Accuracy

Ho_(XAWVOG) r   6977 Holmium complex, CCDC: XAWVOG (Geo)

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    #  Species Formula
  6967 Dysprosium complex, CCDC: GAKYEW (Geo)C14H26O12S2Dy
  6968 Dysprosium complex, CCDC: DIDBOH (Geo)C24H38O14Dy2
  6969 Dysprosium complex, CCDC: QQQEMM01 (Geo)C12H26O16Dy2
  6970 Dysprosium complex, CCDC: AMAQDY (Geo)C42H44N6O16Dy2
  6971 Dysprosium complex, CCDC: DASFOS (Geo)C12H12O18F18Dy2
  6972 Dysprosium complex, CCDC: BACDAK (Geo)C42H34O20Cl12Dy2
  6973 Holmium complex, CCDC: XEQMEL (Geo)C27H27N4O3Ho
  6974 Holmium complex, CCDC: XEWVIE (Geo)C10H20N2O6Ho
  6975 Holmium complex, CCDC: ECOJEL (Geo)C41H56N7O6Ho
  6976 Holmium complex, CCDC: PHPRHO10 (Geo)C45H35O7Ho
  6977 Holmium complex, CCDC: XAWVOG (Geo) C15H15N5O8Ho
  6978 Holmium complex, CCDC: BAGBAN (Geo)C20H18N5O8Ho
  6979 Holmium complex, CCDC: BUVXOF01 (Geo)H18O9Ho
  6980 Holmium complex, CCDC: HOESUL02 (Geo)H18O9Ho
  6981 Holmium complex, CCDC: GINREA (Geo)C8H26O9Ho
  6982 Holmium complex, CCDC: KITGOJ (Geo)C8H26O9Ho
  6983 Holmium complex, CCDC: HANCII (Geo)C10H28O9Ho
  6984 Holmium complex, CCDC: GODKOZ (Geo)C16H26N4O9Ho
  6985 Holmium complex, CCDC: QOZVOQ (Geo)C12H26NO10Ho
  6986 Holmium complex, CCDC: CAQFUV (Geo)C11H13N10O10Ho
  6987 Holmium complex, CCDC: CUSYUK (Geo)C10H18N2O11Ho


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=1.0
Holmium complex, CCDC: XAWVOG
 <Ho-O2> <Ho-O3> <> <Ho-O4> <> <> <Ho-O5> <> <> <> <> <> <> <> <> <Ho-N8> GR=CCDC
 Ho     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.31379998 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.32910005 +1  101.7006061 +1    0.0000000 +0     1     2     0
  O     2.41775071 +1   67.8064719 +1 -124.4348807 +1     1     2     3
  O     2.42137284 +1  107.5214187 +1   60.7338728 +1     1     2     3
  O     2.15125637 +1  131.9672404 +1   72.2696554 +1     5     1     2
  O     2.15884523 +1  115.9243683 +1    0.2931674 +1     4     1     2
  N     2.49850000 +1  131.8515616 +1 -171.8936002 +1     1     2     3
  N     3.16616827 +1  133.3198521 +1  -83.5983525 +1     1     2     3
  N     3.19404622 +1   93.9404924 +1  132.2598985 +1     1     2     3
  C     1.38459338 +1  121.3196731 +1  102.0895487 +1     8     1     2
  C     1.39836490 +1  122.9105284 +1 -140.0862976 +1    11     8     1
  C     1.39185358 +1  119.8923251 +1   -8.3262134 +1    12    11     8
  C     1.39035909 +1  117.6268596 +1   -5.3014842 +1    13    12    11
  C     1.38243404 +1  121.2858655 +1  -54.8221219 +1     8     1     2
  C     1.35336065 +1  105.0850183 +1 -119.1008584 +1     9     1     2
  C     1.40071388 +1  121.9034875 +1 -165.5257268 +1    16     9     1
  C     1.39696719 +1  118.8552615 +1   -2.8019983 +1    17    16     9
  C     1.39078748 +1  119.2516696 +1    0.2196170 +1    18    17    16
  C     1.34582893 +1  134.8345154 +1   74.6214262 +1     9     1     2
  C     1.35483794 +1  101.5160629 +1  146.2021951 +1    10     1     2
  C     1.39489427 +1  122.7451403 +1  148.9156182 +1    21    10     1
  C     1.40072840 +1  118.3012566 +1    0.7524941 +1    22    21    10
  C     1.38804863 +1  119.3479701 +1    0.3332113 +1    23    22    21
  C     1.34445521 +1  130.5113379 +1  -69.1568879 +1    10     1     2
  N     1.33458830 +1  162.3531423 +1   77.8622942 +1     5     1     2
  N     1.27728641 +1   33.0232639 +1 -176.3441173 +1     7     4     1
  O     1.18910335 +1  124.3059145 +1  179.0254742 +1    27     7     4
  O     1.20321684 +1  115.1766399 +1  173.0818290 +1    26     5     1
  H     1.09434433 +1  120.2629582 +1  170.9776048 +1    12    11     8
  H     1.09655708 +1  121.1048139 +1  176.7071611 +1    13    12    11
  H     1.09462516 +1  120.4273308 +1 -173.6145622 +1    14    13    12
  H     1.09142900 +1  121.3118348 +1  176.5706887 +1    17    16     9
  H     1.09635453 +1  120.0877999 +1 -179.6897269 +1    18    17    16
  H     1.09231352 +1  121.0751523 +1 -178.8608238 +1    19    18    17
  H     1.09781813 +1  115.9712429 +1  -16.6583691 +1    20     9     1
  H     1.08952538 +1  121.4117818 +1 -178.3923685 +1    22    21    10
  H     1.09530021 +1  119.9295296 +1 -179.4428334 +1    23    22    21
  H     1.09268150 +1  121.2514969 +1 -179.7516666 +1    24    23    22
  H     1.10010360 +1  116.1386783 +1   39.5329961 +1    25    10     1
  H     1.18352831 +1  114.3692828 +1  124.1763410 +1     2     1     3
  H     0.95234788 +1  142.1624731 +1  -60.9266045 +1     2     1     3
  H     0.96469272 +1  149.2200090 +1  -71.6023542 +1     3     1     2
  H     1.05960614 +1  105.0318980 +1  104.5789899 +1     3     1     2