IBS-ZINC06645548 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.6520 -0.2580 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.0890 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.8510 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.6420 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.3480 -1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4400 -0.7630 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -0.9760 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -0.2850 -1.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 1.1010 -1.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 1.6240 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 0.8950 -3.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 3.1140 -2.9830 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5060 3.6100 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 3.6050 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 5.1230 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 5.4740 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 4.8800 -4.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 3.4420 -4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 5.8150 -5.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 4.9340 -6.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 6.9430 -5.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 6.4270 -4.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 5.7050 -4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 6.1850 -3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 7.3880 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 8.1100 -3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 7.6320 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 0.0550 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.3540 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.3050 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.9690 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -1.9090 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.7300 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -0.4570 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -1.7190 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.1680 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 1.6840 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 3.1270 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 3.3510 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 5.4750 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 5.6010 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 5.0730 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 6.5570 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 3.1840 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 2.8750 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 4.7660 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 5.6210 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 7.7620 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 9.0490 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 8.1980 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -2.3040 -1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -2.6610 -1.3000 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 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 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 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M END