PUBCHEM-ZINC03645630 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 -2.7010 -0.7580 4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -1.4400 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -2.5770 2.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.4540 1.5150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -1.7240 0.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9720 -1.1320 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -2.3600 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -1.4910 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -1.4830 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -2.7800 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -3.1760 -1.5410 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7160 -3.6380 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -4.3360 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -2.0130 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -1.4560 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -0.4530 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 0.1100 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -2.5230 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.3450 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -3.7120 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -2.4290 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -4.4400 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -4.0100 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.7890 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -4.0060 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -4.6120 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -5.1800 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -1.2060 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.3690 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -1.6730 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -0.9110 2.0860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 M CHG 1 11 1 M CHG 1 31 -1 M END