IBS-ZINC05429310 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.6020 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8280 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -2.9180 -0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -3.6220 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -4.1820 1.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -3.7110 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -2.7970 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 -3.3210 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0040 -2.7010 0.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 -1.6030 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1450 -0.9340 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0890 0.1810 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 0.6770 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 0.0590 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -1.0980 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -1.7150 1.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -4.4440 -0.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -4.6740 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -5.7100 -0.9590 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6190 -5.2720 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8570 -4.7500 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 -5.5490 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1430 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.3140 -4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -3.6800 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -3.8280 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -2.3660 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -2.4710 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0980 -1.3060 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 0.6900 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 1.5650 3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 0.4560 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -5.8110 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -6.3440 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -6.3020 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 -5.2360 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -3.7160 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9000 -5.1750 -4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 -6.5820 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 25 2 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END