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UHF SHIFT=80 RELSCF=100 PULAY PM7 Dimethyl rhenium fluoride <Re-C> <><> <Re-F><C-Re-F> GR=PW91D Re 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 C 2.04523000 +1 0.0000000 +0 0.0000000 +0 1 0 0 C 2.10134760 +1 116.6210332 +1 0.0000000 +0 1 2 0 F 1.90655700 +1 130.4940090 +1 -164.8627287 +1 1 2 3 H 1.08976280 +1 111.2125079 +1 -172.5036887 +1 2 1 3 H 1.09137886 +1 108.1818565 +1 120.6932198 +1 2 1 5 H 1.09228784 +1 110.1741181 +1 118.8410329 +1 2 1 6 H 1.09008450 +1 105.7169850 +1 171.3100795 +1 3 1 2 H 1.08644542 +1 111.8383829 +1 118.7229880 +1 3 1 8 H 1.08565239 +1 110.8529194 +1 122.3049706 +1 3 1 9