PUBCHEM-ZINC05843340 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.1030 1.7440 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.3540 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -0.1700 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.8250 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 1.9990 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 3.3180 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 3.4280 0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 4.7470 0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0380 5.5210 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 5.0400 -1.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2530 5.9600 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 5.1950 -0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 5.0290 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 5.1070 1.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 4.7710 1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 3.8680 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 5.1390 -4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 5.4890 -5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 4.2890 -6.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 3.3400 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 2.9680 -4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -1.6060 -0.2930 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3840 -2.4270 -0.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.9670 -0.4350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8900 2.4700 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.1920 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 4.2000 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 4.6240 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 2.9740 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 3.6900 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 6.0440 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 4.6880 -4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 6.1500 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 5.9890 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 2.4460 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 3.7780 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 2.4810 -4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 2.2880 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 4.1870 -3.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END