IFLAB-ZINC04939856 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.5240 -0.1200 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 0.0890 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.8250 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 0.5290 4.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 0.9480 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 0.2130 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 1.1240 5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 0.9630 5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 1.5740 6.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 2.3130 7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 2.4100 7.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 1.8390 6.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 2.9880 8.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 2.8020 8.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 3.4300 9.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 4.2460 10.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 4.4370 10.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 3.8040 9.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 5.2630 11.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 5.9860 10.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 5.9960 9.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 6.7680 11.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 7.5180 11.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 8.2460 11.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 8.2340 13.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 7.4920 13.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 6.7640 12.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 7.4840 15.5250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -1.2040 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 0.1700 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 0.2080 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 0.3300 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -0.9860 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.4940 5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 1.8980 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 0.7070 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 2.0230 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -0.8610 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 0.5440 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 0.3810 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 1.4820 6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 2.1660 7.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5190 3.2850 9.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 4.7360 11.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 3.9480 9.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 5.3150 12.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 7.5280 10.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 8.8270 11.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 8.8060 13.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 6.1890 13.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 0.5090 1.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 51 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 51 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 50 1 0 0 0 0 M END