CHEMBRIDGE-ZINC01186155 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.5260 0.7990 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.5440 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 0.9750 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 1.6620 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.9220 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 1.4850 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.6580 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 2.2570 -0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 3.7720 0.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 4.5210 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 5.9050 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 6.6430 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 6.0010 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 4.6170 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 3.8790 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 6.7500 0.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4990 7.8700 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5700 8.1760 2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6930 8.7180 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8800 9.8740 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0930 10.4710 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8740 9.8290 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1170 8.4100 0.3510 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 2.1220 -2.8370 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1070 1.7980 -3.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 2.8230 -2.7460 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0100 0.4640 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.0060 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 0.7720 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 1.6840 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 4.0560 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 6.4040 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 7.7190 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 4.1190 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 2.8030 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2020 6.4620 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 10.2770 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3940 11.3910 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8560 10.1620 0.6160 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 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 16 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END