PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
b3o3h2cl
2395 B3O3H2Cl
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ΔHf: -313.8 kcal/mol, REF: M. D. Harmony, V. W. Laurie, R. L. Kuczkowsky, R. H. Schwendeman, D. A. Ramsay, F. J. Lovas, W. J. Lafferty, A. G. Maki, J. Phys. Chem. Ref. Data 8, 3 (1979).
PM7
B3O3H2Cl
H=-313.8 HR=HLKS1979
B 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
O 1.40253079 +1 0.0000000 +0 0.0000000 +0 1 0 0
B 1.39753438 +1 120.2934715 +1 0.0000000 +0 2 1 0
O 1.39816287 +1 120.0098735 +1 -0.0026928 +1 3 2 1
B 1.40263122 +1 120.3865352 +1 -0.0066531 +1 4 3 2
O 1.39652007 +1 118.7922938 +1 -0.0230809 +1 5 4 3
H 1.17472573 +1 120.6926823 +1 -179.9813834 +1 1 6 5
H 1.17487909 +1 120.9215204 +1 179.9944807 +1 5 6 1
Cl 1.70935008 +1 120.1522335 +1 -179.9859552 +1 3 2 1