CHEMBRIDGE-ZINC00455214 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.1040 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 0.0260 2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -0.1930 3.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 0.4450 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 0.5120 3.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 0.8780 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 0.9630 4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 1.3340 5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8180 1.6220 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 1.5370 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9040 1.1610 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1230 1.9890 4.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8250 2.2710 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 0.0720 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -0.2830 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.4250 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 0.7390 5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5370 1.4010 6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8050 1.7610 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 1.0900 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8530 2.5510 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8240 1.3850 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3340 3.0930 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 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 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END