IFLAB-ZINC05255258 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6130 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.9580 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.6470 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -3.4450 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -4.2150 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -3.9200 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -5.0200 -0.0980 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -5.8820 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -5.3540 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -5.8860 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -5.4590 4.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -6.8480 4.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -6.9690 1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -7.4120 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -6.8590 -0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -8.5720 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 -9.0340 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0370 -10.1170 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -10.7460 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -10.2940 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -9.2140 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -11.0890 3.2740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7850 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -3.3250 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -1.9120 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -4.1440 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.7620 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -7.1890 3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -7.2000 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -7.4110 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -8.5440 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 -10.4750 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 -11.5940 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -8.8640 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -2.1830 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -3.1890 -0.6180 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 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 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 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