MMs03916323 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7407 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0186 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5185 2.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2592 1.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2407 -1.3151 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7592 1.2722 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 -0.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7591 1.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2591 1.2401 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.3478 -0.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4997 -0.0750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2404 -1.3794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4812 -2.6730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9812 -2.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2219 -3.9560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2405 -1.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7405 -1.3472 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7404 -1.3901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2778 3.8809 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.2407 1.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9814 2.6194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4813 2.6302 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8813 3.6694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2406 1.3365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7405 1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7591 -1.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 3.9345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 3.9452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6074 -1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 3.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3666 2.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3694 -0.4345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6998 -1.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1665 2.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3330 -2.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0737 -3.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 3.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1159 0.9180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4574 0.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5237 2.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8652 1.7657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4628 5.2282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0553 6.2717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6072 -0.9706 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 48 1 0 0 0 0 33 34 2 0 0 0 0 33 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END