IBS-ZINC06760533 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 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 0.0240 -0.8310 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1440 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.3510 1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.3540 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -4.4750 0.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.5500 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -3.3000 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.3240 -2.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1000 -0.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7620 -1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -5.8230 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.8330 -1.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.3810 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 0.3020 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 0.7180 4.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.4590 5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.2180 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -0.6440 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 1.0340 6.9930 Br 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 0.0290 -4.1730 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.5040 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 1.2470 4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -0.4180 5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -1.1770 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 13 14 3 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M END