PUBCHEM-ZINC02048485 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.1300 1.5800 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 0.0510 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.6060 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 0.1470 -0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 2.1970 0.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0250 1.8090 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 3.7330 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 4.3890 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.9250 -1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 0.8790 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 0.0560 -0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 0.8430 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -0.0540 -2.6060 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.9300 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.9390 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.3340 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.3010 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 2.6280 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 0.5650 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 1.8300 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -1.8530 0.0720 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 4.1390 1.3780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 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 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END