CHEMBRIDGE-ZINC02845220 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0690 1.2240 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0110 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.5590 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.8320 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.3020 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -1.5260 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -0.3400 1.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 0.1780 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4550 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.9580 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 2.2020 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 3.5460 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 4.1130 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 4.3440 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 5.8330 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 6.7930 -0.4750 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 8.4540 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 9.5030 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 10.8030 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 11.0630 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 10.0220 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 8.7190 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 12.4590 -0.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7960 13.3760 -0.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 12.6890 -0.7390 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8100 1.6370 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5680 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -2.4210 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.2750 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -1.9100 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 2.9350 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 1.7550 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 4.1660 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 4.0380 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 6.0110 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 6.1390 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 9.3010 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 11.6180 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 10.2290 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 7.9060 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 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 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 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 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 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