CHEMBRIDGE-ZINC04978135 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.3680 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.0080 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6850 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0260 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4020 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0860 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.5610 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 4.1540 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 4.2510 -0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 5.6400 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 6.3970 -0.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 7.7020 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 8.0630 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 6.6000 0.0900 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0780 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7620 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.1650 -1.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.2360 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -4.9470 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -6.3230 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -6.9990 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -6.3010 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -4.9250 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -8.4760 -0.1440 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9020 -9.0940 -0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -9.0740 0.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9380 1.8940 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.5630 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.5030 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 1.9540 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 3.7780 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 8.4180 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 9.0770 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -2.5570 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -4.4200 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -6.8740 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -6.8350 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -4.3810 0.5610 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 15 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 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 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 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