PUBCHEM-ZINC05724168 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.7540 0.2750 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.9170 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -1.7570 -0.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -1.0480 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 0.1660 -1.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -1.5640 -1.7820 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5260 -2.7200 -1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -0.8310 -2.3880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0800 -3.1620 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -3.2520 1.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1420 -2.6820 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -4.7160 1.5880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3520 -5.2940 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -4.8030 2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6040 -5.8480 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -4.1700 2.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4920 -4.7380 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -2.7270 2.3360 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7370 -2.2850 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -2.7150 1.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -1.9520 3.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -2.2370 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -1.2730 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.4220 4.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.8200 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.1430 1.7770 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0220 -0.2910 0.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 0.5620 1.5490 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5360 -4.1820 4.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -4.1010 3.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -5.2390 1.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 1.1620 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -1.1630 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -3.6020 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -3.7040 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -3.0740 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.1980 6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -5.0660 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -4.2700 4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -6.1650 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 29 38 1 0 0 0 0 30 39 1 0 0 0 0 31 40 1 0 0 0 0 M CHG 1 6 1 M CHG 1 8 -1 M CHG 1 26 1 M CHG 1 28 -1 M END