PUBCHEM-ZINC00336983 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 1 0 0 0 0 0999 V2000 -0.1610 1.0940 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.2830 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.8660 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -0.0720 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 1.3050 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.8880 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6300 -1.7230 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -0.7430 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 0.3650 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 0.3210 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -0.8400 3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 -1.9080 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 -1.8300 2.0920 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4540 -2.9430 1.5520 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5710 0.0570 -0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 1.5490 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.9040 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -1.9420 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 1.9260 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 2.9640 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 1.2530 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 1.1720 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -0.9080 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -2.8160 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 0.9740 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 16 26 1 0 0 0 0 M CHG 1 14 1 M CHG 1 15 -1 M END