PUBCHEM-ZINC04520873 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.1810 1.4780 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.0310 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.5440 -0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.9040 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -2.7910 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -4.1350 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -4.5980 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -3.7180 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.3720 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -1.4290 0.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8540 -0.3160 0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -1.7670 -0.0860 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8210 1.8590 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 1.6800 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.9700 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.5240 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.2330 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 0.0620 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -2.4300 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.8260 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -5.6500 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -4.0830 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END