Accuracy

Er_(SEGVAB) r   7020 Erbium complex, CCDC: SEGVAB (Geo)

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    #  Species Formula
  7010 Erbium complex, CCDC: TMHDER (Geo)C33H57O6Er
  7011 Erbium complex, CCDC: XEWVOK (Geo)C10H20N2O6Er
  7012 Erbium complex, CCDC: XEWWUR (Geo)C10H20N2O6Er
  7013 Erbium complex, CCDC: BAGBER (Geo)C20H18N5O8Er
  7014 Erbium complex, CCDC: AERETS02 (Geo)H18O9Er
  7015 Erbium complex, CCDC: GINRIE (Geo)C8H26O9Er
  7016 Erbium complex, CCDC: KITGUP (Geo)C8H26O9Er
  7017 Erbium complex, CCDC: HANCOO (Geo)C10H28O9Er
  7018 Erbium complex, CCDC: HENAEB (Geo)C10H19N2O9Er
  7019 Erbium complex, CCDC: KOZBUW (Geo)C21H24N3O9Er
  7020 Erbium complex, CCDC: SEGVAB (Geo) C6H6O12Er
  7021 Erbium complex, CCDC: VUSGUL (Geo)C12H24N3O12Er
  7022 Erbium complex, CCDC: YICCIW (Geo)C10H36O13Er
  7023 Erbium complex, CCDC: BOWXOA (Geo)N5O15Er
  7024 Erbium complex, CCDC: LEYJII (Geo)C12H30N3O18Er
  7025 Erbium complex, CCDC: SOKBID (Geo)C24H38N3O20Er
  7026 Erbium complex, CCDC: TEPKOO (Geo)C48H54N7O20Er
  7027 Erbium complex, CCDC: RUNQOG (Geo)C48H34N11O25Er
  7028 Erbium complex, CCDC: XOYXIS (Geo)C24H32O7F9Er
  7029 Erbium complex, CCDC: MUGYAO (Geo)C27H54N3O2Si2Er
  7030 Erbium complex, CCDC: XAMREI (Geo)C26H36NSi3Er


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=-3.0
Erbium complex, CCDC: SEGVAB
 <Er-O2> <Er-O3> <> <Er-O4> <> <> <Er-O5> <> <> <Er-O6> <> <> <Er-O7> GR=CCDC
 Er     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.19769997 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.27150004 +1  121.6389924 +1    0.0000000 +0     1     2     0
  O     2.30470005 +1   87.5460911 +1  166.2258047 +1     1     2     3
  O     2.34940001 +1   81.4936626 +1   75.5222735 +1     1     2     3
  O     2.37287045 +1   77.6040315 +1  -90.3406630 +1     1     2     3
  O     2.49705324 +1  153.6677920 +1 -141.8265012 +1     1     2     3
  O     2.23486194 +1  164.6805270 +1  -67.9906376 +1     6     1     2
  O     2.24040043 +1  132.9490771 +1 -149.6841658 +1     7     1     2
  O     2.23762691 +1  163.3857261 +1    7.7590271 +1     2     1     3
  O     2.23758660 +1  179.1905187 +1   22.6468934 +1     5     1     2
  O     2.23305097 +1  179.9971145 +1  154.1612170 +1     3     1     2
  O     2.23833894 +1  178.4636697 +1   73.5151192 +1     4     1     2
  C     1.26108857 +1  158.5212060 +1 -146.3994359 +1     7     1     2
  C     1.22571970 +1   26.9798533 +1  -16.4222358 +1    13     4     1
  C     1.22489133 +1   27.5821991 +1  -12.5701308 +1    12     3     1
  C     1.22881440 +1   27.0328750 +1    8.2605879 +1    11     5     1
  C     1.22684041 +1   27.3423357 +1  178.5529719 +1    10     2     1
  C     1.23028547 +1   26.9035891 +1 -176.1500272 +1     8     6     1
  H     1.10155357 +1  113.2271524 +1  176.1827028 +1    14     7     1
  H     1.10165161 +1  119.8390250 +1  179.8063929 +1    15    13     4
  H     1.09776334 +1  120.3527602 +1  179.7485323 +1    16    12     3
  H     1.10011211 +1  119.3047563 +1 -179.6975592 +1    17    11     5
  H     1.09753446 +1  120.0607573 +1  179.6045442 +1    18    10     2
  H     1.09994115 +1  118.6699462 +1  179.7310495 +1    19     8     6