PUBCHEM-ZINC05838062 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 0.3240 0.5730 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.6300 -0.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -0.4020 -0.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9120 -0.6630 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 1.0510 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.6300 -0.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 1.6310 0.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 0.8620 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -0.4190 2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -1.0650 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -2.3330 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.1800 2.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4840 -3.1970 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -2.7690 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -1.8320 4.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -2.1770 5.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -4.6190 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -4.6460 0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 0.7550 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 1.2600 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -2.8190 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.3020 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -3.6430 3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.8430 4.7040 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3920 -5.5790 2.7340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 25 -1 M END