PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
barium dibromide
6360 Barium dibromide
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ΔHf: -101.5 kcal/mol, REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
FIELD=(0.01,0.02,0.03) PM7
Barium dibromide
H=-101.5 HR=JANAF86
Br 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Ba 2.83624214 +1 0.0000000 +0 0.0000000 +0 1 0 0
Br 2.83268262 +1 173.2765165 +1 0.0000000 +0 2 1 0