IBS-ZINC05156312 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.1000 1.1750 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.3200 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -1.1560 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.5270 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -3.0620 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.2260 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.8550 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.0560 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -4.8100 0.5770 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -5.0590 -0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -5.3730 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -5.2740 0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -5.3680 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -5.8180 -0.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -5.9730 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -5.6500 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -5.7300 2.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -6.1220 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -6.2140 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -6.6160 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 -6.9370 4.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -6.8590 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -6.4480 2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -6.3560 1.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -4.8510 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 -4.9750 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -6.2580 -2.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5580 -6.4780 -4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 1.5200 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.6550 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.4310 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.7380 3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -3.1800 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -2.6450 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 0.2610 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.4250 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.9920 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -4.3920 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -6.0930 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -5.9690 5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -6.6860 6.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -7.2530 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7160 -7.1120 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 -5.0560 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -3.8410 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -4.1970 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -4.8620 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -6.3960 -4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 -7.4730 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -5.7300 -4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END