IBS-ZINC05451686 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.4150 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.2560 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -3.5960 -1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -4.7740 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -5.0390 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -6.3390 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -7.3990 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -7.1560 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -5.8420 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -5.2480 -2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -3.8670 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -3.0510 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.8380 -3.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -3.6150 -4.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -4.9680 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -5.7460 -3.8260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -5.4500 -6.5620 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -3.7680 -7.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -2.8650 -6.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -8.6780 0.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -8.8570 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0330 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -2.3030 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -1.5890 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -4.2240 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -6.5380 2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -7.9800 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -3.5580 -7.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -3.6390 -7.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -2.2710 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -2.1910 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -8.4320 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -9.9220 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -8.3550 2.6640 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 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 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 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 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END