IBS-ZINC02398502 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 -1.6980 3.0400 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 1.6120 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 1.1820 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -0.1280 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -1.0090 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.5790 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 0.7300 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -2.6790 -0.9280 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -3.1540 -2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -2.6830 0.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -3.5510 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -4.1830 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -3.7350 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -4.0420 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -3.2640 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -3.7120 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -3.6330 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 -3.1450 -1.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -3.8110 0.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -3.4140 0.8970 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8970 -2.5180 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 -4.5470 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 -4.1570 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2560 -4.7970 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 -3.1270 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -3.7030 3.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1240 -2.2300 2.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6100 -2.0210 3.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5730 -0.5200 4.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6820 0.0460 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7230 -1.4310 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 1.6280 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 3.6490 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 3.0850 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 3.4200 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 1.8700 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.4640 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -1.2670 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 1.0640 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -3.8780 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -5.2670 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -2.6630 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -4.2710 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -5.1100 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -2.1970 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -3.4650 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -4.7580 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -3.0950 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -4.2010 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -5.4540 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2610 -3.2210 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7100 -4.9410 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3680 -4.0290 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2050 -5.0760 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8730 -5.6050 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -3.8900 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6330 -2.3870 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9670 -2.5530 4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0320 -0.3350 5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5390 -0.1770 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6450 0.3800 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2190 0.6420 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1540 -1.5730 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7570 -1.7400 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4610 2.0740 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9880 1.7220 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0040 2.1420 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3150 0.2060 3.2210 N 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 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 49 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 68 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 M END