Accuracy

Er_(HENAEB) r   7018 Erbium complex, CCDC: HENAEB (Geo)

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    #  Species Formula
  7008 Erbium complex, CCDC: TUMJEQ (Geo)C53H53N6O4Er
  7009 Erbium complex, CCDC: UFIRIK (Geo)C48H66N8O5Er
  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


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
Erbium complex, CCDC: HENAEB
 <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     2.23979995 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.26180000 +1   97.9326145 +1    0.0000000 +0     1     2     0
  O     2.26524837 +1   95.7829207 +1  127.8076396 +1     1     2     3
  O     2.39209997 +1  179.9986074 +1   73.7652789 +1     1     2     3
  O     2.39510001 +1   96.6108065 +1 -168.6543370 +1     1     2     3
  O     2.40340005 +1   81.8172926 +1  -80.0699119 +1     1     2     3
  N     3.06154732 +1   61.9747928 +1   77.1836123 +1     1     2     3
  N     3.18777409 +1  117.8056768 +1   53.4484632 +1     1     2     3
  O     2.21283415 +1  167.4163750 +1  -45.7207748 +1     4     1     2
  O     2.22424201 +1  164.0150525 +1  -62.7982051 +1     2     1     3
  O     2.21703957 +1  176.7411886 +1  151.1794636 +1     3     1     2
  C     1.48817867 +1  108.6089578 +1   39.8537178 +1     9     1     2
  C     1.55577040 +1  113.2674591 +1  -47.5648311 +1    13     9     1
  C     1.47283157 +1  109.6662580 +1  -85.9440472 +1     9     1     2
  C     1.20888826 +1   28.0867578 +1  -30.3315963 +1    12     3     1
  C     1.47892810 +1   98.4662195 +1  155.8204973 +1     9     1     2
  C     1.48392468 +1  129.3344842 +1  154.8943829 +1     5     1     2
  C     1.48584133 +1  101.5803857 +1  -20.4155998 +1     8     1     2
  C     1.20627355 +1   28.3724876 +1   -6.0340068 +1    11     2     1
  C     1.47638914 +1  105.4326395 +1   97.0602997 +1     8     1     2
  C     1.29846091 +1  140.4194549 +1  -43.2675591 +1     4     1     2
  H     1.01404802 +1  107.5866006 +1 -100.2780487 +1     6     1     2
  H     0.96923378 +1  127.1972335 +1  -83.6865848 +1     7     1     2
  H     1.11004737 +1  111.9708591 +1 -170.9284380 +1    13     9     1
  H     1.11758820 +1  107.8587308 +1   72.0044494 +1    13     9     1
  H     1.11304464 +1  107.4030736 +1 -167.0419397 +1    14    13     9
  H     1.11384103 +1  108.6604432 +1  -51.0710002 +1    14    13     9
  H     1.11192065 +1  112.4582040 +1 -106.4649048 +1    15     9     1
  H     1.10384337 +1  114.3638570 +1  133.2753853 +1    15     9     1
  H     1.12293556 +1  107.9060079 +1  -70.5258917 +1    17     9     1
  H     1.11303777 +1  114.0480920 +1  171.4818437 +1    17     9     1
  H     1.10445459 +1  102.7454327 +1  -89.3355923 +1    18     5     1
  H     1.10372856 +1  105.0945865 +1  153.0388373 +1    18     5     1
  H     1.11598747 +1  109.5889664 +1  -86.5293134 +1    19     8     1
  H     1.10622538 +1  113.4900338 +1  154.3338190 +1    19     8     1
  H     1.11620956 +1  110.7051157 +1  -88.9619368 +1    21     8     1
  H     1.10782611 +1  114.1784739 +1  151.2608328 +1    21     8     1
  H     0.98898112 +1  121.4895009 +1   63.7445065 +1     7     1     2
  H     0.95949403 +1  146.0378783 +1   77.2506926 +1     6     1     2
  H     0.97903483 +1  123.7635754 +1  -14.1263609 +1     5     1     2