PUBCHEM-ZINC05685715 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 0.4450 1.7670 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 0.2850 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -0.1480 1.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -1.4600 1.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -2.0540 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -1.5010 3.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -3.4950 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -4.0050 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -5.3490 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -6.1970 2.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -5.6760 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -4.3460 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.5660 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.3870 -1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -2.1940 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -2.1770 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -1.3570 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.5420 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 0.2930 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 0.4090 -0.6070 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4340 2.0910 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 2.0160 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.3050 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.9600 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.3700 4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -5.7950 4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -6.3830 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -4.0180 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -1.3900 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -2.8250 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -2.7980 -4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -1.3510 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 0.7960 -2.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 2 0 0 0 0 M CHG 1 20 -1 M END