PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

calcium sulfide   2777 Calcium sulfide

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    #  Species Formula
  2767 Nonactin-calcium (CAXHEO) (Geo)C40H64O12Ca
  2768 Ca(II)O10 (DUJJOH) (Geo)C16H32N2O12Ca
  2769 Ca(II)O10 (DUJJOH)C16H32N2O12Ca
  2770 Ca(II)O8 (CAARAB) (Geo)C10H20O14Ca
  2771 Calcium monofluoride (Geo)FCa
  2772 Calcium monofluorideFCa
  2773 Ca(++)(H2O)5.FH10O5FCa
  2774 Ca(++)(H2O)5.F (Geo)H10O5FCa
  2775 Calcium difluoride (Geo)F2Ca
  2776 Calcium difluorideF2Ca
  2777 Calcium sulfide SCa
  2778 Calcium sulfide (Geo)SCa
  2779 CaSO4.(H2O)2 (Geo)H4O6SCa
  2780 Ca(++)(H2S)2H4S2Ca
  2781 Ca(++)(H2S)2 (Geo)H4S2Ca
  2782 Ca(II)N6O (BUKZUC) (Geo)C22H18N6OS2Ca
  2783 Ca(II)N6O (BUKZUC)C22H18N6OS2Ca
  2784 Calcium monochloride (Geo)ClCa
  2785 Calcium monochlorideClCa
  2786 Calcium hydroxide fluorideHOClCa
  2787 Ca(++)(H2O)5.ClH10O5ClCa


ΔHf: 29.5 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 GEO-OK FIELD=(0.1,0.1,0.1) PM7
Calcium sulfide
 H=29.5 HR=NIST
 Ca     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.11421336 +1    0.0000000 +0    0.0000000 +0     1     0     0