IBS-ZINC05249092 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -1.2540 1.1890 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.1550 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7060 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.9450 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.6250 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.0750 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.8430 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.1590 -2.5120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0150 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.6950 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.9070 3.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.0520 4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.1310 6.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.0180 7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 1.2910 7.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.2950 9.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.8390 8.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 0.7750 9.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.3880 8.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 1.0470 11.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.3740 11.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 3.3760 10.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 3.0960 9.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 2.7760 13.1080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.9740 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 1.2310 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.3330 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.3760 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -3.5880 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6080 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.9540 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 0.6900 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 0.6670 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 0.2470 11.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 4.4090 10.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 20 34 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 35 1 0 0 0 0 M END