PUBCHEM-ZINC05424658 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 0.1680 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.4220 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -1.8150 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.6000 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.9880 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.9130 -2.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -4.7010 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -3.8980 -3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -2.6720 -4.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -5.1020 -4.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3570 -6.2110 -4.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -4.9840 -5.5570 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 1.2450 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.1890 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.5860 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END