PUBCHEM-ZINC01585952 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.7400 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1360 -0.0200 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -1.6250 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -2.2480 1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -3.4910 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -3.6620 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -2.5540 1.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.7000 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -0.3560 2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9960 0.3580 2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 0.0360 2.8180 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3930 -1.5540 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -1.0160 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -2.4000 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -4.1980 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -4.5390 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.2180 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 22 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END