MMs03927048 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 82 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 1.3792 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5795 0.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5863 1.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1361 3.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4721 3.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8406 5.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3895 5.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8274 3.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6717 2.9077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7018 1.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1695 3.7210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4052 2.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6557 1.1467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6602 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3250 -0.9313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8577 -1.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 -2.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0575 -2.7177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4698 -1.3497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5191 -0.3729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3502 0.8151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1171 -1.4383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9987 -0.0984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8779 1.0759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 -4.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8274 -3.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 -4.7834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9589 -2.2877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0338 0.6132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0730 1.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8575 2.1251 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8575 3.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9474 3.1557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3380 -0.1277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6318 0.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9360 -0.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9465 -1.6095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2298 0.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5341 -0.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2638 6.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9068 6.3563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4566 7.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 2.7682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4718 1.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1034 0.4718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4718 -1.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -1.4104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2787 4.4362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9717 4.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3361 -2.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2795 -3.4447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7444 -5.0768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3765 -4.6119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9926 -1.6781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6644 -3.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7719 2.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8193 3.9802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1229 4.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5731 -1.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1158 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8541 1.5452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3967 1.5559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9413 -1.1349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5774 -0.6842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1268 0.9519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2389 5.7410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9632 7.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2887 7.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 6.1789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6434 7.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7096 8.6911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1203 3.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4385 3.4954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6659 1.8137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 49 1 0 0 0 0 2 50 1 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 26 2 0 0 0 0 6 7 2 0 0 0 0 6 51 1 0 0 0 0 7 8 1 0 0 0 0 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