PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
ch3clr
2334 Chloromethane (Geo)
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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).
SYMMETRY PM7
Chloromethane
GR=JANAF86 <C-Cl> <C-H> <H-C-Cl>
Cl 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.78120000 +1 0.0000000 +0 0.0000000 +0 1 0 0
H 1.09590000 +1 110.9000000 +1 0.0000000 +0 2 1 0
H 1.09590000 +1 110.9000000 +1 120.0000000 +0 2 1 3
H 1.09590000 +1 110.9000000 +1 -120.0000000 +0 2 1 3