IBS-ZINC02224310 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 0.6420 0.1330 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -1.2050 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -1.6140 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -0.6790 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 0.6820 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 1.0740 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 1.6830 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 2.8660 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 3.5090 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 2.6910 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 1.5980 0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 2.9560 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 2.1820 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 1.1270 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 0.8170 2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 0.5440 3.9060 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 0.9130 4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 2.2040 3.3030 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6730 0.3940 5.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0710 -0.6870 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 -1.8040 6.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -1.2480 6.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9360 -0.2920 6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9950 0.8980 5.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.1100 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 -0.2920 -0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 0.4400 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -1.9320 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.6580 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 2.1140 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 3.2260 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 4.4610 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 3.7720 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -0.3060 7.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 -1.0740 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 -2.5510 7.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 -2.2710 5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8750 0.0480 6.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1280 -0.7540 5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3880 1.5600 5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9070 1.4420 6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -2.4120 -0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -2.6460 -0.9210 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 29 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 42 43 1 0 0 0 0 M END