PUBCHEM-ZINC02989532 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.1340 1.3280 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.0520 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -0.6930 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 0.0450 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 1.4250 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 2.0720 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 3.4690 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 4.1700 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 3.5930 1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 5.6400 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 6.4170 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 7.7880 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 8.3950 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 7.6290 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 6.2560 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 5.4390 3.2550 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2780 5.9820 4.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 4.2240 3.1830 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7320 10.1220 1.0850 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.4530 -0.1010 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -2.8120 0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.9130 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -2.9180 -1.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -2.5820 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -2.8960 -3.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -2.4920 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -1.8070 -3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -1.6890 -2.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 1.8280 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.6300 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -0.4590 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 2.0000 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 3.9330 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 5.9450 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 8.3900 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 8.1080 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -3.4250 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 -2.7010 -5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -1.3930 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 27 39 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END