PUBCHEM-ZINC05116581 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8220 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0880 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0450 -0.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8000 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3280 -2.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9860 -0.1840 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.5060 -4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 0.9640 -4.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 0.9030 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -0.7610 -4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -2.1490 -4.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.8360 -5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -2.1970 -6.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3970 2.5170 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0190 0.7890 2.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -1.2320 3.4040 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.9820 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 1.3290 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 1.5930 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -0.4760 -3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -0.1700 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 -2.3830 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.1810 -6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.6890 -5.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.4770 -6.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -1.3060 -3.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -1.9390 -3.8150 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 6 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END