ASINEX-ZINC00794162 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.0140 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -1.4930 1.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -1.9780 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -3.0950 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -3.5940 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -4.6340 3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -5.0920 4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 -4.5100 5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 -3.4710 4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -3.0160 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -0.6850 0.0160 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -1.8840 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 -1.1580 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.3640 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -3.9150 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -2.7090 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -5.0880 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -5.9040 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -4.8680 6.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -3.0160 4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -2.2070 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 M END