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PULAY SHIFT=80 SYMMETRY PM7 Molybdenum hexacarbonyl <Mo-C> GR=HIKL1992 Mo 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 C 2.06300000 +1 0.0000000 +0 0.0000000 +0 1 0 0 C 2.06300000 +0 90.0000000 +0 0.0000000 +0 1 2 0 C 2.06300000 +0 90.0000000 +0 180.0000000 +0 1 2 3 C 2.06300000 +0 180.0000000 +0 0.0000000 +0 1 2 3 C 2.06300000 +0 90.0000000 +0 90.0000000 +0 1 2 3 C 2.06300000 +0 90.0000000 +0 -90.0000000 +0 1 2 3 O 1.15801742 +1 180.0000000 +0 0.0000000 +0 2 1 3 O 1.15801742 +0 180.0000000 +0 0.0000000 +0 4 1 2 O 1.15801742 +0 180.0000000 +0 0.0000000 +0 5 1 3 O 1.15801742 +0 180.0000000 +0 0.0000000 +0 6 1 3 O 1.15801742 +0 180.0000000 +0 0.0000000 +0 7 1 3 O 1.15801742 +0 180.0000000 +0 0.0000000 +0 3 1 2 2 1 3 4 5 6 7 8 1 9 10 11 12 13