PUBCHEM-ZINC03662332 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.0130 1.6070 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.1690 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -0.3740 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -1.7100 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -2.5300 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0020 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.6660 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -0.0910 2.4980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -3.8950 -0.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -4.6520 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -4.0380 -3.4090 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -6.0190 -1.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -7.0570 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -7.2350 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -8.7730 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -9.8280 -5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -9.2740 -7.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -8.6390 -6.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -7.5870 -5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -6.4890 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -6.8500 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -8.0450 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -7.7190 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -6.3500 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -5.8120 1.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 2.1600 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 1.6780 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 2.1020 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 0.2370 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.0850 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -2.6260 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -4.4080 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -8.0030 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -6.8020 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -6.2980 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -7.6520 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -9.2210 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 -7.9380 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -10.2080 -6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -10.6810 -5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -8.5250 -7.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -10.0760 -7.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -8.1820 -7.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -9.4190 -6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -6.7490 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -7.2160 -5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -7.3500 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -5.7060 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -9.0300 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -8.3960 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -5.6460 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -8.2080 -4.4120 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3820 -9.0030 -4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END