Accuracy

Dy_(KITGEZ) r   6954 Dysprosium complex, CCDC: KITGEZ (Geo)

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    #  Species Formula
  6944 Dysprosium complex, CCDC: XEQMAH (Geo)C27H27N4O3Dy
  6945 Dysprosium complex, CCDC: TUQTUU01 (Geo)C48H66N8O5Dy
  6946 Dysprosium complex, CCDC: CECLIF10 (Geo)C6H24N6O6Dy
  6947 Dysprosium complex, CCDC: XAWVIA (Geo)C15H15N5O8Dy
  6948 Dysprosium complex, CCDC: BAFZUE (Geo)C20H18N5O8Dy
  6949 Dysprosium complex, CCDC: MANHOY (Geo)C29H23N6O8Dy
  6950 Dysprosium complex, CCDC: BUVXIZ01 (Geo)H18O9Dy
  6951 Dysprosium complex, CCDC: ZZZARG01 (Geo)H18O9Dy
  6952 Dysprosium complex, CCDC: FUXRAR (Geo)C6H24O9Dy
  6953 Dysprosium complex, CCDC: GINPUO (Geo)C8H26O9Dy
  6954 Dysprosium complex, CCDC: KITGEZ (Geo) C8H26O9Dy
  6955 Dysprosium complex, CCDC: HANCAA (Geo)C10H28O9Dy
  6956 Dysprosium complex, CCDC: BIHLIN (Geo)C23H37N3O9Dy
  6957 Dysprosium complex, CCDC: VOSBOU (Geo)C16H28N5O9Dy
  6958 Dysprosium complex, CCDC: YAVSOD (Geo)C20H20N6O10Dy
  6959 Dysprosium complex, CCDC: SETADY (Geo)C10H18N2O11Dy
  6960 Dysprosium complex, CCDC: DIBTIR (Geo)H6N3O12Dy
  6961 Dysprosium complex, CCDC: TISQUH (Geo)C18H25N4O12Dy
  6962 Dysprosium complex, CCDC: PALBIN (Geo)C4H14N8O12Dy
  6963 Dysprosium complex, CCDC: FOPNAZ (Geo)C12H40O14Dy
  6964 Dysprosium complex, CCDC: LEYHUS (Geo)C12H30N3O18Dy


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
Dysprosium complex, CCDC: KITGEZ
 <Dy-O2> <Dy-O3> <> <Dy-O4> <> <> <Dy-O5> <> <> <Dy-O*> <> <> <Dy-O6> GR=CCDC
 Dy     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.35909998 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.37859997 +1   98.7149834 +1    0.0000000 +0     1     2     0
  O     2.37890001 +1   80.5233675 +1 -132.2203458 +1     1     2     3
  O     2.38739998 +1  139.2963314 +1  125.0868542 +1     1     2     3
  O     2.41420000 +1   89.8228640 +1   67.5249306 +1     1     2     3
  O     2.44909993 +1  137.9188410 +1  -70.8367579 +1     1     2     3
  O     4.09142124 +1   96.7286570 +1 -102.2526530 +1     1     2     3
  O     3.65789212 +1  142.5104992 +1   14.4211416 +1     1     2     3
  O     4.17835469 +1  133.1404204 +1   76.4832110 +1     1     2     3
  C     1.49074722 +1  135.2440560 +1  123.8315127 +1     6     1     2
  C     1.42888101 +1   89.4771631 +1  -15.9061650 +1    10     1     2
  C     1.42567285 +1  117.0744926 +1 -135.9943887 +1    10     1     2
  C     1.42400517 +1  136.9952705 +1   78.6416273 +1     9     1     2
  C     1.42139573 +1  100.7674701 +1 -125.9406066 +1     9     1     2
  C     1.47285367 +1  123.5601461 +1  172.4056145 +1     7     1     2
  C     1.46891073 +1  126.7372705 +1   -6.9447372 +1     7     1     2
  C     1.43686595 +1   86.7378873 +1  161.3820211 +1     8     1     2
  H     0.99802127 +1  117.9058365 +1  -68.6853957 +1     6     1     2
  H     1.00172556 +1  148.6483482 +1  -70.9209873 +1     8     1     2
  H     1.11251417 +1  120.0379425 +1  119.5193821 +1     4     1     2
  H     0.97880784 +1  138.9710576 +1  -63.9475883 +1     4     1     2
  H     1.00667823 +1  132.4131580 +1  -64.4207660 +1     2     1     3
  H     1.00866782 +1  128.2769911 +1  117.4937019 +1     2     1     3
  H     0.98163025 +1  140.9840267 +1   72.3927738 +1     5     1     2
  H     1.08181215 +1  116.9640545 +1 -103.6476946 +1     5     1     2
  H     1.03429782 +1  112.2900408 +1  167.4400440 +1     3     1     2
  H     0.98814375 +1  143.5851346 +1  -23.8005603 +1     3     1     2
  H     1.11302990 +1  105.7179061 +1 -138.4614936 +1    11     6     1
  H     1.10568616 +1  103.2919499 +1  -22.5082839 +1    11     6     1
  H     1.12385538 +1  105.4398738 +1  154.8581272 +1    12    10     1
  H     1.10479457 +1  111.3720678 +1  -87.6192138 +1    12    10     1
  H     1.11747349 +1  108.1200422 +1  161.3678056 +1    13    10     1
  H     1.11206478 +1  101.0230384 +1  -84.7697556 +1    13    10     1
  H     1.11372304 +1  111.7314859 +1  175.2066576 +1    14     9     1
  H     1.10914560 +1  103.1041392 +1  -69.3626670 +1    14     9     1
  H     1.10982608 +1  106.0344631 +1   93.6598312 +1    15     9     1
  H     1.11465062 +1  111.7066864 +1 -148.5482243 +1    15     9     1
  H     1.10498812 +1  103.4402477 +1   32.0865229 +1    16     7     1
  H     1.11020770 +1  108.9073552 +1  147.3785730 +1    16     7     1
  H     1.10691635 +1  104.2260398 +1   28.5487949 +1    17     7     1
  H     1.11033427 +1  108.6130867 +1  143.3921653 +1    17     7     1
  H     1.10659667 +1  108.8879112 +1   80.7939511 +1    18     8     1
  H     1.11922203 +1  107.0860207 +1 -160.6431883 +1    18     8     1