MMs01387744 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 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 1.4941 0.1327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8941 -0.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3561 -1.0949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8502 -0.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4824 0.3981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6204 1.6257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5215 2.8248 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9404 2.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9162 0.8386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 0.0677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1788 -1.4321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 0.7966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5434 0.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5382 2.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2514 3.0673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8491 3.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1117 0.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3985 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7094 0.7128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7337 2.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4469 2.9835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9962 -0.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9720 -1.5579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2588 -2.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5698 -1.5998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5940 -0.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3072 0.6709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8565 -2.3707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1675 -1.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1263 1.4930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1062 1.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1953 -0.1062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1062 -1.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2692 -1.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6682 -2.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7472 -2.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0097 -1.2712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0927 3.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6352 3.9321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6831 -0.3662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9335 0.9821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6124 -0.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1549 -0.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9119 1.9852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1622 3.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2330 3.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6905 3.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9232 -2.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2394 -3.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6427 0.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3265 1.8707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7506 -2.6905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2163 -1.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5843 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9667 1.8021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2293 2.6886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1359 2.2545 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.1359 3.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END