MMs01559634 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 1.2951 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2873 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5824 -3.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5745 -4.5135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 -2.2703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9214 -2.8758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0272 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -0.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 1.4592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 -0.7975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0543 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3922 -1.2543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 1.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6873 -0.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2853 -0.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8833 -0.8383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8755 -2.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5726 -3.0814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2775 -2.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2449 -2.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 -1.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2577 -1.7072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0829 -1.9975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6000 1.4394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4063 2.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 1.4519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9111 -1.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4538 -1.7344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2237 0.8554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7663 0.8473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5945 1.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9257 -0.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9116 -2.9437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5663 -4.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2351 -2.9192 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 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END