MMs02981053 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.2979 -0.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2955 -2.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5934 -3.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8959 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 -0.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7966 1.4878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 2.2399 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4595 2.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1985 1.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 3.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0968 2.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 3.7358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3946 1.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6902 -0.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9927 1.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6948 2.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2929 2.2277 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.2953 3.7277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5908 1.4757 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.2882 -0.7723 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5362 -2.0702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0403 0.5256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5861 -1.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8863 -0.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1842 -1.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1818 -3.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8816 -3.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5838 -3.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2835 -3.7723 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 0.6016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -2.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 -4.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9319 -2.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5999 1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7212 -1.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2639 -1.6806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2029 -1.1404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9763 0.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0164 1.2854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7898 2.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 3.7380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5029 4.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 3.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3521 -0.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6883 -1.9683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6967 3.4317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8882 0.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2243 -0.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2201 -3.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8797 -4.9764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 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 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END