IBS-ZINC02425428 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.1710 1.3840 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.0000 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.5960 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 0.1800 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 1.5880 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 2.1710 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 2.4660 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 1.8530 0.1580 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6520 -0.4190 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -1.7620 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -2.3030 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -3.7960 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -4.5250 -0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 -4.2480 0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3760 -3.4550 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3940 -2.1830 0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -1.6000 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -0.5680 -0.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4820 -4.0790 1.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 1.8520 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -0.6180 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -1.6790 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 3.2540 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 0.2930 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -5.2460 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -5.0670 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3110 -3.5180 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 3.7250 0.2560 O 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 28 2 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 M CHG 1 8 -1 M END