PUBCHEM-ZINC06361538 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.4900 -1.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8390 -1.5780 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 0.1110 -1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7180 -0.1850 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 1.6370 -1.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3220 2.0200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 2.2420 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 3.6670 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 2.1120 -2.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -0.3630 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.0710 -2.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.4910 1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.3030 2.2220 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2690 -0.1150 3.2280 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8880 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8780 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 1.8800 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 1.9490 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 4.1180 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 3.0740 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -1.3240 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -0.4110 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 16 17 2 0 0 0 0 M CHG 1 16 1 M CHG 1 17 -1 M END