Accuracy
ch3sehr
4045 Methylselenium hydride (Geo)
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REF: J. H. Callomon, E. Hirota, K. Kuchitsu, W. J. Lafferty, A. G. Maki, C. S. Pote, "Structure Data on Free Polyatomic Molecules," Landolt-Bornstein, New Series, Group II, Vol. 7, Springer, Berlin (1976).
PM7
Methylselenium hydride
<C-Se> <C-H> <> <Se-H> GR=CHKL1976
Se 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.95900000 +1 0.0000000 +0 0.0000000 +0 1 0 0
H 1.08800000 +1 106.4603199 +1 0.0000000 +0 2 1 0
H 1.47300000 +1 95.5282330 +1 179.5686725 +1 1 2 3
XX 1.00000000 +0 132.6254600 +1 170.0513500 +1 2 1 3
H 1.08296037 +1 91.9404899 +1 124.5834225 +1 2 4 1
H 1.08292945 +1 91.5481791 +1 -125.2642948 +1 2 4 1