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SYMMETRY PM7 Scandium tribromide H=-134.03 HR=PW91D Br 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Sc 2.35100058 +1 0.0000000 +0 0.0000000 +0 1 0 0 Br 2.35100058 +1 120.0000000 +1 0.0000000 +0 2 1 0 Br 2.35100058 +1 120.0000000 +1 180.0000000 +1 2 1 3 2 1 3 4