Accuracy

Ho_(CAQFUV) r   6986 Holmium complex, CCDC: CAQFUV (Geo)

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    #  Species Formula
  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
  6988 Holmium complex, CCDC: LIZPAL (Geo)C10H18N2O11Ho
  6989 Holmium complex, CCDC: NUJBAV (Geo)C21H9N3O12Ho
  6990 Holmium complex, CCDC: XARVOB (Geo)C18H24N4O12Ho
  6991 Holmium complex, CCDC: XORGEQ (Geo)C21H23O16Ho
  6992 Holmium complex, CCDC: LEYJEE (Geo)C12H30N3O18Ho
  6993 Holmium complex, CCDC: SIFZIQ (Geo)C15H7O8F18Ho
  6994 Holmium complex, CCDC: BEYSAZ (Geo)H8O12S2Ho
  6995 Holmium complex, CCDC: GAKYIA (Geo)C14H26O12S2Ho
  6996 Holmium complex, CCDC: FAGYOC (Geo)C14H20N2O12S2Ho


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
Holmium complex, CCDC: CAQFUV
 <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     2.36510003 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.38978999 +1  125.8712898 +1    0.0000000 +0     1     2     0
  O     2.40617298 +1  116.8327243 +1  171.5220566 +1     1     2     3
  O     2.42750004 +1   66.9624989 +1  -95.3141460 +1     1     2     3
  O     2.14717323 +1  121.1177684 +1   -7.1285562 +1     5     1     2
  O     2.15138603 +1  129.7602062 +1   92.7360066 +1     4     1     2
  N     2.46079994 +1   93.7751282 +1   84.8289126 +1     1     2     3
  N     4.41531800 +1   32.7963119 +1   -5.5688871 +1     1     2     3
  N     3.58571611 +1   61.1536526 +1   35.9196198 +1     1     2     3
  C     1.34972008 +1   93.3993693 +1  148.2531203 +1    10     1     2
  C     1.40268068 +1  123.1821150 +1  141.6411875 +1    11    10     1
  H     1.09204144 +1  120.5602690 +1 -177.4465458 +1    12    11    10
  C     1.39496012 +1  118.1024512 +1    0.9293310 +1    12    11    10
  H     1.09311159 +1  120.0763962 +1 -178.9375892 +1    14    12    11
  C     1.39117643 +1  119.4722380 +1    0.5331822 +1    14    12    11
  H     1.09283481 +1  121.2718920 +1  179.6038701 +1    16    14    12
  C     1.34932143 +1  132.7388847 +1  -77.6343900 +1    10     1     2
  C     1.39491127 +1  104.2601794 +1  143.1599765 +1     9     1     2
  N     1.20768903 +1   33.3514785 +1 -178.2999564 +1     7     4     1
  N     1.29778072 +1  152.6731246 +1   -2.6553546 +1     5     1     2
  H     3.10647901 +1   81.0314396 +1  158.3198708 +1    19     9     1
  C     1.34917205 +1  142.3041009 +1  -73.5278276 +1     9     1     2
  C     1.42870765 +1  127.1557265 +1  -70.5192853 +1     8     1     2
  N     1.31353024 +1  156.3551446 +1   66.1148040 +1     3     1     2
  O     1.20269203 +1  117.5932659 +1  179.7118095 +1    25     3     1
  H     3.10535931 +1   81.7978466 +1 -174.7586978 +1    24     8     1
  C     1.38432166 +1  128.8421215 +1  115.6219573 +1     8     1     2
  O     1.21186813 +1  127.8832210 +1 -179.9782103 +1    20     7     4
  O     1.19872946 +1  119.6217769 +1  171.0177386 +1    21     5     1
  O     1.22264926 +1  115.4290440 +1   -0.3643107 +1    25     3     1
  N     1.36054848 +1  110.7844180 +1  157.9791408 +1    19     9     1
  N     1.34584101 +1  111.3607659 +1 -174.9226364 +1    24     8     1
  N     1.00683308 +1   16.9381797 +1   -1.4166256 +1    27    24     8
  N     1.00355280 +1   16.3680180 +1   -4.5542642 +1    22    19     9
  C     1.46184986 +1  128.9374839 +1   -5.0491030 +1    28     8     1
  H     1.11349436 +1  113.5675951 +1  -51.0789471 +1    36    28     8
  H     1.09916899 +1  114.3538601 +1 -173.4495848 +1    36    28     8
  H     1.11738973 +1  112.8047719 +1   64.8690763 +1    36    28     8
  C     1.46731566 +1  127.7405395 +1   36.9443581 +1    23     9     1
  H     1.10003922 +1  113.8002489 +1 -161.5771145 +1    40    23     9
  H     1.10618122 +1  111.7010290 +1   75.9094889 +1    40    23     9
  H     1.11520996 +1  111.1920512 +1  -41.2362809 +1    40    23     9
  H     1.00012834 +1  124.8228334 +1  -23.0115362 +1     2     1     3
  H     1.03016640 +1  115.7663956 +1  104.9192758 +1     2     1     3