MMs02768055 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.7454 -1.3017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2453 -1.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4907 -2.6141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9907 -2.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7453 -1.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 0.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9920 -0.9936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3094 1.5908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 2.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8947 1.3457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8616 3.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4935 4.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 5.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5587 6.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9268 6.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0782 4.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6819 2.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8923 1.3100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0062 0.0996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7783 2.5203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1026 0.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9405 -1.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1509 -1.9533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5234 -1.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6855 0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4751 1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7337 -2.2341 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0464 -1.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -3.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0278 -3.2018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4037 1.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1037 1.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -3.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -3.6459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3416 -2.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5201 3.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2475 6.4371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4375 8.0163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9001 6.9093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1728 4.2231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8116 3.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8425 -1.5514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0212 -3.1462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7835 0.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6048 2.2221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 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 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END