MMs00469558 MOE2007 2D CORINA 3.40 0006 02.08.2006 81 84 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 1.5000 0.0092 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 -1.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5159 -2.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2738 -3.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7738 -3.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5158 -2.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7579 -1.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4841 2.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2261 3.9108 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0261 3.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4682 5.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0318 5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7897 6.4905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2897 6.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0476 7.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5476 7.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2896 6.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5317 5.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0317 5.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7261 3.9200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4681 5.2236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7102 6.5180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9681 5.2328 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1681 5.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 3.9383 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3260 2.8991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 2.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 2.6256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 3.9475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9839 2.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2419 1.3495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4839 2.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2418 1.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7418 1.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4839 2.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7259 3.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2259 3.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7101 6.5364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9522 7.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4522 7.8216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6942 9.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1942 9.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9363 10.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1783 11.7416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6783 11.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9363 10.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0073 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3159 -2.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6802 -4.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -4.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -2.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3515 -0.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5601 3.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5696 1.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5933 5.6225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2526 6.3857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3354 6.9078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0053 7.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 8.8186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1539 8.8021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4896 6.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1253 4.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4254 4.1422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6482 0.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3482 0.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6838 2.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3195 5.0179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6196 5.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8006 8.1080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1362 10.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7719 12.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 12.7680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7363 10.4215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.3128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 1.3201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7419 1.3403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1483 0.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 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