PUBCHEM-ZINC00613989 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0100 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3950 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 4.1980 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 5.5530 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 6.2700 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 7.6360 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 8.3270 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 7.6410 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 6.2530 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 5.4400 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 5.8510 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 4.1980 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 9.6860 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1630 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1700 -2.7810 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -2.7630 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5200 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 1.9390 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 5.7490 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 8.1880 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 8.1780 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 10.1150 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END