PUBCHEM-ZINC05598870 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.2390 1.2060 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.1690 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.7460 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 0.0520 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 1.4270 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 2.0100 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 3.4010 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 4.3150 1.1030 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 3.9150 0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 5.6570 0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 3.8330 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 3.2400 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 2.8610 4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 3.0760 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 3.6700 4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 4.0530 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 4.8050 2.0020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 2.1160 5.9490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.2190 0.0380 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7670 -2.9230 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -2.7290 0.1080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7410 1.6560 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -0.7940 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.4020 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 2.0490 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 3.8310 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 3.0720 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 2.7810 6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 3.8370 4.6610 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END