IBS-ZINC05164758 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -5.0820 3.9680 -2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 2.8580 -2.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 1.6540 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 1.5470 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 0.3260 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -0.8010 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -0.6940 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 0.5300 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 0.6360 -3.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -0.5580 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.1130 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -3.2680 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 -4.2280 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4590 -5.1520 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -3.6650 1.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -2.3950 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -1.4310 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -0.5990 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 0.2980 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 0.3740 4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7620 -0.4500 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 -1.3490 3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9580 -2.1540 2.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 1.2590 5.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 2.0780 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 2.9890 6.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 2.5780 7.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 3.4130 8.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 4.6620 8.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 5.0730 7.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 4.2380 6.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 5.4800 9.7080 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 4.8650 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 3.7670 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 4.1190 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 2.4200 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 0.2460 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -1.5670 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -0.3340 -3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -0.9520 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -1.3000 -3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -3.3920 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -0.6570 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 0.9420 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 -0.3880 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8660 -2.9990 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 1.4440 5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 2.6760 4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 1.6030 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 3.0920 9.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 6.0470 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 4.5600 5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END