Accuracy

Er_(VUSGUL) r   7021 Erbium complex, CCDC: VUSGUL (Geo)

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    #  Species Formula
  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
  7031 Erbium complex, CCDC: EHEKUX (Geo)C20H49O2Si3Er


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: VUSGUL
 <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     2.29339999 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.29350000 +1   82.0427402 +1    0.0000000 +0     1     2     0
  O     2.29399996 +1  160.9868466 +1  116.1287613 +1     1     2     3
  O     2.44925805 +1   71.7955314 +1  177.3108961 +1     1     2     3
  O     2.44991906 +1   97.6532965 +1   70.1059648 +1     1     2     3
  O     2.45016205 +1   99.5348336 +1  -71.3557651 +1     1     2     3
  O     2.19149211 +1  112.4680542 +1  162.8877312 +1     6     1     2
  O     2.22752463 +1  153.4403060 +1  173.1064767 +1     7     1     2
  O     2.22779529 +1  158.1584176 +1  108.1303267 +1     5     1     2
  N     2.84755228 +1   82.5930215 +1 -123.3792417 +1    10     5     1
  N     2.70609624 +1   94.6258156 +1 -170.8621558 +1     8     6     1
  N     2.82792286 +1   84.0522152 +1 -115.9492496 +1     9     7     1
  O     2.27822899 +1  109.2189892 +1   38.2522271 +1    11    10     5
  O     2.27699904 +1  108.8845908 +1   41.6436079 +1    13     9     7
  O     2.26778774 +1  118.2417936 +1   65.7641724 +1    12     8     6
  C     1.26058071 +1   29.8295842 +1 -175.9727319 +1     8     6     1
  C     1.20881303 +1   26.8136087 +1 -148.6657471 +1    10     5     1
  C     1.46158528 +1   62.3734740 +1   -9.6940294 +1    12     8     6
  C     1.46256038 +1   57.2759877 +1  -42.8484393 +1    11    10     5
  C     1.20954879 +1   26.8655219 +1 -140.0000436 +1     9     7     1
  C     1.46255181 +1   57.9390998 +1  -39.7992018 +1    13     9     7
  C     1.21178163 +1   32.0468979 +1  109.2037912 +1    16    12     8
  C     1.23375868 +1   30.5148656 +1  115.5407778 +1    14    11    10
  C     1.23189688 +1   30.6122052 +1  115.1983405 +1    15    13     9
  C     1.50098839 +1  123.9570835 +1  176.0749284 +1    23    16    12
  C     1.49875126 +1  120.4641115 +1  175.3385439 +1    25    15    13
  C     1.49793531 +1  120.2154307 +1  175.4306754 +1    24    14    11
  H     0.96734473 +1  130.4608613 +1   -0.8198578 +1     2     1     3
  H     1.05090406 +1  130.6513934 +1 -104.3675711 +1     3     1     2
  H     1.15226195 +1  116.2941156 +1  -47.0252688 +1     4     1     2
  H     0.97143868 +1  125.5537524 +1   93.5264877 +1     3     1     2
  H     1.10930038 +1  111.1800640 +1  141.9197394 +1    22    13     9
  H     1.11131905 +1  109.6814853 +1 -100.1280170 +1    22    13     9
  H     1.01805528 +1   72.9117318 +1 -174.6154070 +1    13     9     7
  H     1.10221778 +1  110.8851622 +1  100.2320791 +1    27    25    15
  H     1.10419730 +1  110.2964218 +1  -17.7337119 +1    27    25    15
  H     1.09871839 +1  113.1333698 +1 -138.0722100 +1    27    25    15
  H     0.95106866 +1  139.1181876 +1  131.5806938 +1     4     1     2
  H     1.06829543 +1  128.7813860 +1  172.2594286 +1     2     1     3
  H     1.12475932 +1  111.0198009 +1  128.2054943 +1    19    12     8
  H     1.11774618 +1  109.3983106 +1 -115.7267417 +1    19    12     8
  H     1.10946342 +1  111.3587805 +1  143.1231700 +1    20    11    10
  H     1.11131106 +1  109.7492128 +1  -98.8570288 +1    20    11    10
  H     1.01522700 +1   61.4928205 +1 -154.2954949 +1    12     8     6
  H     1.01786867 +1   73.5550416 +1 -177.6322238 +1    11    10     5
  H     1.09794299 +1  112.5062468 +1 -130.0994130 +1    26    23    16
  H     1.09949404 +1  111.3492462 +1  108.3150699 +1    26    23    16
  H     1.10274133 +1  110.1237932 +1  -10.3443253 +1    26    23    16
  H     1.09891082 +1  113.0731671 +1 -135.7208624 +1    28    24    14
  H     1.10251632 +1  110.9599921 +1  102.5760107 +1    28    24    14
  H     1.10437364 +1  110.3856915 +1  -15.4196448 +1    28    24    14