NIH-ZINC00451877 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 -0.9050 1.3900 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -0.1280 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.5520 -1.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -1.8720 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.6430 -0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.3610 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -3.6540 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -4.1240 -3.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -3.3660 -4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -3.8760 -5.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -2.0580 -4.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -1.4540 -3.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2740 -0.6260 -3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.8830 -4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.3350 -4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 0.6400 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -0.3310 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -1.7200 -5.6140 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -0.2260 -6.9410 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -4.5920 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 1.8760 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.6610 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 1.7120 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -0.4000 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.6150 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -5.0600 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -1.5270 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 1.0300 -3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 1.5920 -4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -4.9800 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -5.4190 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -4.0550 -0.5840 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 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 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 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 M END