PUBCHEM-ZINC05598967 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.1670 2.5210 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 1.1220 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 0.3850 0.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5100 0.9830 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.9640 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 0.1650 1.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 0.5770 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 1.0820 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 0.5690 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 1.0450 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 2.0320 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 2.5480 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 2.0750 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 0.5010 -3.6920 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3390 -0.3660 -3.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 0.9200 -4.7490 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7190 3.0460 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 3.0760 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 2.4360 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.2070 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 0.5670 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -1.4890 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.8000 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -1.5620 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 0.5500 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -0.2000 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 2.4000 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 3.3170 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 2.5770 1.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 3.3200 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END