Accuracy

Tm_(FAGYUI) r   7071 Thulium complex, CCDC: FAGYUI (Geo)

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    #  Species Formula
  7061 Thulium complex, CCDC: VEQFUS (Geo)C27H27N4O3Tm
  7062 Thulium complex, CCDC: MEDNAK (Geo)C26H30N8O6Tm
  7063 Thulium complex, CCDC: BAGBIV (Geo)C20H18N5O8Tm
  7064 Thulium complex, CCDC: ZZZARJ01 (Geo)H18O9Tm
  7065 Thulium complex, CCDC: KITHAW (Geo)C8H26O9Tm
  7066 Thulium complex, CCDC: HANCUU (Geo)C10H26O9Tm
  7067 Thulium complex, CCDC: TUPYUY (Geo)C30H57N6O12Tm
  7068 Thulium complex, CCDC: LEYJOO (Geo)C12H30N3O18Tm
  7069 Thulium complex, CCDC: FENWOK (Geo)C20H30N3O18Tm
  7070 Thulium complex, CCDC: MIHPAU (Geo)C51H30O8F21P2Tm
  7071 Thulium complex, CCDC: FAGYUI (Geo) C7H18NO10STm
  7072 Thulium complex, CCDC: NIHZUZ (Geo)C42H34N8O14Tm2
  7073 Thulium complex, CCDC: COZHII (Geo)C36H32N6O16Tm2
  7074 Thulium complex, CCDC: LUPCII (Geo)C32H88N6O2Si8Tm2
  7075 Ytterbium complex, CCDC: RENXIR (Geo)C30H24N6Yb
  7076 Ytterbium complex, CCDC: YIZHUK (Geo)C30H60N6Yb
  7077 Ytterbium complex, CCDC: BORVIN (Geo)C27H30B3N18Yb
  7078 Ytterbium complex, CCDC: QIVCAZ (Geo)C28H31B2N12O2Yb
  7079 Ytterbium complex, CCDC: VIWDIO (Geo)C21H32N4O3Yb
  7080 Ytterbium complex, CCDC: MIPTUA (Geo)C27H27N4O3Yb
  7081 Ytterbium complex, CCDC: IBIFII (Geo)C64H59O4Yb


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
Thulium complex, CCDC: FAGYUI
 <Tm-O2> <Tm-O3> <> <Tm-O4> <> <> <Tm-O5> <> <> <Tm-O6> <> <> <Tm-O7> GR=CCDC
 Tm     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.29150001 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.31295650 +1   90.3360855 +1    0.0000000 +0     1     2     0
  O     2.31653384 +1  102.6193083 +1   83.7825945 +1     1     2     3
  O     2.31956343 +1   82.1334999 +1 -166.9303182 +1     1     2     3
  O     2.32577740 +1  179.9971733 +1    5.9015660 +1     1     2     3
  O     2.34644281 +1   76.7672414 +1  -70.0236175 +1     1     2     3
  O     4.51074876 +1  155.8760880 +1 -124.7950202 +1     1     2     3
  O     4.32086110 +1  132.2695660 +1   88.3289922 +1     1     2     3
  C     1.27127626 +1  144.8563256 +1  173.2135406 +1     2     1     3
  C     1.47343406 +1  124.9914884 +1  175.5426959 +1    10     2     1
  C     1.38080865 +1  126.1199992 +1   -0.8168226 +1    11    10     2
  H     1.08892276 +1  120.9492907 +1    0.2667396 +1    12    11    10
  C     1.40593150 +1  118.3682499 +1 -179.5955050 +1    12    11    10
  H     1.09538754 +1  119.2582296 +1 -179.9192601 +1    14    12    11
  C     1.38671751 +1  120.4403728 +1    0.2008059 +1    14    12    11
  H     1.09807501 +1  119.8932003 +1  179.8960631 +1    16    14    12
  C     1.41013362 +1  120.9870143 +1   -0.1364877 +1    16    14    12
  H     1.09848594 +1  119.0342501 +1  179.9595413 +1    18    16    14
  C     1.37593293 +1  118.6337390 +1    0.0238769 +1    18    16    14
  S     1.76764973 +1  127.7554607 +1  179.6952521 +1    20    18    16
  N     1.33919564 +1  121.3772782 +1   -5.0132490 +1    10     2     1
  O     1.41811414 +1  112.4532679 +1  -73.3052283 +1    21    20    18
  O     1.41869943 +1  112.2737990 +1   74.5233988 +1    21    20    18
  H     0.98100505 +1  130.0804210 +1    5.6163020 +1     4     1     2
  H     0.97352074 +1  113.8608521 +1   88.7823507 +1     9     1     2
  H     0.90812470 +1  161.6967631 +1  153.7263708 +1     5     1     2
  H     0.98904924 +1  135.4761927 +1 -160.7570294 +1     7     1     2
  H     1.06121325 +1  130.6260131 +1 -129.5239391 +1     6     1     2
  H     0.99353742 +1  125.2838989 +1  -73.3501586 +1     3     1     2
  H     0.96395728 +1  108.1731455 +1   27.4058125 +1     8     1     2
  H     0.99105229 +1  132.1298322 +1  101.5503560 +1     3     1     2
  H     1.05494931 +1  127.0913434 +1  172.4607192 +1     4     1     2
  H     0.97324424 +1  136.5834881 +1  -63.3347014 +1     9     1     2
  H     0.99715449 +1  118.4829045 +1   -6.1448598 +1     7     1     2
  H     0.96647976 +1  121.3279275 +1  -96.3568791 +1     8     1     2
  H     0.98143630 +1  128.3420980 +1   64.0868592 +1     6     1     2
  H     2.02192660 +1  104.8238963 +1   -3.4885368 +1     5     1     2