PUBCHEM-ZINC05131975 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 25 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5880 -0.3550 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.5330 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8460 -0.2450 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -2.0580 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0020 -2.3460 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -2.5870 -0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4370 -2.2360 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -4.0940 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -4.6980 -1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -2.1120 -1.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -2.6120 -1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 0.0200 0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.4790 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.0330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 2.6880 -0.8430 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0570 3.3440 -1.6860 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -2.3870 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -2.3950 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.1960 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.2050 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -4.7660 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -5.7310 0.9130 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 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 17 18 2 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 17 1 M CHG 1 18 -1 M END