PUBCHEM-ZINC04762689 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 0.0370 1.2920 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 3.2090 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 3.7110 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 3.3880 3.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 4.5590 2.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 5.2110 3.9600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7650 4.4220 4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 6.2540 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 7.2130 3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 7.8760 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 5.8870 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 5.7990 2.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 0.2170 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.7880 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.4450 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 3.3940 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 3.7790 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 4.7970 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 6.7910 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 5.7720 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.7700 1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 1.6140 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 6.4020 4.7740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 23 -1 M END