Accuracy

Sm_(XAGVOQ) r   6720 Samarium complex, CCDC: XAGVOQ (Geo)

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    #  Species Formula
  6710 Samarium complex, CCDC: KIWROX (Geo)C18H14N9O10Sm
  6711 Samarium complex, CCDC: NSMEDT01 (Geo)C10H18N2O11Sm
  6712 Samarium complex, CCDC: QALFAK (Geo)H6N3O12Sm
  6713 Samarium complex, CCDC: MOXJEO (Geo)C30H57N6O12Sm
  6714 Samarium complex, CCDC: JIZVOD (Geo)C15H11N7O12Sm
  6715 Samarium complex, CCDC: FUHQOO (Geo)C12H12O15Sm
  6716 Samarium complex, CCDC: XOWGAR (Geo)C38H30N11O25Sm
  6717 Samarium complex, CCDC: FINDOV (Geo)C30H27N3O3F15Sm
  6718 Samarium complex, CCDC: XIVFIR (Geo)C27H19N3O7F18Sm
  6719 Samarium complex, CCDC: WOCNIL (Geo)C31H35N3OF15Si3Sm
  6720 Samarium complex, CCDC: XAGVOQ (Geo) C20H58N3O2Si6Sm
  6721 Samarium complex, CCDC: XILGOO (Geo)C29H46N6O7F3SSm
  6722 Samarium complex, CCDC: GUPHUU (Geo)C12H20N4O4S4Sm
  6723 Samarium complex, CCDC: XOGYOH (Geo)C32H16O8F12S4Sm
  6724 Samarium complex, CCDC: HAWMUN (Geo)C19H24N4O4S3ClSm
  6725 Samarium complex, CCDC: ADELAW (Geo)C27H24N4O3Cl3Sm
  6726 Samarium complex, CCDC: DOXFUR (Geo)C20H40O5I2Sm
  6727 Samarium complex, CCDC: WIGVOX (Geo)C40H62N20O2Sm2
  6728 Samarium complex, CCDC: HAPMEQ (Geo)C54H54N8O6Sm2
  6729 Samarium complex, CCDC: MEWGOK (Geo)C56H42N4O12Sm2
  6730 Samarium complex, CCDC: LIXDUR (Geo)C66H46N4O12Sm2


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
Samarium complex, CCDC: XAGVOQ
 <Sm-N2> <Sm-N3> <> <Sm-N4> <> <> <Sm-O5> <> <> <Sm-O6> GR=CCDC
 Sm     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     2.30095388 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     2.32718113 +1  114.1175659 +1    0.0000000 +0     1     2     0
  N     2.33080667 +1  117.5538405 +1  178.1849494 +1     1     2     3
  O     2.48640014 +1   94.4836052 +1  -89.6070240 +1     1     2     3
  O     2.47200027 +1   92.0895238 +1   92.5572713 +1     1     2     3
 Si     1.83728886 +1  127.1479228 +1 -170.2784900 +1     4     1     2
 Si     1.83947828 +1  126.7086101 +1    6.9931424 +1     4     1     2
 Si     1.83922873 +1  126.2550136 +1  -62.2528690 +1     2     1     3
 Si     1.83697392 +1  127.0236275 +1  116.9489727 +1     2     1     3
 Si     1.84190882 +1  126.4938304 +1   -4.5995033 +1     3     1     2
 Si     1.83675996 +1  127.5096362 +1  176.3306240 +1     3     1     2
  C     1.87994946 +1  118.5200230 +1 -127.5123918 +1     7     4     1
  C     1.88293766 +1  114.8494968 +1  102.4084984 +1     7     4     1
  C     1.88251881 +1  115.4393981 +1  108.9510729 +1     8     4     1
  C     1.88045877 +1  117.9344930 +1 -121.1676972 +1     8     4     1
  C     1.87780078 +1  117.1925026 +1  117.3983604 +1     9     2     1
  C     1.88220496 +1  115.8183381 +1 -112.2385566 +1     9     2     1
  C     1.88157577 +1  115.7046637 +1 -110.1633279 +1    10     2     1
  C     1.87831658 +1  117.3784115 +1  119.3258675 +1    10     2     1
  C     1.88016937 +1  118.7821298 +1 -128.3118361 +1    11     3     1
  C     1.88154498 +1  114.2140026 +1  101.7905023 +1    11     3     1
  C     1.88291954 +1  113.8551051 +1  100.5197740 +1    12     3     1
  C     1.87976024 +1  119.0400097 +1 -129.5623078 +1    12     3     1
  C     1.45164979 +1  126.0709016 +1 -103.0293017 +1     5     1     2
  C     1.52502190 +1  108.1554681 +1 -171.9031299 +1    25     5     1
  C     1.53450631 +1  103.9658799 +1  -21.6788549 +1    26    25     5
  C     1.45362875 +1  124.9258296 +1   76.5930405 +1     5     1     2
  C     1.44961910 +1  127.0259050 +1 -109.4515274 +1     6     1     2
  C     1.52617668 +1  107.0981274 +1  150.7280646 +1    29     6     1
  C     1.53780992 +1  104.9765094 +1   20.1905566 +1    30    29     6
  C     1.45285251 +1  125.7838643 +1   70.2484505 +1     6     1     2
  H     1.46249732 +1  102.5428533 +1  -11.4670991 +1     7     4     1
  H     1.46263806 +1  102.4787921 +1   -5.4611685 +1     8     4     1
  H     1.46289138 +1  102.0791918 +1    2.1888523 +1     9     2     1
  H     1.46284831 +1  101.9901153 +1    4.2040489 +1    10     2     1
  H     1.46321643 +1  102.6044777 +1  -11.9850021 +1    11     3     1
  H     1.46258956 +1  102.6940584 +1  -13.0714323 +1    12     3     1
  H     1.10250748 +1  111.8653390 +1   39.8473108 +1    13     7     4
  H     1.10300547 +1  111.9498157 +1  -81.2953532 +1    13     7     4
  H     1.10374773 +1  110.9036603 +1  159.6199762 +1    13     7     4
  H     1.10174977 +1  111.4257726 +1  -41.3594037 +1    14     7     4
  H     1.10277096 +1  111.2944500 +1 -161.4074634 +1    14     7     4
  H     1.10217569 +1  111.6977444 +1   79.0881001 +1    14     7     4
  H     1.10093039 +1  111.7106695 +1  -40.8908790 +1    15     8     4
  H     1.10333823 +1  111.0950402 +1 -161.0230022 +1    15     8     4
  H     1.10227521 +1  111.7186084 +1   79.6258916 +1    15     8     4
  H     1.10223562 +1  111.8478761 +1   39.3006437 +1    16     8     4
  H     1.10300337 +1  111.8339082 +1  -81.6124025 +1    16     8     4
  H     1.10373608 +1  111.0417177 +1  159.2449453 +1    16     8     4
  H     1.10514110 +1  110.9994450 +1  -39.1966894 +1    17     9     2
  H     1.10281128 +1  111.3106140 +1 -158.8549588 +1    17     9     2
  H     1.10212887 +1  112.0575477 +1   81.2972440 +1    17     9     2
  H     1.10299141 +1  111.1914389 +1   34.4283742 +1    18     9     2
  H     1.10280883 +1  111.6384569 +1  -85.5300269 +1    18     9     2
  H     1.10159227 +1  111.6274611 +1  154.9124552 +1    18     9     2
  H     1.10271880 +1  111.6455889 +1  -84.7168876 +1    19    10     2
  H     1.10160006 +1  111.6054756 +1  155.6832186 +1    19    10     2
  H     1.10328624 +1  111.2211106 +1   35.2059857 +1    19    10     2
  H     1.10210364 +1  112.0917638 +1   80.2505202 +1    20    10     2
  H     1.10480004 +1  111.0105246 +1  -40.2559013 +1    20    10     2
  H     1.10269198 +1  111.3369822 +1 -160.0233101 +1    20    10     2
  H     1.10220343 +1  112.0478867 +1   41.9149673 +1    21    11     3
  H     1.10322031 +1  111.9573966 +1  -79.2431146 +1    21    11     3
  H     1.10409734 +1  110.8358952 +1  161.7406394 +1    21    11     3
  H     1.10210317 +1  111.4346332 +1  -45.6925159 +1    22    11     3
  H     1.10340692 +1  111.1286789 +1 -165.3331696 +1    22    11     3
  H     1.10178174 +1  111.7586886 +1   74.9743668 +1    22    11     3
  H     1.10224597 +1  111.1976300 +1  -40.9442424 +1    23    12     3
  H     1.10248858 +1  111.5271691 +1 -161.0047237 +1    23    12     3
  H     1.10208511 +1  111.5937446 +1   79.3004416 +1    23    12     3
  H     1.10236278 +1  112.0564950 +1   42.7344458 +1    24    12     3
  H     1.10327479 +1  112.0446545 +1  -78.5280394 +1    24    12     3
  H     1.10389659 +1  110.8024866 +1  162.4993318 +1    24    12     3
  H     1.10246716 +1  104.6062317 +1  -50.6133613 +1    25     5     1
  H     1.10390065 +1  105.0702107 +1   67.2637084 +1    25     5     1
  H     1.10431075 +1  111.6678024 +1   98.1891654 +1    26    25     5
  H     1.10189974 +1  112.1996056 +1 -142.9512634 +1    26    25     5
  H     1.10518898 +1  111.1044998 +1  -94.3852018 +1    27    26    25
  H     1.10182445 +1  112.0467748 +1  147.1732195 +1    27    26    25
  H     1.10396184 +1  104.6951439 +1   68.2552720 +1    28     5     1
  H     1.10220572 +1  104.9794870 +1  -49.6126286 +1    28     5     1
  H     1.10197572 +1  104.7385894 +1   29.6849523 +1    29     6     1
  H     1.10260621 +1  105.9158399 +1  -87.9417563 +1    29     6     1
  H     1.10144884 +1  111.8756290 +1  141.6376663 +1    30    29     6
  H     1.10537816 +1  111.4578666 +1  -99.8318917 +1    30    29     6
  H     1.10475267 +1  110.9443109 +1 -125.1599840 +1    31    30    29
  H     1.10202563 +1  111.6928725 +1  116.9332355 +1    31    30    29
  H     1.10266632 +1  105.7537389 +1   85.0698619 +1    32     6     1
  H     1.10177090 +1  104.7322925 +1  -32.4217796 +1    32     6     1