PUBCHEM-ZINC04558600 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.3360 -1.6660 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.9740 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -3.3260 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -2.3710 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -1.0630 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -0.7110 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -2.7550 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -2.6010 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -2.9050 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 -3.2900 -0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 -2.7840 -2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5490 -3.1160 -3.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0700 -3.6820 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -3.9560 -4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5940 -3.0190 -5.8690 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 -4.3640 -5.1650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -5.4760 -4.2460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 -1.8810 -3.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2380 -1.4550 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 -2.3570 -1.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9150 -0.3190 -3.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 0.1700 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7530 -0.6920 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6650 -0.2050 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6700 1.1380 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 2.0000 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8520 1.5210 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6490 1.6560 0.7430 N 0 3 0 0 0 0 0 0 0 0 0 0 14.4480 0.8990 1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6550 2.8400 1.0310 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6880 -1.3900 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -3.7200 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -4.3480 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -0.3160 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 0.3110 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0560 -2.1100 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -3.7930 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 -2.4780 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -1.3700 -4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 0.1590 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7490 -1.7420 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3740 -0.8760 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7690 3.0480 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1470 2.1950 -2.2140 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END