Accuracy

caclr   2783 Calcium monochloride (Geo)

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    #  Species Formula
  2773 Ca(++)(H2O)5.F (Geo)H10O5FCa
  2774 Calcium difluoride (Geo)F2Ca
  2775 Calcium difluorideF2Ca
  2776 Calcium sulfideSCa
  2777 Calcium sulfide (Geo)SCa
  2778 CaSO4.(H2O)2 (Geo)H4O6SCa
  2779 Ca(++)(H2S)2H4S2Ca
  2780 Ca(++)(H2S)2 (Geo)H4S2Ca
  2781 Ca(II)N6O (BUKZUC) (Geo)C22H18N6OS2Ca
  2782 Ca(II)N6O (BUKZUC)C22H18N6OS2Ca
  2783 Calcium monochloride (Geo) ClCa
  2784 Calcium monochlorideClCa
  2785 Calcium hydroxide fluorideHOClCa
  2786 Ca(++)(H2O)5.ClH10O5ClCa
  2787 Ca(++)(H2O)5.Cl (Geo)H10O5ClCa
  2788 Calcium dichloride (Geo)Cl2Ca
  2789 Calcium dichlorideCl2Ca
  2790 Ca(II)Cl4O2(2-) (DILXOL) (Geo)H4O2Cl4Ca
  2791 Ca(II)Cl4O2(2-) (DILXOL)H4O2Cl4Ca
  2792 Ca(II)2O12Cl2(2+) (NADQEP) (Geo)C12H28O14Cl2Ca2
  2793 Ca(II)2O12Cl2(2+) (NADQEP)C12H28O14Cl2Ca2


REF: K. Moller, H.-U. Schutze-Pahlmann, J. Hoeft, T. Torring, Chem. Phys., 68, 399 (1982).
  
 GEO-OK UHF PM7
Calcium monochloride
 <Ca-Cl> GR=MSPH1982
 Ca     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.43678700 +1    0.0000000 +0    0.0000000 +0     1     0     0