IBS-ZINC05272672 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.3150 0.8780 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.4320 1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.9220 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.2730 1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -2.2460 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.9520 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -4.1890 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -4.7390 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -4.0550 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.8090 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.1190 0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -2.7960 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -3.9960 0.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -2.0630 0.4410 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1360 -1.2530 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -1.4860 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -0.9670 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1970 -0.0340 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4940 0.4440 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4650 -0.0080 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1430 -0.9400 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8380 -1.4220 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4730 -2.4160 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2400 -2.7080 1.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 -2.9870 0.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9060 1.6180 -3.2810 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 1.1530 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.6130 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 0.8510 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.5270 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -4.7320 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -5.7100 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -4.4900 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.1520 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -0.6700 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -2.2650 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 0.3240 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4750 0.3690 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8980 -1.2940 0.4590 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 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M END