MMs02459845 MOE2007 2D CORINA 3.40 0006 02.08.2006 86 89 0 0 1 0 0 0 0 0999 V2000 0.3646 -0.3421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 0.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5722 1.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 2.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9903 3.5769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5903 2.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1993 4.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9076 6.1736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2999 4.8037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7584 6.1722 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9175 5.8616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6236 7.1930 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0236 8.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1534 8.7429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7888 8.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2975 7.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8411 7.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7797 8.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3348 9.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6557 9.7112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3288 7.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 5.9620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 5.4421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3325 4.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4599 3.1087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 3.4427 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2045 2.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6904 3.6799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7168 4.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3102 4.2277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 1.9597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6749 1.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9382 2.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0977 1.2702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2588 1.5733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5511 -0.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0537 -0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2285 -1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9008 -2.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3982 -2.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2233 -1.4675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1284 7.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5156 5.7186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7229 8.3084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2805 2.3501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 4.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6932 0.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -1.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4224 -0.9088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6729 -0.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6103 -0.1716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1719 1.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 2.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6123 1.4544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6614 2.9963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7236 3.6810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5338 6.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0342 6.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1145 10.3160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2496 10.8404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3205 8.2809 0.0000 H 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 3.7644 6.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 5.5135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4895 3.6246 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6895 3.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 50 1 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 54 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 85 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 2 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 23 24 1 0 0 0 0 23 63 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 29 30 2 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