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SYMMETRY PM7 Ketene GR=CTS1959 <C-O> <C-C> <C-H> <H-C-C> O 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 C 1.16100000 +1 0.0000000 +0 0.0000000 +0 1 0 0 C 1.31400000 +1 180.0000000 +0 0.0000000 +0 2 1 0 H 1.08300000 +1 118.7000000 +1 90.0000000 +1 3 2 1 H 1.08300000 +1 118.7000000 +1 180.0000000 +1 3 2 4