CHEMBRIDGE-ZINC04700453 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 0.1080 1.0200 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.3230 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.8090 -1.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -2.0650 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.4790 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -1.7680 -1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -3.6390 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -3.9690 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 -2.9660 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -3.2950 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2520 -4.6210 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 -5.6210 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -5.2990 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -6.3900 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8950 -2.2270 0.2340 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.5590 -1.0600 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0740 -2.5160 0.3250 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1320 1.3900 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.8900 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.7370 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.0400 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.1930 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.8180 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.9710 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -4.2460 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -1.9310 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2990 -4.8750 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -6.6550 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -6.6030 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -7.2910 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -6.0660 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END