MMs00895257 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 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 -1.3005 -0.7475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5952 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2948 2.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0029 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8928 2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4966 -0.7376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7914 1.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4909 2.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0947 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0975 -2.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6927 -0.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 0.0247 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.7428 -1.2729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2379 1.3223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2880 0.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2851 2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5827 3.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8832 2.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8860 0.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5884 0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1808 3.0346 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0381 -0.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3027 -1.9475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6384 -0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2925 3.4525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 2.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1197 3.1752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6624 3.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7879 -1.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 0.2160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2697 -1.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9735 1.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1996 2.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2605 3.1831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7178 3.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6192 0.9375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1619 0.9405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9232 -1.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4658 -1.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2447 2.8752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5804 4.2296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9264 0.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5907 -1.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1933 1.5099 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1933 2.7099 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 50 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 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END