IBS-ZINC02218698 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.5860 1.5330 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.0260 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -0.6850 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.0640 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.7430 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -2.0180 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -0.6380 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.8510 -2.5090 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -4.2190 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -4.8070 -0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -4.9140 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -6.2610 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -7.0890 -0.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.9570 2.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -8.3540 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -9.1110 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -10.4910 2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -11.1270 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -10.3740 1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -8.9800 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -11.0500 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -12.2630 0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -12.8600 2.3080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 1.9200 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.9010 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.8660 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.1600 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -2.6170 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -0.0760 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -4.4450 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -6.4890 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -8.6200 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -11.0740 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -8.3920 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -10.3220 0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -10.8090 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 35 36 1 0 0 0 0 M END