ASINEX-ZINC00870920 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.0340 0.9450 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.4960 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.8320 -2.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 1.6520 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 2.0170 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 2.0640 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 2.3460 -2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 1.7500 -0.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 1.4660 -0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9570 0.4410 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 2.4280 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 3.7860 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 4.6720 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 4.2020 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 2.8340 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 1.9510 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 2.6270 4.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 3.8420 5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 4.8520 4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 1.6940 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 0.2830 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 0.2080 1.2120 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 2.2500 -3.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.1440 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.2890 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.2920 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 4.1550 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 5.7330 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 0.8890 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 3.7800 5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 4.0470 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 1.9450 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 2.4070 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 0.0320 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -0.4300 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.7020 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END