MMs00030944 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 81 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2878 -2.2565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3102 -2.2435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3177 -3.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6205 -4.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9158 -3.7305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9083 -2.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6055 -1.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2185 -4.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5138 -3.7175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -5.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5288 -6.7175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5288 -5.5175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8241 -5.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1268 -6.7045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2365 -5.6953 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6196 -4.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -4.4923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 10.1030 -11.7488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5587 -12.7174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2335 -7.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1349 -3.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9129 -4.8731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8537 -5.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3964 -5.4024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0911 -2.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3131 -1.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8296 -0.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3723 -0.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0432 -5.7715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8212 -7.1037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7579 -1.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6501 -0.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9885 1.9192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6884 1.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7118 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