PUBCHEM-ZINC05647637 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 0.0690 1.4630 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.1540 -1.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -0.2980 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 0.7810 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 1.9000 -0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 3.2900 -0.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5030 3.4490 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 3.6980 1.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0640 3.3640 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 5.2190 0.8900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7070 5.6610 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 5.3910 -0.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8430 6.2230 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 4.1850 -0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 5.5910 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 5.7710 -0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 5.0700 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 5.8340 2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 5.3500 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 3.3870 1.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2010 0.8790 0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -0.1140 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -0.0040 1.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -1.2820 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 -2.1030 -0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -1.7200 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.5850 -0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 2.1360 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 4.7170 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 6.4780 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 1.7750 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -0.8990 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -1.9390 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -3.0760 -0.1210 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 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 24 33 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 20 -1 M END