IBS-ZINC02316394 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.0020 1.3820 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0010 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -0.6810 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 0.0170 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 1.3980 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0860 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4850 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 4.1460 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 3.2800 2.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 5.4900 0.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 6.1510 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 5.5360 2.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 7.6220 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 8.3320 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 9.7050 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 10.3840 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 9.6880 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 8.3110 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 7.4390 4.1410 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 12.1140 1.6730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.4430 -0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.8400 0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.8560 0.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -2.9200 -1.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.6270 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -2.9530 -3.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -2.5920 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -1.9300 -4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -1.7760 -2.4670 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.9140 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -0.5460 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -0.5190 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 1.9420 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 3.9780 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 5.9800 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 7.8050 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 10.2540 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 10.2220 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.4050 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -2.8150 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -1.5500 -4.7300 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 28 41 1 0 0 0 0 M END