IFLAB-ZINC04249139 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 0.0450 1.3920 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.0140 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.6850 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 0.0030 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 1.3820 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 2.0850 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 3.5680 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 4.3580 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 5.6790 0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 5.6280 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 4.3690 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 7.2650 0.2580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 8.1280 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 7.0030 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0820 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -2.8920 -1.1310 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.3750 -1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.2710 -0.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -2.4230 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -1.4530 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -1.2630 -4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -2.0820 -4.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -3.1690 -3.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -2.0780 -6.3870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 1.9350 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.5230 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -0.5420 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 1.9170 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 4.0280 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 8.7590 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 8.7220 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 7.0820 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 7.1190 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -2.5770 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -0.8590 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -0.5110 -5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 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 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 M END