MMs03542685 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 61 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 -0.7482 1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2482 1.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2517 -1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7517 -1.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2482 1.3061 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8482 0.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7482 1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4965 2.6082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9965 2.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7482 1.3122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7447 3.9103 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5856 4.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1328 5.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2462 6.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5462 5.5367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2415 2.9557 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.8415 3.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7083 3.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7135 2.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1803 2.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6523 1.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1139 3.0977 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -18.3097 3.9884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.2873 3.3488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.6575 0.5571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -20.8309 0.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.2882 -0.5846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7799 1.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3183 0.1013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1468 2.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8468 2.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8531 -2.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1532 -2.3381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2932 -1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6282 -0.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8951 3.6466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0944 4.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4261 6.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3533 7.0867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9502 7.2567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0328 6.6336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6880 5.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2573 4.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7251 3.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6967 1.5189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1645 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7293 3.5820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1971 3.1073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2363 4.0691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.1855 1.3567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.8162 0.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4965 2.6041 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4581 2.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8951 3.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5349 3.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 57 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 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 17 1 0 0 0 0 15 54 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 20 54 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 32 33 3 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 57 60 1 0 0 0 0 M CHG 1 26 1 M CHG 1 57 1 M END