ASINEX-ZINC00040079 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6960 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.1600 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -4.9960 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -4.7970 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -3.6710 -2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -5.8680 -2.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -5.7360 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -7.1160 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -8.0570 -2.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -7.3500 -2.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -6.2910 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -6.2040 -2.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -4.9460 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -4.3290 -2.4780 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -8.7260 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.4460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.4700 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.3700 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.3450 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -9.4170 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -8.9330 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -8.8500 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 M END