PUBCHEM-ZINC05141091 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 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 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.0970 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.5450 -1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -3.8860 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.7520 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -6.1160 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -6.6200 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -5.7630 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -4.3930 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -3.5220 -1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -7.0380 -0.6860 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1830 -6.5960 -0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -8.2400 -0.6220 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 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -2.5280 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.4120 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -4.3610 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -7.6860 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -6.1590 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -2.5650 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -3.8770 -1.2860 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 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 26 1 0 0 0 0 12 27 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