IBS-ZINC02233718 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0400 1.0320 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.4660 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.7450 1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.8020 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -1.0790 3.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -1.1980 2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -1.0100 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -1.0810 -0.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -1.4690 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -1.5820 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -1.4150 -1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -1.8670 0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 -1.8720 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -2.2670 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 -2.2710 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 -1.8840 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4740 -1.4910 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 -1.4790 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5790 -1.0440 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 -2.7640 -4.3550 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -0.5900 2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 0.0340 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 0.2080 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -0.2360 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -0.8200 4.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -1.0140 4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.3360 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.2400 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.5890 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.7690 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -1.0220 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -0.6760 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -2.4150 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1780 -2.0680 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -2.5700 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 -1.8880 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4490 -1.1890 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 -1.9100 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3840 -0.3110 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 -0.5980 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 0.3700 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 0.6850 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -0.1000 4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -1.5010 4.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 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 34 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 M END