CHEMBRIDGE-ZINC01164488 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0140 2.0210 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.5000 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -0.1580 0.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8040 0.2290 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -1.6730 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 0.1410 -1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 0.7900 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 1.1630 -0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 1.0280 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 1.6630 -2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 1.9610 -4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 1.9640 -5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 2.2440 -6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 2.5230 -6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 2.5230 -5.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 2.2380 -4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 2.2330 -3.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8680 2.5240 -3.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 0.2960 -3.6440 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.2360 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -1.0740 -2.6390 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 2.4900 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 2.3160 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.3410 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 0.1800 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 0.2050 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -2.1420 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -2.0610 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -1.8960 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5370 1.9490 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 1.7480 -4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 2.2470 -7.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 2.7420 -7.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 2.7420 -6.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5360 2.4870 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9010 3.5200 -4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1860 1.7880 -4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 M END