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SHIFT=80 RELSCF=0.1 PM7 Gold(III) trifluoride <Au-F> <> <> <Au-F'> <F-Au-F'> GR=PW91D Au 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 F 2.01030800 +1 0.0000000 +0 0.0000000 +0 1 0 0 F 1.48618978 +1 177.5048101 +1 180.0000000 +0 1 2 0 F 2.02091200 +1 94.9950620 +1 179.9986619 +1 1 2 3