MMs01291309 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.7537 -1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5925 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4925 -2.6024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2462 -1.3055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2387 -3.9036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7387 -3.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4925 -2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9925 -2.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7387 -3.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -5.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -5.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7312 -6.5060 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7612 -3.8949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1642 -4.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 -3.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -5.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0075 -2.5894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2537 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2537 -1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5075 -2.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2612 -3.8819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7612 -3.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5075 -2.5764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5150 -5.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7687 -6.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5225 -7.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0225 -7.7682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7687 -6.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0150 -5.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 -0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6708 -0.5229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6752 -2.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6357 -4.9411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8955 -1.5701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5955 -1.5779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9387 -3.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 -6.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6537 -1.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 1.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 1.0539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4537 -1.2804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6642 -4.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5687 -6.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9255 -8.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6254 -8.8057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9687 -6.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -4.1292 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 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 M END