PUBCHEM-ZINC04923789 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.5950 1.5820 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 0.1440 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.0220 -1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 0.3340 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -0.8070 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -1.8170 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -0.7040 -0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.7560 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 -1.7600 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -2.8460 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -3.8050 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -3.2300 0.4230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.5010 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.7250 -2.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.7540 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -1.4600 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -1.6930 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -1.2280 -5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -0.5260 -5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -0.2920 -4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.1050 -7.6260 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 2.2700 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 1.7960 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.7060 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.0700 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5440 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.5320 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.2250 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 0.1040 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -2.9500 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -4.7640 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -1.8240 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -2.2390 -4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -1.4120 -6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 0.2520 -4.8810 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 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 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 M END