IBS-ZINC02323512 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.8070 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5590 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3520 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.6590 -3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -3.1450 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -3.2410 -4.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -2.6160 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.4060 -1.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -2.6990 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -3.1470 -2.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -2.4710 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -2.8650 -0.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 -2.3890 -0.0590 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7520 -2.9520 -0.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 -0.9950 0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -3.1670 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0440 -4.4100 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9390 -5.0200 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -4.3870 3.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 -3.1440 3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -2.5320 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1510 -5.0530 5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -3.5480 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -3.6570 -6.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.5140 -5.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -2.4660 -4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.6130 -5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -1.2440 -6.1800 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -2.0470 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -1.4150 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -3.0680 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -3.4050 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -4.9040 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3830 -5.9910 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 -2.6500 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -1.5590 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 -4.7640 5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 -4.7410 5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 -6.1350 5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -2.7900 -6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -4.5090 -6.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -3.2640 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -1.5000 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -3.5180 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -1.7420 -5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -2.6490 -6.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.2790 -7.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.3730 -5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.1740 -5.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END