PUBCHEM-ZINC05409913 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 0 0 0 0 0 0999 V2000 -0.0610 1.2770 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0280 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -0.9190 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -2.2220 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -3.1540 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -2.6390 -0.1510 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0510 2.1690 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.4810 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 4.3110 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 5.6210 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 6.6430 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 6.2350 -0.4310 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9550 1.6890 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.4600 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -0.4990 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.6680 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7150 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 3.9780 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 3.8230 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 6.0730 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -4.3500 -1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 7.8080 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 21 2 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 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 22 2 0 0 0 0 M CHG 1 6 -1 M CHG 1 12 -1 M END