PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
brfo3r
4148 Perbromyl fluoride (Geo)
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REF: J. H. Callomon, E. Hirota, T. Iijima, K. Kuchitsu, W. J. Lafferty, "Structure Data on Free Polyatomic Molecules," Landolt-Bornstein, New Series, Group II, Vol. 15, Springer, Berlin (1977).
SYMMETRY PM7
Perbromyl fluoride
GR=CHIK1986 <Br-F> <Br=O> <F-Br=O> GWT=0.1
F 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Br 1.70800000 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.58200000 +1 103.3000000 +1 0.0000000 +0 2 1 0
O 1.58200000 +1 103.3000000 +1 120.0000000 +1 2 1 3
O 1.58200000 +1 103.3000000 +1 -120.0000000 +1 2 1 3