IBS-ZINC04029271 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.5300 0.9920 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.3950 -2.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.9790 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -2.4350 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.9920 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -4.3270 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -5.1080 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -4.5560 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -3.2150 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -2.6680 -2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -3.5300 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -4.9320 -0.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5390 -4.1420 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -5.7020 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -6.9240 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -7.3400 -3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -8.4930 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -8.5490 -4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -7.5180 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -6.3670 -5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -6.2820 -3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -5.3110 -3.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -4.4710 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -7.6480 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -6.6300 0.6900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7380 -7.1550 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -5.6900 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -4.4990 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -6.1760 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 -5.2130 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 1.3600 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 1.1200 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 1.5520 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.4600 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.8920 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -2.3840 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -6.1510 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -5.1660 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -4.3560 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -3.9240 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -2.9690 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -9.3020 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -9.4240 -5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -7.6170 -6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -5.5700 -5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -8.4390 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -8.0760 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -4.5260 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -4.6520 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 -5.7370 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -5.8600 0.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -5.3690 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 51 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 51 52 1 0 0 0 0 M END