PUBCHEM-ZINC00717618 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.2570 0.4420 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.9080 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.5930 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -0.8680 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 0.5060 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 1.1500 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 1.4840 0.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -1.6550 -0.4340 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -2.8710 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -2.7380 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 -3.6640 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -4.7180 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -4.8620 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -3.9390 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -4.0900 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -3.0600 0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3650 -3.4450 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -2.6740 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -2.6170 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -4.4500 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -4.5020 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -3.9880 -4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -4.3520 -5.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -5.2330 -5.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -5.5890 -6.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -5.8560 4.1490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.9390 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -1.4280 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 2.2040 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -1.9120 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -3.5550 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -5.6980 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -4.0800 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -5.1010 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -3.3760 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -1.6780 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.8730 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.3790 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -5.4510 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -3.7650 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -4.7530 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -5.2340 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -3.0320 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -4.7900 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -4.8550 -6.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -3.4670 -6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -3.1460 -0.9380 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.4710 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -3.9540 -3.4430 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6720 -4.6560 -3.8280 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 47 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 49 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 47 1 M CHG 1 49 1 M END