CHEMBRIDGE-ZINC04548173 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 2.6880 0.4380 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -0.6590 0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.9380 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.1730 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -0.4570 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -1.5050 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.2730 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -1.9970 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -2.7770 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.1200 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -4.8800 -1.5560 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.8630 0.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -6.2060 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -6.7450 -0.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -7.0210 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -6.4040 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -7.1700 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -8.5500 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -9.1690 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -8.4120 1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -9.1890 0.1360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -9.5070 4.7260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 0.3620 -4.2410 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0880 1.2850 -3.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 0.1130 -5.4030 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6450 0.2470 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.3510 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 0.5510 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 0.6460 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -1.7230 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -3.0900 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.3520 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -4.4330 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -5.3280 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -6.6930 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -10.2450 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 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 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END