IBS-ZINC05349196 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1640 1.8370 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.4580 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.2610 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 0.4060 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.7860 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 2.5000 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 4.0050 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 4.4380 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 5.9000 1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 6.5110 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 5.8500 3.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 8.0160 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 8.4300 3.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 8.5940 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 8.4130 4.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 9.0110 5.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 9.2530 6.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 9.8220 8.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 9.6780 9.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 10.2140 10.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 10.8940 10.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 11.0410 9.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 10.5150 8.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 11.5660 12.2380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 9.1260 6.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 8.6510 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 8.5450 4.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.6180 -0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 2.3980 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.0590 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -0.1520 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 2.3060 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 4.3760 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 4.4140 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 4.0670 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 4.0280 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 6.4290 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 8.3860 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 8.4250 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 9.0270 6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 9.1470 9.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 10.1040 11.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 11.5720 9.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 10.6340 7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -1.9640 -1.4940 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 45 1 0 0 0 0 M END