CHEMBRIDGE-ZINC00455814 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 -0.1860 1.5790 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 0.0510 0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3570 -0.2970 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -0.5130 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.1440 -0.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -0.3170 1.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -0.9340 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -2.2010 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -2.8080 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 -2.1540 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -0.8910 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -0.2830 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -0.1940 2.0950 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.0510 0.9170 2.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2630 -0.7320 2.0670 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.3370 -2.7490 0.9600 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.3860 -0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.4330 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 0.0350 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -0.0140 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -0.5280 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -0.9940 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -0.9530 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 1.9870 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.9270 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 1.9120 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.2520 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -2.7110 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -3.7930 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 0.7000 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 0.4370 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 0.3500 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -0.5650 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 -1.3950 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -1.3220 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 17 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 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END