PUBCHEM-ZINC02004445 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -1.5250 1.4890 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 0.0280 1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.6140 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -0.7260 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.1960 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.1980 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -2.7970 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -4.1860 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -4.9160 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -4.2530 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -2.9430 0.3160 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6750 -2.0380 -0.1340 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8400 1.9240 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8270 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 1.8040 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -0.7120 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -1.6020 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.0050 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -4.6800 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -5.9940 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.8240 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -2.5080 0.3900 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 4 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 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 12 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 M CHG 1 11 1 M CHG 1 12 -1 M END