PUBCHEM-ZINC02050646 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8460 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.6780 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0500 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.6070 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -3.7960 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -2.4040 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -1.5330 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -0.2330 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 0.5680 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 1.9440 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 2.5460 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 1.6730 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 0.0190 0.0830 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 2.0610 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 3.5280 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 4.3670 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 4.0570 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 2.6990 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 3.2980 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -6.4870 -0.0140 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.2540 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.6940 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -4.2330 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -1.9660 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0660 1.9330 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1720 1.4330 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7760 3.8730 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 3.6270 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 4.1220 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9990 5.4260 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 4.4410 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6670 4.5230 -0.5910 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 3 0 0 0 0 M END