PUBCHEM-ZINC05431561 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.1700 1.5030 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -0.0040 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.5950 -1.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.0890 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -2.8180 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -4.1940 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -4.8480 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -4.1260 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -2.7490 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -1.9630 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -1.4910 -1.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0480 -2.3490 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -0.8120 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -1.5280 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 -0.9050 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8370 0.4340 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7030 1.1510 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 0.5260 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -0.5700 -2.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -4.9710 -0.2040 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2810 -4.3960 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -6.1860 -0.2890 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7120 1.8810 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 1.8650 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 1.8540 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -0.2230 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.3070 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -5.9250 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -4.6400 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -2.5960 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -1.0980 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -2.5750 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6250 -1.4650 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 0.9210 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7800 2.1970 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 1.0850 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 0.2200 -1.4570 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END