PUBCHEM-ZINC06678247 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0060 0.3370 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -1.1380 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -1.5060 0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0330 -0.8570 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -2.9770 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -1.2960 1.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -1.0360 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -0.9860 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -0.7260 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -0.5080 1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -0.5400 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -0.8150 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 -0.3340 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -0.9900 5.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 0.6390 4.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9950 1.0230 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 0.3970 6.8550 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.9460 1.9470 4.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6560 2.9660 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2690 3.4800 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9900 4.5220 7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1150 5.0470 6.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5010 4.5650 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7690 3.5420 4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2740 2.9930 3.3430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.5490 5.0790 8.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 4.6210 9.2380 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0560 0.5650 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 0.9720 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 0.6010 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -1.3710 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -1.7310 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -3.6260 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 -3.2690 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -3.1780 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -1.1630 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 -0.7090 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 -0.3520 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -0.8590 3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 1.1750 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2210 1.8730 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3750 3.1240 7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6840 5.8510 7.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3660 4.9960 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2890 5.9670 9.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 45 2 0 0 0 0 M CHG 1 27 -1 M END