PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
gallium trichloride, dimer
3852 Gallium trichloride, dimer
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ΔHf: -233.1 kcal/mol, REF: D. D. Wagman, W. H. Evans, V. B. Parker, R. H. Schumm, I. Halow, S. M. Bailey, K. L. Churney, R. L. Nuttall, J. Phys. Chem. Ref. Data Suppl. 11, 2 (1982).
SYMMETRY PM7
Gallium trichloride, dimer
H=-233.1 HR=WEPS1982
XX 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Ga 1.60339416 +1 0.0000000 +0 0.0000000 +0 1 0 0
Ga 1.60339416 +0 180.0000000 +0 0.0000000 +0 1 2 0
Cl 1.58362676 +1 90.0000000 +0 0.0000000 +0 1 2 3
Cl 1.58362676 +0 90.0000000 +0 180.0000000 +0 1 2 3
Cl 2.08749579 +1 116.3741397 +1 90.0000000 +0 2 1 4
Cl 2.08749579 +0 116.3741397 +0 -90.0000000 +0 2 1 4
Cl 2.08749579 +0 116.3741397 +0 90.0000000 +0 3 1 4
Cl 2.08749579 +0 116.3741397 +0 -90.0000000 +0 3 1 4