MMs01694250 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 -0.7492 -1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2492 -1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2492 -1.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7492 -1.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7508 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2508 1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7492 -1.3047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7508 1.2934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2508 1.2925 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.6508 2.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 -0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5000 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2492 -1.3073 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -15.7492 -1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0015 2.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3922 3.9618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2186 4.2119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5075 4.9648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5084 6.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8079 7.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1065 6.4633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1056 4.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8061 4.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4934 2.7470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0396 -0.5994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5994 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0396 0.5994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4508 -1.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0374 -3.1987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6021 -3.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 -1.9975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0402 -2.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3766 -1.7114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6486 -2.3410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3486 -2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3514 2.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6514 2.3356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1514 2.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8721 -0.4168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2077 -1.1889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2923 1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6279 0.4019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7499 -0.1082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9492 -1.3089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7485 -2.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4695 7.0654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8086 8.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1460 7.0627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1445 4.3627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 M END