Accuracy

Pr_(FATWOM) r   6575 Praseodymium complex, CCDC: FATWOM (Geo)

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    #  Species Formula
  6565 Praseodymium complex, CCDC: BUVWIY01 (Geo)H18O9Pr
  6566 Praseodymium complex, CCDC: BAFYOX (Geo)C20H20N5O9Pr
  6567 Praseodymium complex, CCDC: KAHGEF (Geo)C16H18N7O9Pr
  6568 Praseodymium complex, CCDC: ECABAL (Geo)C24H16N7O9Pr
  6569 Praseodymium complex, CCDC: FEDYAO (Geo)C18H33N6O10Pr
  6570 Praseodymium complex, CCDC: DUCHAK (Geo)C13H12N9O10Pr
  6571 Praseodymium complex, CCDC: BIFYUK (Geo)C10H18N2O11Pr
  6572 Praseodymium complex, CCDC: QIMRIN (Geo)C18H32N11O11Pr
  6573 Praseodymium complex, CCDC: QOZVEG (Geo)C12H24N2O12Pr
  6574 Praseodymium complex, CCDC: XOKYIF (Geo)C6H24O13Pr
  6575 Praseodymium complex, CCDC: FATWOM (Geo) C12H16N3O13Pr
  6576 Praseodymium complex, CCDC: JEXXUF (Geo)C12H24N5O13Pr
  6577 Praseodymium complex, CCDC: XAVWUM (Geo)C10H20N3O14Pr
  6578 Praseodymium complex, CCDC: PEHXIJ (Geo)C13H26N3O14Pr
  6579 Praseodymium complex, CCDC: RUGQUF (Geo)C22H26N3O14Pr
  6580 Praseodymium complex, CCDC: QOVXII (Geo)C8H20O15Pr
  6581 Praseodymium complex, CCDC: SERWOB01 (Geo)C12H24N3O15Pr
  6582 Praseodymium complex, CCDC: HEDKAC (Geo)C22H28N5O16Pr
  6583 Praseodymium complex, CCDC: QISQEO (Geo)C8H12N16O16Pr
  6584 Praseodymium complex, CCDC: LEJSOI (Geo)C12H16N6O20Pr
  6585 Praseodymium complex, CCDC: KUSXUR (Geo)C42H75N6O3Si6Pr


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
Praseodymium complex, CCDC: FATWOM
 <Pr-O2> <Pr-O3> <> <Pr-O4> <> <> <> <> <> <> <> <> <> <> <> <Pr-O8> GR=CCDC
 Pr     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.49496290 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.50800235 +1  120.9910930 +1    0.0000000 +0     1     2     0
  O     2.51153343 +1  113.7352087 +1 -139.5109660 +1     1     2     3
  O     2.14407811 +1  131.0983860 +1 -140.8685729 +1     2     1     3
  O     2.14694182 +1  149.8371682 +1  -61.7657522 +1     3     1     2
  O     2.15059914 +1  165.7691311 +1   48.4224476 +1     4     1     2
  O     2.56179974 +1  126.3206475 +1  115.5879151 +1     1     2     3
  O     3.46661207 +1   82.0816401 +1  144.3859412 +1     1     2     3
  O     3.52108170 +1   93.4694167 +1   69.0730767 +1     1     2     3
  O     2.60727688 +1   82.2011163 +1  -74.4467509 +1     9     1     2
  N     1.21768272 +1   33.6777125 +1  177.4649113 +1     5     2     1
  N     1.20279608 +1   32.9129040 +1 -167.4235652 +1     7     4     1
  N     1.31705115 +1  179.9885208 +1  -42.6641535 +1     3     1     2
  O     1.20307157 +1  127.5055055 +1 -179.9513813 +1    12     5     2
  O     1.21406065 +1  115.4941918 +1  160.8441197 +1    14     3     1
  O     1.21960774 +1  127.4961989 +1  179.8453677 +1    13     7     4
  C     1.35875385 +1  162.9234793 +1  -97.8212914 +1    11     9     1
  C     1.39337043 +1  125.8940508 +1 -108.5696881 +1    18    11     9
  C     1.39536276 +1  119.3585282 +1 -179.8309761 +1    19    18    11
  C     1.39225088 +1  120.9222802 +1    0.0450775 +1    20    19    18
  C     1.39437212 +1  120.1054087 +1    0.2330864 +1    21    20    19
  C     1.38928597 +1  119.2199045 +1   -0.3489383 +1    22    21    20
  C     1.41876981 +1   88.0698934 +1  178.5498318 +1    10     1     2
  C     1.45942734 +1  132.5603893 +1  -88.2292495 +1     8     1     2
  C     1.45432965 +1  117.7218677 +1   83.2722591 +1     8     1     2
  C     1.41872480 +1  108.0505234 +1 -161.6584172 +1     9     1     2
  C     1.40835366 +1  121.5957415 +1  -21.9029800 +1     9     1     2
  C     1.43037383 +1   68.6901930 +1  151.0534429 +1    11     9     1
  H     1.08656508 +1  121.2273883 +1   -0.5615436 +1    19    18    11
  H     1.09132938 +1  119.2558867 +1  179.7694497 +1    20    19    18
  H     1.08929705 +1  120.1487359 +1  179.6423773 +1    21    20    19
  H     1.09089545 +1  120.9766075 +1  178.5510616 +1    22    21    20
  H     1.10768330 +1  111.5393807 +1  170.6964510 +1    24    10     1
  H     1.11823874 +1  103.0317450 +1   57.1057713 +1    24    10     1
  H     1.10750990 +1  105.6924061 +1 -120.2101796 +1    25     8     1
  H     1.10576292 +1  107.0633152 +1  121.0637116 +1    25     8     1
  H     1.10278016 +1  109.7559066 +1  147.0626665 +1    26     8     1
  H     1.11528888 +1  103.8435302 +1   32.1653720 +1    26     8     1
  H     1.10750944 +1  108.2072562 +1 -139.0468694 +1    27     9     1
  H     1.10264375 +1  111.1300315 +1  100.8205589 +1    27     9     1
  H     1.10534475 +1  109.4897887 +1  154.6742962 +1    28     9     1
  H     1.11766343 +1  100.8121751 +1   39.5529150 +1    28     9     1
  H     1.10814130 +1  109.6316922 +1 -135.6535450 +1    29    11     9
  H     1.10285583 +1  109.1544074 +1  104.0341382 +1    29    11     9