CHEMBRIDGE-ZINC04841421 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3720 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 1.3990 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.5600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 4.1800 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 4.2210 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 5.6100 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 6.3410 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 7.6500 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 8.0440 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 6.6050 0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -0.7050 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7530 -0.0860 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9230 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0760 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.6170 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -3.5460 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -3.9230 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -2.6070 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9000 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 1.9470 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 3.7270 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 8.3460 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 9.0660 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -3.1840 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -1.8030 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -4.4340 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -3.0150 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -4.7400 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.1740 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -1.9040 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -2.8110 -2.0070 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 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 15 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 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 26 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END