PUBCHEM-ZINC04520903 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 0.3470 2.1870 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.6820 -0.3450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5060 0.3340 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 0.4050 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -0.3070 -1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 0.9490 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 0.6390 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.0210 -1.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -0.3640 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 0.0670 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -0.2740 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -1.0430 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -1.4740 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -1.1410 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -1.6080 -3.4790 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7740 -1.9460 -3.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -1.6530 -4.5830 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2260 -1.4060 -1.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8760 -1.0270 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 -2.0830 -1.8700 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4180 2.3880 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 2.5350 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 2.7100 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -0.4380 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 1.1410 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 0.9820 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.2480 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.6680 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.0600 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -2.0740 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 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 7 24 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 18 1 M CHG 1 20 -1 M END