IFLAB-ZINC04280361 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8190 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.3320 2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -3.7860 2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -4.1610 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -3.1960 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -2.0010 3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -1.1680 4.7220 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 -2.4480 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -3.4630 3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -4.6730 3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 -5.6320 3.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -2.4580 5.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 -1.4020 5.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 -0.4420 6.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 -1.4130 6.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2080 -0.3210 7.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4670 -0.3370 7.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 -1.4320 7.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8660 -2.5180 6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 -2.5170 6.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9130 -3.8860 6.6560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -1.4540 3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -4.0700 3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -4.3030 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -5.1770 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -4.0980 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 -3.2240 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 0.5340 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8080 0.5070 8.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2800 -1.4380 8.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2700 -3.3670 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -0.4420 3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.4490 4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END