PUBCHEM-ZINC05117629 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3420 0.0090 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 1.3180 -0.3820 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.7470 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 0.8090 -0.0270 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1900 -0.2190 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 1.8890 -0.0270 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8270 -1.7560 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -2.1970 1.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8190 -1.4840 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -3.5830 1.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1000 -4.2960 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -4.0240 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -6.0510 2.8010 I 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -3.5300 0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -2.2500 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9650 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6600 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.4180 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -1.8000 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -3.3620 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -3.9800 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -2.9140 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.8660 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 M CHG 1 6 1 M CHG 1 8 -1 M END