Accuracy

Pr_(CAZGUF) r   6564 Praseodymium complex, CCDC: CAZGUF (Geo)

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    #  Species Formula
  6554 Praseodymium complex, CCDC: NPYPRP10 (Geo)C48H36N12Pr
  6555 Praseodymium complex, CCDC: KOBRUO (Geo)C64H32N16Pr
  6556 Praseodymium complex, CCDC: RUGNOW (Geo)C27H30B3N18Pr
  6557 Praseodymium complex, CCDC: MIPTEK (Geo)C27H27N4O3Pr
  6558 Praseodymium complex, CCDC: POGWIR (Geo)C44H67O5Pr
  6559 Praseodymium complex, CCDC: YOTYUB (Geo)C45H82N9O5Pr
  6560 Praseodymium complex, CCDC: PELGOC (Geo)C27H29N2O6Pr
  6561 Praseodymium complex, CCDC: VELRUZ (Geo)C16H38N2O7Pr
  6562 Praseodymium complex, CCDC: ZULRED (Geo)C34H34N5O7Pr
  6563 Praseodymium complex, CCDC: KAWBIT (Geo)C31H30N8O7Pr
  6564 Praseodymium complex, CCDC: CAZGUF (Geo) C15H25O8Pr
  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


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: CAZGUF
 <Pr-O2> <Pr-O3> <> <Pr-O4> <> <> <Pr-O8> <> <> <Pr-O9> <> <> <Pr-O5> GR=CCDC
 Pr     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.37880019 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.43960011 +1  103.4217762 +1    0.0000000 +0     1     2     0
  O     2.45770021 +1   65.4796915 +1 -110.3276991 +1     1     2     3
  O     2.45829976 +1  141.1058469 +1  -66.5021978 +1     1     2     3
  O     2.45899953 +1  107.6010430 +1  155.4591850 +1     1     2     3
  O     2.46170035 +1  102.1926695 +1   88.1075637 +1     1     2     3
  O     4.14422928 +1  102.6438470 +1  -99.6793048 +1     1     2     3
  O     4.12812319 +1  100.9977074 +1   48.3325865 +1     1     2     3
  C     1.25768308 +1  143.8856621 +1  -98.5335551 +1     6     1     2
  C     1.40331626 +1  122.1060369 +1    3.2525088 +1    10     6     1
  C     1.27177842 +1  143.0016932 +1  105.1481308 +1     7     1     2
  C     1.49511809 +1  116.6612552 +1 -176.7962218 +1    10     6     1
  C     1.49203295 +1  115.7913041 +1  179.6361234 +1    12     7     1
  C     1.26223869 +1  143.4070020 +1   81.0057207 +1     5     1     2
  C     1.40065641 +1  122.3075255 +1   -1.3327717 +1    15     5     1
  C     1.26389322 +1  144.0766591 +1 -140.2619337 +1     3     1     2
  C     1.49459865 +1  116.2415316 +1  179.4777501 +1    15     5     1
  C     1.49439789 +1  116.1223024 +1 -179.9347531 +1    17     3     1
  C     1.27047014 +1  141.9383806 +1    0.4679635 +1     4     1     2
  C     1.39971508 +1  122.1568674 +1    0.6370167 +1    20     4     1
  C     1.26370363 +1  145.5580793 +1  107.7597951 +1     2     1     3
  C     1.49072428 +1  115.9580474 +1 -179.4986036 +1    20     4     1
  C     1.49290009 +1  116.2622116 +1 -177.6432790 +1    22     2     1
  H     0.95697289 +1   63.3654540 +1  160.5094939 +1     8     1     2
  H     0.95656451 +1   62.9485519 +1  -88.8268929 +1     9     1     2
  H     0.95939423 +1   40.5176018 +1   92.3375327 +1     9     1     2
  H     0.95894799 +1   39.9773065 +1  -19.8122231 +1     8     1     2
  H     1.08250264 +1  118.0860293 +1  179.4717930 +1    11    10     6
  H     1.10167950 +1  111.4900469 +1   -1.5101454 +1    13    10     6
  H     1.09840197 +1  111.4195959 +1 -121.7221090 +1    13    10     6
  H     1.09897575 +1  111.2069464 +1  118.4313888 +1    13    10     6
  H     1.10628889 +1  110.6271359 +1  -66.7223841 +1    14    12     7
  H     1.09443564 +1  113.5999293 +1  171.6893871 +1    14    12     7
  H     1.10433728 +1  111.0667752 +1   49.4808407 +1    14    12     7
  H     1.08211454 +1  118.4779937 +1 -179.6663784 +1    16    15     5
  H     1.10163272 +1  111.6981157 +1  -18.1132899 +1    18    15     5
  H     1.09749587 +1  112.2613840 +1 -139.3174664 +1    18    15     5
  H     1.10195061 +1  110.5529433 +1  100.8350629 +1    18    15     5
  H     1.09743602 +1  112.3065298 +1 -140.9235662 +1    19    17     3
  H     1.10208852 +1  110.5652560 +1   99.1840170 +1    19    17     3
  H     1.10167425 +1  111.6488998 +1  -19.6630202 +1    19    17     3
  H     1.08238485 +1  118.4772326 +1  179.2711591 +1    21    20     4
  H     1.09454959 +1  113.6996743 +1  175.6163439 +1    23    20     4
  H     1.10434184 +1  110.9400816 +1   53.4203838 +1    23    20     4
  H     1.10714698 +1  110.7689985 +1  -62.6549552 +1    23    20     4
  H     1.10237729 +1  111.3547312 +1   20.9850550 +1    24    22     2
  H     1.10102442 +1  110.4803220 +1  -97.3667656 +1    24    22     2
  H     1.09698546 +1  112.4781698 +1  142.4356491 +1    24    22     2