PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
sepf2hr
4078 Difluorophosphine selenide (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).
PM7
Difluorophosphine selenide
<P=Se> <P-F> <Se=P-F> <P-H> <Se=P-H> <> <> <F-P-F> GR=CHIK1986
Se 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
P 2.02600000 +1 0.0000000 +0 0.0000000 +0 1 0 0
F 1.55700000 +1 116.8000000 +1 0.0000000 +0 2 1 0
H 1.42200000 +1 118.6000000 +1 -121.4422174 +1 2 1 3
F 1.56449352 +1 98.1000000 +1 102.6116718 +1 2 3 4