IBS-ZINC02444131 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -1.3390 1.2700 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -0.0360 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.6420 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.0130 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -0.5920 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -1.8730 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -2.5320 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -1.9130 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -3.7740 1.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -4.3810 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -2.5230 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.7790 5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -2.2530 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -3.4360 6.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -1.2990 7.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -0.0170 6.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 1.3540 7.6320 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -0.0110 5.3450 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -1.6290 8.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -1.4840 8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -1.0670 7.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 -1.8320 9.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9290 -1.6860 9.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 -2.0250 10.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 -2.4930 11.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 -2.6200 11.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -2.3060 10.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.9440 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 1.6380 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 1.2240 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 1.0010 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -0.0800 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.4170 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -5.3680 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -4.4790 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -3.7600 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -3.5930 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -1.9620 9.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4130 -1.3180 8.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7430 -1.9250 10.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5880 -2.7590 12.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -2.4200 10.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 42 1 0 0 0 0 M END