Accuracy

Nd_(FUHQII) r   6647 Neodymium complex, CCDC: FUHQII (Geo)

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    #  Species Formula
  6637 Neodymium complex, CCDC: ANTNND10 (Geo)C33H36N9O12Nd
  6638 Neodymium complex, CCDC: CAHJAX (Geo)C6H24O13Nd
  6639 Neodymium complex, CCDC: FUCRAW (Geo)H8N3O13Nd
  6640 Neodymium complex, CCDC: SOKBAV (Geo)C12H16N3O13Nd
  6641 Neodymium complex, CCDC: SOTXEE (Geo)C3H13N4O13Nd
  6642 Neodymium complex, CCDC: RIMQIN (Geo)C17H22N5O13Nd
  6643 Neodymium complex, CCDC: FIBXET (Geo)C2H12N7O13Nd
  6644 Neodymium complex, CCDC: SUCRIR (Geo)C12H16N7O13Nd
  6645 Neodymium complex, CCDC: BAWDIM10 (Geo)C8H18N3O14Nd
  6646 Neodymium complex, CCDC: RUGRAM (Geo)C8H18N3O14Nd
  6647 Neodymium complex, CCDC: FUHQII (Geo) C12H12O15Nd
  6648 Neodymium complex, CCDC: HOXNND01 (Geo)C12H24N3O15Nd
  6649 Neodymium complex, CCDC: BEXQIE (Geo)H2N5O16Nd
  6650 Neodymium complex, CCDC: YURMUT (Geo)C22H28N5O16Nd
  6651 Neodymium complex, CCDC: LEJSUO (Geo)C12H16N6O20Nd
  6652 Neodymium complex, CCDC: YOGRIV (Geo)C31H50N3OSi3Nd
  6653 Neodymium complex, CCDC: OFONIG (Geo)C30H48N3O3Si3Nd
  6654 Neodymium complex, CCDC: OFONUS (Geo)C45H54N3O3Si3Nd
  6655 Neodymium complex, CCDC: WOFMOT (Geo)C36H69Si6Nd
  6656 Neodymium complex, CCDC: IMACAA (Geo)C31H71OSi6Nd
  6657 Neodymium complex, CCDC: YIBSIL (Geo)C20H58N3O2Si6Nd


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
Neodymium complex, CCDC: FUHQII
 <Nd-O2> <Nd-O2> <> <Nd-O2> <> <> <Nd-O2> <> <> <Nd-O6> <> <> <Nd-O7> GR=CCDC
 Nd     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.43189976 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.43190018 +1   82.0303758 +1    0.0000000 +0     1     2     0
  O     2.43190061 +1  161.5504492 +1  -54.1238410 +1     1     2     3
  O     2.43190244 +1   97.0661557 +1  166.4268149 +1     1     2     3
  O     2.43195836 +1   80.7807870 +1  -99.8579445 +1     1     2     3
  O     2.43200031 +1   99.5007145 +1   83.9528085 +1     1     2     3
  O     3.29481889 +1  142.7662104 +1   59.5840465 +1     1     2     3
  O     3.22492008 +1   75.9701205 +1  -49.9434324 +1     1     2     3
  O     3.24541582 +1   48.6358359 +1  163.7432798 +1     1     2     3
  O     2.23609394 +1  176.8195122 +1   88.3760008 +1     6     1     2
  O     2.24120476 +1  177.3230669 +1 -149.6673967 +1     2     1     3
  O     2.23658671 +1  177.7994088 +1    9.3386513 +1     5     1     2
  O     2.23823536 +1  176.2271061 +1  -65.9196931 +1     3     1     2
  O     2.23767258 +1  179.9961794 +1  144.4813252 +1     4     1     2
  O     2.23724090 +1  179.5715740 +1 -147.5723171 +1     7     1     2
  H     2.08002196 +1  132.2545918 +1  148.1032785 +1    10     1     2
  H     1.81956651 +1   63.3718682 +1  106.9678421 +1    17    10     1
  C     1.22334641 +1   26.2223713 +1  -14.8879450 +1    13     5     1
  C     1.40077853 +1  120.1592612 +1  -88.1076346 +1     9     1     2
  H     1.09457528 +1  111.7411143 +1 -120.3467620 +1    20     9     1
  H     1.09506017 +1  111.4035474 +1  115.5873380 +1    20     9     1
  C     1.22492577 +1   26.2868418 +1  -10.7740788 +1    11     6     1
  C     1.22407124 +1   26.1220499 +1  -13.2642979 +1    16     7     1
  C     1.40019635 +1  119.7547251 +1 -153.1520384 +1     8     1     2
  C     1.40021437 +1  119.5513571 +1   35.0231570 +1     8     1     2
  H     1.09393852 +1  111.6254417 +1 -120.1284044 +1    26     8     1
  H     1.09445073 +1  111.8772295 +1  115.6419299 +1    26     8     1
  C     1.22505556 +1   26.0879858 +1  -11.5421795 +1    14     3     1
  H     1.09415183 +1  112.4464126 +1 -122.2148512 +1    25     8     1
  C     1.40060432 +1  119.9031314 +1   91.0692665 +1     9     1     2
  H     1.09357613 +1  111.9165249 +1 -118.9431165 +1    31     9     1
  H     1.09568053 +1  111.1155055 +1  117.1059951 +1    31     9     1
  C     1.22353622 +1   25.8271308 +1  -14.5122133 +1    12     2     1
  H     1.09422320 +1  111.0896476 +1  113.6446397 +1    25     8     1
  C     1.40006498 +1  119.9956431 +1    1.0496110 +1    10     1     2
  H     1.09258142 +1  112.0952148 +1 -120.7151862 +1    36    10     1
  H     1.09553508 +1  111.0171889 +1  115.3614670 +1    36    10     1
  C     1.22359186 +1   26.1458469 +1  -15.9003834 +1    15     4     1
  C     1.10020643 +1   34.0016085 +1  -35.0970857 +1    18    17    10