CHEMBRIDGE-ZINC04958143 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.0870 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.2420 2.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 3.6410 3.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 2.7090 4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 1.5290 4.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.1190 5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 4.4760 6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 4.8570 7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 3.8980 8.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.5420 8.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.1530 6.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8140 9.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.7240 10.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 4.0150 9.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 5.4380 1.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 5.2250 5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 5.9060 7.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.1040 6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 2.6780 10.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 2.5040 11.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 6.0720 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 5.7560 2.6090 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 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 23 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 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 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