PUBCHEM-ZINC05878969 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 -0.3730 0.2610 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 0.6880 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 2.5360 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 3.2930 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 4.7670 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 5.5280 3.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 6.9100 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 7.9020 1.9520 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 7.3820 4.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 8.8220 4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 9.4210 4.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 10.2230 5.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 10.7920 4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4990 10.5700 3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 9.7900 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 9.2220 3.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0460 11.2690 3.4740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 6.5030 5.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 5.8060 6.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 4.8350 6.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 4.1870 7.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 4.5300 8.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 5.4560 7.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 6.0800 6.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -0.8020 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 0.5530 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 0.4810 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 1.0290 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.3980 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.1640 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 2.6530 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 2.8820 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 2.8640 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 3.2120 3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 5.1960 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 4.8820 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 4.9810 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 8.9030 5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 9.4230 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 10.4080 6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 11.4050 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 9.6180 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 8.6190 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 7.0860 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 5.7530 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 4.5860 6.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 3.4400 8.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 4.0590 8.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 6.8280 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 1.0520 1.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8270 0.7550 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 50 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 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 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 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 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END