PUBCHEM-ZINC06068626 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 19 0 0 1 0 0 0 0 0999 V2000 -0.1380 0.5270 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.4010 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 1.9890 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 2.6990 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 3.4740 -2.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 2.5730 -3.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 3.3940 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 1.7320 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 1.9710 -0.2460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8660 2.4600 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 0.5150 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 0.2270 -0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -0.5160 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.5950 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 0.8140 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -0.1670 0.8240 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3960 2.7290 -0.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 3.0460 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 1.9300 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 7 1 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 16 -1 M END