IFLAB-ZINC05255381 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6750 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -0.0650 1.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -2.1410 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.9560 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -4.2660 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -4.5420 0.5880 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.8750 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -2.3360 -0.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -3.1500 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -4.3560 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -2.5750 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -3.4150 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -2.8730 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 -1.4980 -2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -0.6590 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -1.1900 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 -0.8230 -3.6260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -5.3570 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -4.7220 2.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -3.4690 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -2.3880 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -5.2710 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -4.7300 4.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -6.4180 4.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -6.9520 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.4910 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -1.3740 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -4.4870 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5920 -3.5210 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 0.4120 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -0.5350 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -5.8480 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.0870 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -3.6200 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -3.1610 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.0690 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -1.5350 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -7.8760 5.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -6.2250 6.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -7.1550 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END