IBS-ZINC02228739 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 0.5510 1.0620 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.3620 0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -0.8680 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -0.0120 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -0.5260 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -1.8940 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -2.7560 -1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -2.2440 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -3.0860 0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -3.4840 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -4.1010 -2.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -4.5570 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 0.4070 -3.7910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4900 1.4110 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 0.4320 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.6990 -5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 0.4100 -6.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 0.5060 -7.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -0.0070 -7.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -0.0240 -6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -0.3280 -5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -0.7420 -6.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -0.0800 -4.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -0.2660 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 1.0600 -3.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9900 1.8380 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 0.9060 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 1.2760 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 2.1030 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 1.4320 -5.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.2050 -4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 0.4120 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 0.8890 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 2.1500 -2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 2.9450 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 2.4780 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 3.2550 -4.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 1.4620 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.4770 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 1.3320 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 1.0570 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -2.2910 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -4.1530 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -2.6010 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -3.9990 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -4.1780 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -4.1930 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -5.6470 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -0.6030 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -1.0130 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8940 1.5920 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 -0.1230 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8030 1.8820 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 0.3820 -4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 3.1310 -4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 2.0760 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -0.5730 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 0.2740 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 2.5170 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 3.9290 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 3.8280 -4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 35 2 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 35 60 1 0 0 0 0 36 37 1 0 0 0 0 37 61 1 0 0 0 0 M END