CHEMBRIDGE-ZINC03904845 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 2.2990 0.8430 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -0.4870 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.8470 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 0.1150 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 1.4390 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 1.8170 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 3.1870 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 3.8610 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 3.2000 -0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 5.2360 0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 6.2730 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 7.6920 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 10.0700 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 11.0830 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 11.2450 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 10.0170 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 8.9390 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -2.2360 0.2830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8960 -3.0540 0.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.5110 -0.2050 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2480 1.0800 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.2170 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.1380 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 2.1670 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 3.7780 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 5.5240 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 6.0630 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 6.1720 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 7.9700 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 7.7540 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 9.8990 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 10.3880 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 12.0580 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 10.7810 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 10.2150 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 9.6950 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 9.2410 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 7.9880 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 8.7310 0.5630 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9700 8.4060 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 39 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 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 39 1 M END