PUBCHEM-ZINC01228431 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.2440 1.1090 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.3820 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -1.2500 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.6140 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -3.0430 0.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.1860 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.8770 -0.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.6700 -2.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -4.2480 -2.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -4.4220 -3.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -5.0330 -1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -4.4460 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -4.2310 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -4.3850 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -4.7580 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -4.9740 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -4.8230 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -4.9140 -0.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 -5.3680 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -5.7300 -2.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3460 -5.4240 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1210 -5.9360 -2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4610 -6.0520 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0170 -5.6800 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3790 -5.7990 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1880 -6.2870 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6370 -6.6590 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2750 -6.5360 -3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5840 -6.9940 -4.6060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.8990 -6.4350 -1.4050 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.4440 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.6100 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 1.3500 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -0.8730 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -3.3170 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -2.0840 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -3.9410 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -4.2160 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -5.2640 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -4.9950 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 -4.6970 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4580 -6.0770 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 -4.4220 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3860 -5.2990 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8110 -5.5100 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2700 -7.0410 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 M END