MMs02458767 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 -0.7506 1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2506 1.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2494 -1.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7494 -1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2506 1.2965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2494 -1.3016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7494 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4988 -2.6017 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2988 -2.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9988 -2.6024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7494 -1.3037 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.3494 -2.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7506 1.2944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2494 -1.3044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 -0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2506 1.2937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5000 -0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2506 1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7506 1.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5000 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7494 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2494 -1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7481 -3.9003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4975 -5.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9975 -5.2005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7469 -6.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2469 -6.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4963 -7.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2456 -9.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7456 -9.0965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4963 -7.7978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1511 2.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8511 2.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8489 -2.3396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1489 -2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6489 -2.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5416 -0.1204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8772 -0.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7898 -3.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1262 -3.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8489 -2.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6511 2.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3511 2.3304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7000 -0.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3489 -2.3461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6489 -2.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5481 -3.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6474 -5.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2963 -7.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6451 -10.1347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3451 -10.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6963 -7.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0036 0.0000 O 0 5 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 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 39 1 0 0 0 0 6 40 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 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 16 58 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 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 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 2 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 M CHG 1 58 -1 M END