PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
sb2f4
5713 Sb2F4
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ΔHf: -224.0 kcal/mol, REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
PM7
Sb2F4
H=-224.0 HR=PW91D
Sb 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Sb 3.04926200 +1 0.0000000 +0 0.0000000 +0 1 0 0
F 1.95113030 +1 87.3553502 +1 0.0000000 +0 2 1 0
F 1.95237534 +1 86.6498211 +1 95.4374349 +1 2 1 3
F 1.95118392 +1 87.3603810 +1 79.5814844 +1 1 2 3
F 1.95239128 +1 86.6493234 +1 95.4223230 +1 1 2 5