PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
chclf2r
2421 Chlorodifluoromethane (Geo)
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REF: S. S. Chen, A. C. Wilhoit, B. J. Zwolinski, J. Phys. Chem. Ref. Data 5, 571 (1975).
PM7
Chlorodifluoromethane
GR=CWZ1975 <C-H> <C-Cl> <Cl-C-H> <C-F> <F-C-Cl> <F-C-Cl-H>
H 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.09000000 +1 0.0000000 +0 0.0000000 +0 1 0 0
Cl 1.74000000 +1 107.0000000 +1 0.0000000 +0 2 1 0
F 1.35000000 +1 110.5000000 +1 120.0000000 +1 2 3 1
F 1.33235912 +1 108.7416336 +1 -126.7451071 +1 2 3 1