327.2       15.2   24.4   tetrakis(Tetramethylthiourea)-oxo-rhenium(v) tris(hexafluorophosphate) (FIQLEW)
  2134  (JSmol)              -746.4     -654.2       26.3   33.3   Hexacarbonyl-rhenium(i) (mu-2-fluoro)-bis(pentafluoro-rhenium(v)) (FUZJOZ)
  2136  (JSmol)              -375.0     -416.5       16.8   16.5   Chloro-osmocenium hexafluorophosphate (WEHLEA)
  2139  (JSmol)               -15.1     -217.5       20.1   26.9   Dipyridinomethane cis-dibromo-tetrafluoro-osmium(iv) (NILVOT)
  2142  (JSmol)               -38.1     -316.7       53.6   69.2   Osmium(v) pentafluoride (OsF5) (ICSD 14117)
  2143  (JSmol)               -12.5     2999.8       27.0    -.-   Osmium(vi) hexafluoride (OsF6)
  2146  (JSmol)               -91.7     -197.8       43.5   31.7   Tetraethylammonium cis-tetrachlorodifluoroosmate(v) (CAXSAV)
  2147  (JSmol)              -162.3     -261.7       26.1   26.3   Tetramethylammonium fluorotetraoxoosmate (XAKBUG)
  2152  (JSmol)              -172.3     -337.0       29.5   21.7   bis(Tetramethylammonium) hexafluoro-osmium(iv) (UFEPEA)
  2167  (JSmol)              -131.2     -110.4        8.2   14.5   bis(Tetramethylammonium) tetraiodo-fluoro-nitrosyl-osmium (TEDYEG)
  2177  (JSmol)                10.9        -.-       21.2    -.-   Iridium(iii) trifluoride (IrF3) (ICSD 16676)
  2180  (JSmol)  -138.6      -142.8        -.-       31.4    -.-   Iridium(vi) hexafluoride (IrF6) (ICSD 171654)
  2181  (JSmol)              -402.9        -.-       26.8    -.-   Potassium hexafluoroiridate(iv) (K2IrF6) (ICSD 95779)
  2187  (JSmol)              -178.3     -237.7       25.3   59.4   fac-Tetraethylammonium trichloro-trifluoro-iridium(v) (MAKGUA)
  2194  (JSmol)              -226.4     -472.9       51.0   79.7   tris(mu-2-Iodo)-bis(h5-pentamethylcyclopentadienyl)-di-iridium hexafluorophosphate (GUSJEJ)
  2196  (JSmol)              -486.2     -450.1       18.3   32.6   (2,2'-Bipyrimidine)-chloro-(dimethyl sulfoxide)-platinum(ii) hexafluorophosphate (USOWIJ)
  2204  (JSmol)              -135.3     -179.8       14.5   62.5   Platinum(iv) tetrafluoride (PtF4) (ICSD 71579)
  2206  (JSmol)              -481.1     -556.4       47.2   18.3   Potassium hexafluoroplatinate(iv) (K2PtF6) (ICSD 16892)
  2215  (JSmol)              -338.3     -325.3       26.0   36.1   bis(Tetramethylammonium) hexafluoroplatinate(iv) (TMAPTF01)
  2236  (JSmol)   -86.9       -69.0     -169.8       63.4   92.5   Gold(iii) fluoride (AuF3) (ICSD 16876)
  2246  (JSmol)              -361.0     -403.7       24.7   52.8   bis(Methyl isocyanide)-gold(i) hexafluorophosphate (LUVJIV)
  2257  (JSmol)              -370.1     -509.6       46.4   76.6   Magnesium hydrogen fluoride tetrafluoroaurate hexafluoroaurate (MgHF(AuF4)(AuF6)) (ICSD 415872)
  2268  (JSmol)   -70.3       -54.1     -125.2       28.8   46.8   Mercury difluoride (HgF2)
  2278  (JSmol)              -377.9     -426.1       29.2   32.9   bis(tris(Dimethylamino)sulfonium) bis(mu-2-fluoro)-tetrakis(trifluoromethyl)-mercury (TUQSUT)
  2280  (JSmol)              -641.9     -726.4       19.8   20.5   (18-Crown-6)-potassium bis(trifluoromethyl)-iodo-mercury (AQEPIV)
  2289  (JSmol)  -105.1      -103.1     -294.9       35.0   70.6   Mercury fluoride (Hg2F2) (ICSD 72354)
  2296  (JSmol)              -526.4     -885.9       15.3   56.6   Potassium hexafluorothallate(iii) (K3TlF6) (ICSD 19068)
  2297  (JSmol)              -527.9     -771.8       54.9   49.5   Rubidium hexafluorothallate(iii) (Rb3TlF6) (ICSD 19075)
  2300  (JSmol)              -401.7     -444.8       21.1   34.5   Thallium hexafluoroarsenate (TlAsF6) (ICSD 417954)
  2301  (JSmol)              -426.5     -669.6        9.1   57.6   Thallium tetrafluoroaluminate (TlAlF4)
  2303  (JSmol)   -77.6       -62.6     -119.4       35.9   41.0   Thallium(i) fluoride (TlF) (ICSD 90992)
  2308  (JSmol)               -94.8     -129.0       49.2   45.3   Thallium(iii) trifluoride (TlF3) (ICSD 10365)
  2312  (JSmol)             -1272.3    -1798.7       33.6   34.7   bis(Mesitylene)-thallium tetrateflate-boron (FIVCOC)
  2324  (JSmol)              -280.3     -303.9       38.9   17.9   Catena-((mu-4-Ethane-1,2-disulfonato-O,O',O'',O''')-bis(mu-3-fluoro)-di-lead(ii)) (TIQGAC)
  2339  (JSmol)  -158.7      -212.6     -315.5       44.9   51.3   Lead(ii) fluoride (PbF2)
  2341  (JSmol)  -225.1      -190.8     -378.5       24.6   72.3   Lead(iv) tetrafluoride (PbF4) (ICSD 16795)
  2346  (JSmol)              -386.5     -363.5       37.0   38.6   bis((mu-2-Tetrafluoroborato-F,F')-(nu-5-pentamethyl-cyclopentadienyl))-lead (VALVOT)
  2364  (JSmol)             -1035.9    -1703.7       30.6   45.1   Pyromorphite (Pb5(PO4)3(F))
  2372  (JSmol)              -255.7     -184.7       78.0   65.1   Bismuth pentafluoride (BiF5) (ICSD 25023)
  2375  (JSmol)  -215.0      -153.0     -204.3       45.4   36.8   Bismuth trifluoride (BiF3) (ICSD 9015)
  2378  (JSmol)              -278.4     -223.3       66.9   87.4   Lithium hexafluorobismuthate (LiBiF6) (ICSD 15119)
  2380  (JSmol)             -1505.5    -1455.7       28.5   16.5   Nona-aqua-bismuth(iii) tris(triflate) (ZEZTUT)
  2381  (JSmol)              -899.2     -932.9       17.0   26.9   Potassium 18-crown-6 tris(perfluorophenylthiolato)-isothiocyanato-bismuth(iii) (YULBEM)
  2382  (JSmol)              -362.7     -616.2       49.3   72.8   Potassium hexafluorobismuthate (KBiF6) (ICSD 25024)
  2383  (JSmol)              -506.0     -656.7       79.4   73.4   Rubidium hexafluorobismuthate (RbBiF6) (ICSD 15121)
  2384  (JSmol)              -411.1     -741.7       72.9   78.8   Sodium hexafluorobismuthate (NaBiF6) (ICSD 15120)
  2397  (JSmol)              -341.9     -667.5       79.5   74.7   Cesium hexafluorobismuthate (CsBiF6) (ICSD 15122)
  2404  (JSmol)             -1795.2    -1790.6       29.4   20.0   Difluoro-tris(pentafluorophenyl)-bismuth bis(tris(pentafluorophenyl)-bismuth) (SETNOU)