IBS-ZINC05033190 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.8000 1.2660 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.0360 -0.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -0.8460 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.6510 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -1.5870 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -2.7210 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -2.9360 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -1.9940 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.2170 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -1.3640 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -3.4050 0.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -4.0750 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -3.6700 3.5820 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -5.1020 1.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -6.3670 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -7.0670 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -8.3490 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -8.9570 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -8.2800 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -6.9840 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -8.8820 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -9.3450 5.6210 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3100 -10.5740 3.6450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.8640 -3.0340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 1.0990 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 1.8550 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 1.8400 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.2180 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -1.4270 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -3.8150 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -3.8850 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -4.9050 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -6.6280 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -8.8740 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -6.5060 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -8.8420 4.1520 O 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 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 31 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 32 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 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 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 2 0 0 0 0 M CHG 1 22 -1 M END