MMs00080684 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -0.0872 -1.4975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0731 -2.4482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5275 -3.8454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -3.7583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3499 -2.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7471 -1.7615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9183 -2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3155 -2.1531 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3547 -1.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4866 -3.0903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2606 -4.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4317 -5.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8290 -4.9648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 -3.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8839 -2.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5416 -0.6702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4647 -5.0166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9476 -4.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -5.9616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4932 -3.3932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -2.2221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1016 -0.8248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -3.1671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9191 -6.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0697 1.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 0.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -0.5752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0172 -3.4912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5422 -3.7238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1428 -5.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2508 -6.6967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7659 -5.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1728 -3.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0648 -1.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6047 0.0795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1569 -4.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1623 -2.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7952 -1.9808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1987 -5.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4826 -7.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0369 -6.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END