Accuracy

Ho_(QOZVOQ) r   6985 Holmium complex, CCDC: QOZVOQ (Geo)

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    #  Species Formula
  6975 Holmium complex, CCDC: ECOJEL (Geo)C41H56N7O6Ho
  6976 Holmium complex, CCDC: PHPRHO10 (Geo)C45H35O7Ho
  6977 Holmium complex, CCDC: XAWVOG (Geo)C15H15N5O8Ho
  6978 Holmium complex, CCDC: BAGBAN (Geo)C20H18N5O8Ho
  6979 Holmium complex, CCDC: BUVXOF01 (Geo)H18O9Ho
  6980 Holmium complex, CCDC: HOESUL02 (Geo)H18O9Ho
  6981 Holmium complex, CCDC: GINREA (Geo)C8H26O9Ho
  6982 Holmium complex, CCDC: KITGOJ (Geo)C8H26O9Ho
  6983 Holmium complex, CCDC: HANCII (Geo)C10H28O9Ho
  6984 Holmium complex, CCDC: GODKOZ (Geo)C16H26N4O9Ho
  6985 Holmium complex, CCDC: QOZVOQ (Geo) C12H26NO10Ho
  6986 Holmium complex, CCDC: CAQFUV (Geo)C11H13N10O10Ho
  6987 Holmium complex, CCDC: CUSYUK (Geo)C10H18N2O11Ho
  6988 Holmium complex, CCDC: LIZPAL (Geo)C10H18N2O11Ho
  6989 Holmium complex, CCDC: NUJBAV (Geo)C21H9N3O12Ho
  6990 Holmium complex, CCDC: XARVOB (Geo)C18H24N4O12Ho
  6991 Holmium complex, CCDC: XORGEQ (Geo)C21H23O16Ho
  6992 Holmium complex, CCDC: LEYJEE (Geo)C12H30N3O18Ho
  6993 Holmium complex, CCDC: SIFZIQ (Geo)C15H7O8F18Ho
  6994 Holmium complex, CCDC: BEYSAZ (Geo)H8O12S2Ho
  6995 Holmium complex, CCDC: GAKYIA (Geo)C14H26O12S2Ho


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7 SPARKLES CHARGE=2.0
Holmium complex, CCDC: QOZVOQ
 <Ho-O2> <Ho-O3> <> <Ho-O4> <> <> <Ho-O5> <> <> <Ho-O6> <> <> <Ho-O7> GR=CCDC
 Ho     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.35039996 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.36779995 +1   75.8604926 +1    0.0000000 +0     1     2     0
  O     2.37679996 +1   96.7368226 +1  101.7634454 +1     1     2     3
  O     2.37969998 +1  171.2939324 +1  -19.1620631 +1     1     2     3
  O     2.38359999 +1  114.8253251 +1 -165.8272018 +1     1     2     3
  O     2.41480000 +1   72.9134187 +1  -80.2074458 +1     1     2     3
  O     4.24296752 +1  122.2522564 +1  120.0433977 +1     1     2     3
  O     3.58256541 +1   80.4299744 +1 -138.3982350 +1     1     2     3
  O     2.18548548 +1   93.0321487 +1   97.3665669 +1     9     1     2
  O     2.17235569 +1   60.0981218 +1  149.8349918 +1    10     9     1
  H     1.35758689 +1  121.4556368 +1 -109.6709644 +1     7     1     2
  H     0.98650019 +1  124.2459912 +1 -158.6037413 +1     2     1     3
  H     0.98122849 +1  127.5689593 +1  139.2583737 +1     3     1     2
  H     1.09821427 +1  111.3971575 +1   40.5289760 +1     6     1     2
  H     0.98740911 +1  126.6126976 +1   28.1914082 +1     8     1     2
  H     0.98752222 +1  120.2686401 +1   -2.1493218 +1     5     1     2
  H     0.97116287 +1  137.0896912 +1  -35.1001203 +1     4     1     2
  H     1.10432844 +1  121.2405459 +1  147.6049974 +1     4     1     2
  N     1.19121022 +1   31.5973040 +1   -0.9650857 +1    11    10     9
  C     1.39168235 +1  128.7728974 +1   43.7749463 +1     7     1     2
  H     1.11861512 +1  106.7467128 +1  175.6246922 +1    21     7     1
  C     1.54371295 +1  108.5532375 +1  -65.2238770 +1    21     7     1
  H     1.11542687 +1  108.0606200 +1  -50.9283918 +1    23    21     7
  H     1.11412337 +1  109.5609733 +1 -164.0787997 +1    23    21     7
  C     1.52778637 +1  128.4327050 +1   38.9032514 +1     2     1     3
  H     1.11580519 +1  102.4658488 +1 -177.5091882 +1    26     2     1
  C     1.51823185 +1  105.5103413 +1  -60.3220870 +1    26     2     1
  H     1.12263583 +1  108.3748018 +1 -161.9114793 +1    28    26     2
  H     1.11439002 +1  110.2407813 +1  -49.2262208 +1    28    26     2
  C     1.53433286 +1  126.0624410 +1  -40.3703467 +1     3     1     2
  H     1.11512262 +1  102.3894146 +1 -178.3468080 +1    31     3     1
  C     1.54477805 +1  109.1511927 +1   57.0673481 +1    21     7     1
  H     1.11632466 +1  108.7765446 +1  162.1408307 +1    33    21     7
  H     1.11307003 +1  108.0508364 +1   49.6806239 +1    33    21     7
  C     1.44777622 +1  137.5974348 +1 -160.8308313 +1     6     1     2
  H     1.12111580 +1  104.8231714 +1 -167.6871066 +1    36     6     1
  C     1.52486275 +1  107.9503592 +1   74.5890609 +1    36     6     1
  H     1.11634681 +1  108.2876683 +1   30.3287316 +1    38    36     6
  H     1.12047805 +1  107.7591294 +1  140.8600463 +1    38    36     6
  C     1.45066880 +1   85.0229843 +1  142.3305434 +1     8     1     2
  H     1.12352248 +1  103.8519777 +1  178.9749986 +1    41     8     1
  C     1.52939193 +1  102.6657460 +1   64.5147662 +1    41     8     1
  H     1.12089109 +1  108.9766552 +1    0.7839531 +1    43    41     8
  H     1.12285367 +1  108.0894605 +1  110.3210009 +1    43    41     8
  C     1.52563819 +1  133.9053671 +1 -172.2898631 +1     5     1     2
  H     1.11908449 +1  101.9094476 +1  168.8069360 +1    46     5     1
  C     1.50792150 +1  107.1551865 +1   51.2771628 +1    46     5     1
  H     1.12114291 +1  109.0144777 +1  164.5350027 +1    48    46     5
  H     1.11639196 +1  110.4820429 +1   51.3844343 +1    48    46     5