PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
sb2br4
5721 Sb2Br4
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ΔHf: -54.5 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
Sb2Br4
H=-54.5 HR=PW91D
Sb 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Sb 2.94138531 +1 0.0000000 +0 0.0000000 +0 1 0 0
Br 2.48520378 +1 93.4132311 +1 0.0000000 +0 2 1 0
Br 2.48982255 +1 93.7688988 +1 101.8339712 +1 2 1 3
Br 2.48525356 +1 93.4114546 +1 -51.7823573 +1 1 2 3
Br 2.48997234 +1 93.7365778 +1 101.8452174 +1 1 2 5