PUBCHEM-ZINC03080646 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 0.0230 1.5230 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 0.1980 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 0.4310 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.3460 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -1.6930 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -2.1930 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -1.3460 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 0.0010 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 0.5010 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 -1.8820 1.1190 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1990 -3.0680 1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -1.1350 1.1450 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0620 -0.9910 -1.1410 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -1.1640 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -1.9220 -3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.0550 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.4360 -4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.6810 -3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.5490 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.9580 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 1.3440 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 2.2100 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 1.1960 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -0.4980 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 0.7600 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -2.3550 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -3.2450 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 0.6620 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 1.5540 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.4050 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.6430 -5.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -1.5420 -5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -0.1990 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 0.0360 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END