MMs00943158 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 59 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 1.3031 -0.7429 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2639 -1.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3114 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6145 -2.9857 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6537 -3.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9094 -2.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 -0.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0972 -0.7000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3839 1.5571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 -0.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2933 -0.6715 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.0362 0.6316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5505 -1.9746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5965 -1.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8914 -0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8831 0.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1780 1.5999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4812 0.8570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4894 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1945 -1.4001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2027 -2.9001 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6228 -4.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5943 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1285 -2.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -3.3727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -3.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -2.0137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8217 0.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3643 0.9377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9624 0.9520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4197 0.9435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7329 -1.6378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2756 -1.6293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0177 0.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5604 0.9663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1038 -1.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9290 -1.6093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4717 -1.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2138 0.9864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7565 0.9948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8302 -2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3728 -2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8406 1.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1714 2.7998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5171 1.4627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5319 -1.2372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4228 -4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6293 -5.6856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8227 -4.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.7286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 58 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 58 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END