Accuracy

ca(ii)o8 (gebpae) r   2762 Ca(II)O8 (GEBPAE) (Geo)

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    #  Species Formula
  2752 Ca(++)(H2O)5.OH (Geo)H11O6Ca
  2753 Ca(II)(H2O)6(2+) (BIHNIQ) (Geo)H12O6Ca
  2754 Ca(II)(H2O)6(2+) (BIHNIQ)H12O6Ca
  2755 Ca(II)O6 (BOLTIF) (Geo)C10H18O6Ca
  2756 Ca(II)O6 (BOLTIF)C10H18O6Ca
  2757 Ca(II)O7N2(2+) (CACRPB) (Geo)C18H38N2O7Ca
  2758 Ca(++)(Edta) (Geo)C10H12N2O8Ca
  2759 Ca(++)(Edta)C10H12N2O8Ca
  2760 Ca(II)O6N2 (LINYAI) (Geo)C10H14N4O8Ca
  2761 Ca(II)O6N2 (LINYAI)C10H14N4O8Ca
  2762 Ca(II)O8 (GEBPAE) (Geo) C4H12N2O10Ca
  2763 Ca(II)O8 (GEBPAE)C4H12N2O10Ca
  2764 Calcium hydrogen trisoxalate (Geo)C6H3O12Ca
  2765 Calcium hydrogen trisoxalateC6H3O12Ca
  2766 Nonactin-calcium (CAXHEO) (Geo)C40H64O12Ca
  2767 Ca(II)O10 (DUJJOH) (Geo)C16H32N2O12Ca
  2768 Ca(II)O10 (DUJJOH)C16H32N2O12Ca
  2769 Ca(II)O8 (CAARAB) (Geo)C10H20O14Ca
  2770 Calcium monofluoride (Geo)FCa
  2771 Calcium monofluorideFCa
  2772 Ca(++)(H2O)5.FH10O5FCa


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7
Ca(II)O8 (GEBPAE)
 <Ca-O> <Ca-O><O-Ca-O> GR=CCDC
 Ca     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.44177900 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.50700000 +1  104.1947430 +1    0.0000000 +0     1     2     0
  O     2.10459797 +1   74.3844116 +1   62.6243037 +1     1     2     3
  N     2.24018040 +1  145.5370489 +1   28.1514438 +1     4     1     2
  C     1.24136079 +1  107.4669517 +1  -86.9024723 +1     2     1     3
  C     1.23828443 +1  114.4463286 +1   -9.7431317 +1     4     1     5
  O     2.52685750 +1   62.9255772 +1 -110.7584197 +1     1     2     4
  H     1.00672959 +1  148.8829708 +1  -13.2701878 +1     5     4     1
  H     0.99915008 +1   93.1816600 +1  172.5122820 +1     5     4     9
  H     0.97566508 +1  106.4833172 +1   -1.3363206 +1     8     1     2
  H     0.97188595 +1  106.6366336 +1 -110.9753042 +1     8     1    11
  H     0.97092562 +1  112.3160574 +1  -49.4982797 +1     3     1     2
  H     0.96741669 +1  109.8804144 +1  115.6515798 +1     3     1    13
  O     2.09750500 +1  102.2317057 +1  -56.8690055 +1     1     2     8
  O     2.14550939 +1  164.4321028 +1  -93.0174397 +1     1     2    15
  O     2.49298984 +1   63.2806456 +1   34.0492640 +1     1     2    16
  O     2.38442166 +1   94.3391291 +1  -58.9196074 +1     1     2    17
  C     1.25124356 +1  116.3892208 +1 -170.2298961 +1    15     1     2
  C     1.23704178 +1  110.1472760 +1  104.2004783 +1    16     1     2
  H     0.97186641 +1  108.1200598 +1  109.8627257 +1    17     1     2
  H     0.98060209 +1  106.9882913 +1 -111.1255214 +1    17     1    21
  H     0.97319410 +1  116.1109940 +1   62.9620649 +1    18     1     2
  H     0.96937662 +1  114.9472532 +1  121.8501192 +1    18     1    23
  O     1.21234812 +1  130.8557308 +1 -177.6470461 +1    19    15     1
  N     1.35489074 +1  120.5408986 +1  172.2075865 +1    20    16     1
  H     1.00661747 +1  120.3230698 +1  179.1894421 +1    26    20    16
  H     0.99962505 +1  122.0627969 +1  178.3879319 +1    26    20    27
  O     1.21588208 +1  131.7382641 +1 -156.8885560 +1     6     2     1