PUBCHEM-ZINC05159565 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.8060 1.6060 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 0.1260 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -0.7520 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.1440 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -2.5930 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -1.6300 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.2990 -1.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -4.0310 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -4.2970 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -5.7470 -1.0240 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -6.7380 -1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.1220 1.9280 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0010 -4.1600 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -2.9000 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -1.8760 2.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -3.8610 1.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -3.8340 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -4.6920 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.2140 2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 1.9730 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 2.1340 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 1.8500 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -1.9190 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -4.7090 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -4.1990 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.7260 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -5.8800 -2.0300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6410 -5.5590 0.4180 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6380 -2.9590 3.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -3.1080 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.9860 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 26 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M END