PUBCHEM-ZINC05411440 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 -0.6030 1.3850 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 0.2010 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9920 0.5570 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -0.7920 -0.6640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5880 -0.3290 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -1.7930 0.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8880 -1.3040 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -1.8200 1.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9490 -2.5080 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -0.4900 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.2100 2.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -3.3490 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -3.4050 4.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -2.2480 4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.4710 3.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.8510 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.6640 7.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3100 -3.5160 6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.4730 8.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -4.2170 2.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -2.9860 -0.1190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0230 -1.4920 -1.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.4040 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 2.1790 1.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 1.5250 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 2.0110 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 1.0580 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -4.0050 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -5.0860 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -0.7100 6.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -0.1920 5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -0.3460 7.1310 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 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 17 1 M CHG 1 21 -1 M END