IBS-ZINC04994250 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -1.3600 0.3810 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -0.0960 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 2.0960 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 2.8170 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 4.3170 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 5.0070 -0.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 5.2450 -0.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3580 4.2950 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7350 5.9930 -2.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2450 6.1420 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 5.5050 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 5.4430 -1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 6.6740 -3.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 7.3460 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 8.2840 -1.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 7.5260 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 6.4450 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7800 6.6200 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 7.8600 -3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 8.9400 -2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 8.7780 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2920 10.1560 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6370 10.2510 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 6.0860 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 6.9020 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 7.6750 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9510 7.6320 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 6.8170 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 6.0470 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 5.2540 -0.7280 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.6840 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 0.6720 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 0.9510 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 0.2420 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -1.1590 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 0.0710 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 2.4850 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 2.2630 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 2.6500 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 2.4280 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 4.4840 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 4.7050 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 5.4080 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 5.4750 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3250 5.7840 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4000 7.9900 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 9.6160 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2710 9.5700 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9960 11.2720 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6690 9.9820 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 6.9360 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 8.3120 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 8.2360 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7300 6.7840 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 0.6560 1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 M END