IFLAB-ZINC05154741 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.8710 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -3.5480 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -3.9240 0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -3.7510 3.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -2.4300 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -3.3480 4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 -2.7180 3.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -2.4850 2.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -3.6300 5.6750 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3490 -4.4680 5.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9820 -4.8160 6.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8350 -3.9180 7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4160 -4.2370 8.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1430 -5.4530 9.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2910 -6.3510 8.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 -6.0350 7.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -7.1650 6.5290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0140 -3.8090 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1780 -5.3800 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -2.9680 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0810 -3.5360 9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5970 -5.7020 10.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0790 -7.3010 8.9900 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 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 15 2 0 0 0 0 14 16 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 M END