MMs02403408 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 67 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 0.0009 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2977 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2968 -3.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5953 -4.5016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5953 -3.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5944 -6.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2949 -6.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0036 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -8.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8948 -3.7524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1934 -4.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1925 -6.0031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4929 -3.7539 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4537 -3.1539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4938 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7933 -1.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0919 -2.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3914 -1.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 -0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0937 0.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6918 0.7429 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6927 2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9922 2.9921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9931 4.4921 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2899 0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5885 -0.0094 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.7915 -4.5047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7906 -6.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0892 -6.7555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4911 -6.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1826 -1.2909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -2.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7763 -5.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0042 -7.1295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2557 -7.3508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6043 -7.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 -5.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -4.9611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -8.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2933 -9.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -8.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8956 -2.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3119 -2.4616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0841 -1.1261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0912 -3.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4303 -2.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0944 1.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7554 0.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5108 2.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2830 3.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1971 2.4282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1741 3.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2185 -0.9267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7612 -0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9045 1.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0618 1.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8311 -3.9054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0905 -7.7935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4515 -7.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8917 -5.7143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 M END