IFLAB-ZINC04167292 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -0.6890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 -0.0350 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -0.7620 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 -2.3970 -0.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -1.9970 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 -0.1880 -0.0710 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4850 -1.7700 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9710 -1.5200 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -0.3830 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8300 -2.5590 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2740 -2.3150 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0060 -3.6330 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6010 -4.0820 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2720 -5.2910 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3470 -6.0510 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7520 -5.6030 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0860 -4.3900 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3450 -3.8230 2.4820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 -2.3410 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 -2.3340 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4910 -3.4680 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5390 -1.7450 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5560 -1.7520 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5420 -3.4890 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7360 -5.6420 -2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8700 -6.9960 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8110 -6.1970 1.9050 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 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 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 M END