PUBCHEM-ZINC03091356 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.2320 1.3820 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 0.0010 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 0.0220 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 1.4030 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0880 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.4880 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 4.1480 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 3.5310 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 5.4920 -0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 6.1820 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 7.5730 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 8.2460 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 7.5020 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 6.1220 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 5.5080 -0.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 8.2960 -0.1110 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -0.7080 1.5170 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0140 -0.0920 2.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -1.9260 1.5140 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2280 -2.0300 0.0070 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.9130 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.5480 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 1.9500 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 3.9830 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 5.9780 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 8.1200 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 9.3250 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 5.5380 -0.1320 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 21 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END