PUBCHEM-ZINC04521444 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.3190 1.4930 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 0.0080 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.7760 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -0.1770 1.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1030 0.4220 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -1.6310 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -2.2460 1.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.2460 1.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 0.2540 1.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 1.5220 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 2.5690 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 3.8200 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 4.0310 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 2.9910 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.7370 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 0.7230 3.6840 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 5.3740 3.2830 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9460 6.2900 2.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 5.5610 4.4600 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7550 2.3460 -0.6360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0600 3.2860 -1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 1.2210 -1.1010 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6950 1.8900 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 1.6140 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 2.0340 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.3600 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -0.4790 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -1.8430 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.5640 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -1.7530 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -3.1820 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -0.4200 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 4.6350 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 3.1590 4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M END