PUBCHEM-ZINC06870778 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0660 1.8340 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.3140 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -0.2630 0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9500 0.2300 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -1.7650 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 0.0190 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -0.0180 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 0.0460 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 0.1450 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 0.1810 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 0.1190 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 0.1590 -3.7490 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7600 0.8710 -4.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -0.5200 -3.8730 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.0170 0.2240 -1.3720 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -0.2300 -2.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4730 -0.3710 -0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 1.8240 -1.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 2.2450 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 2.0780 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 2.2620 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.1140 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 0.0700 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -1.9310 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -2.1760 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -2.2570 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -0.0960 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1630 0.0170 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 0.2580 -3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2530 2.1330 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 2.4520 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -0.0390 -1.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 0.0690 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 32 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END