PUBCHEM-ZINC05592405 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.2250 1.3730 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.1360 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.5260 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.0430 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -2.4420 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -3.8670 2.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -4.4520 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -3.7490 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -4.4380 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -5.8400 5.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -6.5380 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -5.8600 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -6.4790 2.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -7.9010 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -6.5010 6.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -5.8440 7.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 -6.7190 8.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -8.0510 8.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -8.2140 6.9940 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 -9.1850 9.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -8.9420 10.3140 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9810 -6.1220 9.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 1.8410 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 1.6290 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 1.8050 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.5740 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.5390 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -0.0820 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.1160 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -2.4990 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.4660 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -2.0280 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -2.0570 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -2.6660 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -3.8620 6.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -7.6220 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -8.2170 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -8.3040 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -8.3040 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -6.4310 10.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -6.4140 9.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -5.0280 9.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -10.3530 8.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 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 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 2 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 21 -1 M END