Accuracy

Tb_(XOCDIC) r   6942 Terbium complex, CCDC: XOCDIC (Geo)

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    #  Species Formula
  6932 Terbium complex, CCDC: MIHNUM (Geo)C51H30O8F21P2Tb
  6933 Terbium complex, CCDC: PEJZAF (Geo)C72H64N4O8P4Tb
  6934 Terbium complex, CCDC: FAGZAP (Geo)C7H18NO10STb
  6935 Terbium complex, CCDC: QALFUE (Geo)C14H26O12S2Tb
  6936 Terbium complex, CCDC: ZUNCEQ (Geo)C36H38N8O10Tb2
  6937 Terbium complex, CCDC: XUGBUW (Geo)C66H114O12Tb2
  6938 Terbium complex, CCDC: IDOZEG (Geo)C54H58N4O12Tb2
  6939 Terbium complex, CCDC: NIGYUX (Geo)C42H34N8O14Tb2
  6940 Terbium complex, CCDC: JAXWOU01 (Geo)C56H46O18Tb2
  6941 Terbium complex, CCDC: COSVOV (Geo)C64H56N6O26Tb2
  6942 Terbium complex, CCDC: XOCDIC (Geo) C12H12O18F18Tb2
  6943 Terbium complex, CCDC: BACBUC (Geo)C42H34O20Cl12Tb2
  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


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
Terbium complex, CCDC: XOCDIC
 <Tb-O2> <Tb-O3> <> <Tb-O4> <> <> <Tb-O5> <> <> <Tb-O6> <> <> <Tb-O7> GR=CCDC
 Tb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.32860000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.32979999 +1   77.5117102 +1    0.0000000 +0     1     2     0
  O     2.35769999 +1   78.9259789 +1 -136.9799479 +1     1     2     3
  O     2.36849997 +1  139.5427905 +1   58.7250344 +1     1     2     3
  O     2.37880005 +1   83.7814023 +1  151.8943537 +1     1     2     3
  O     2.40299999 +1   75.0655225 +1   81.4862918 +1     1     2     3
  O     2.55572277 +1  138.2057233 +1 -157.5516297 +1     1     2     3
  O     2.60210047 +1  116.6701329 +1  -63.7363135 +1     1     2     3
 Tb     3.58089455 +1  101.4492745 +1   63.0243917 +1     2     1     3
  O     2.20215845 +1   99.7809127 +1    0.9171689 +1     9     1     2
  O     2.24155172 +1  117.8338473 +1   22.4231602 +1     5     1     2
  O     2.20129916 +1  118.8301446 +1   38.3816817 +1     4     1     2
  O     2.20840088 +1  124.3351949 +1  -36.2027463 +1     3     1     2
  O     2.18637319 +1  152.5649509 +1   61.0896532 +1     2     1     3
  O     2.47542560 +1  133.6706691 +1   54.1149968 +1    10     2     1
  O     2.48773755 +1  139.4341537 +1  -63.0926668 +1    10     2     1
  O     2.54643770 +1  101.1318493 +1 -134.7269237 +1    10     2     1
  C     1.26643681 +1  179.9973225 +1   43.2785331 +1     2     1     3
  C     1.55033481 +1  116.0298825 +1 -161.0562716 +1    19     2     1
  F     1.33550170 +1  109.0848413 +1  -67.2738401 +1    20    19     2
  F     1.33033660 +1  113.9498293 +1   48.9677366 +1    20    19     2
  F     1.32043286 +1  115.4567732 +1  173.3301646 +1    20    19     2
  C     1.26284643 +1  143.7627111 +1   26.0977289 +1     4     1     2
  C     1.54871120 +1  115.1738574 +1 -155.1547195 +1    24     4     1
  F     1.32601556 +1  115.6495681 +1  123.4660884 +1    25    24     4
  F     1.33257830 +1  109.8738145 +1 -116.6989079 +1    25    24     4
  F     1.33134430 +1  113.3043612 +1    0.2404930 +1    25    24     4
  O     2.39458246 +1  119.0583294 +1  140.0794861 +1    10     2     1
  C     1.22587489 +1   25.5004482 +1 -174.1715190 +1    12     5     1
  C     1.55663862 +1  117.5763482 +1 -178.9880620 +1    30    12     5
  F     1.32800619 +1  116.4965959 +1  146.1535840 +1    31    30    12
  F     1.32638089 +1  118.1871720 +1   15.2308160 +1    31    30    12
  F     1.34543343 +1  104.7633467 +1  -99.5350303 +1    31    30    12
  H     0.99969351 +1  116.9518765 +1  -75.3635964 +1     6     1     2
  H     0.97317978 +1  121.7782630 +1   39.5094932 +1     7     1     2
  H     0.98601377 +1  124.8119363 +1   52.3837885 +1     8     1     2
  C     1.26286601 +1   27.1353114 +1 -178.5068498 +1    11     9     1
  C     1.24467164 +1   27.3471066 +1  172.6849388 +1    14     3     1
  C     1.54487740 +1  116.7559174 +1  178.9146633 +1    39    14     3
  F     1.32487132 +1  115.5969110 +1 -123.4339592 +1    40    39    14
  F     1.33255512 +1  109.7055174 +1  116.4876429 +1    40    39    14
  F     1.33093001 +1  112.7992495 +1   -0.2170154 +1    40    39    14
  C     1.27029495 +1  142.1902054 +1 -122.8451502 +1    29    10     2
  O     1.21647518 +1  128.7291439 +1   -6.2736393 +1    44    29    10
  C     1.55405057 +1  112.5520339 +1  174.2180583 +1    44    29    10
  F     1.32775887 +1  116.3339143 +1   32.1819676 +1    46    44    29
  F     1.32584830 +1  118.1014448 +1  163.1744453 +1    46    44    29
  F     1.34525483 +1  104.6381661 +1  -82.0148900 +1    46    44    29
  H     0.98968494 +1  120.6718615 +1  137.2901700 +1    17    10     2
  H     0.97580280 +1  122.9161098 +1  -93.5860577 +1    16    10     2
  H     1.00186985 +1  123.8995998 +1   29.6182536 +1    18    10     2
  C     1.54693259 +1  114.8290727 +1 -179.5200869 +1    38    11     9
  F     1.33621121 +1  109.1558468 +1   67.3330742 +1    53    38    11
  F     1.33148828 +1  113.6478294 +1  -48.5092446 +1    53    38    11
  F     1.32054095 +1  115.7893354 +1 -173.2452673 +1    53    38    11
  H     0.99358981 +1  149.0585345 +1   87.0618267 +1     6     1     2
  H     1.02916546 +1  140.0012159 +1 -150.6536445 +1     7     1     2
  H     0.99371218 +1  113.0722856 +1  142.1987454 +1    18    10     2
  H     0.98813642 +1  139.7927833 +1  -22.2102482 +1    17    10     2
  H     1.01974222 +1  137.1621616 +1   85.2313007 +1    16    10     2
  H     0.97827591 +1  109.8173460 +1  -65.1603046 +1     8     1     2