PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
hcooch3r
1057 Methyl formate (Geo)
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REF: R. F. Curl, Jr. J. Chem. Phys., 30, 1529 (1959).
SYMMETRY PM7
Methyl formate
<C=O> <C-O> <O-C=O> <O-CH3> <C-O-C> GR=RFC1959
O 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.20000000 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.33400000 +1 125.9000000 +1 0.0000000 +0 2 1 0
C 1.43700000 +1 114.8000000 +1 0.0000000 +0 3 2 1
H 1.09703188 +1 126.8809432 +1 180.0000000 +0 2 1 3
H 1.09498827 +1 103.3116362 +1 180.0000000 +0 4 3 2
XX 1.00000000 +0 130.0104617 +1 0.0000000 +0 4 3 2
H 1.09442358 +1 55.4347538 +1 87.6495750 +1 4 7 3
H 1.09442358 +0 55.4347538 +0 -87.6495750 +0 4 7 3