PUBCHEM-ZINC05999168 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0460 1.1870 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.1820 -0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.6940 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 0.0520 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -0.5400 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -1.8870 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -2.6390 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -2.0580 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.7270 0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -4.1570 0.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7970 -4.4090 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -4.6550 0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9060 -4.2570 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -6.1860 0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8700 -6.5790 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -6.7700 1.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1510 -6.5120 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -6.2040 1.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3850 -6.4590 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -4.7770 1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -6.8380 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -6.1820 2.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -8.1980 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -8.4650 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -6.6100 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -7.5620 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -4.1940 -1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -4.6670 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 0.2920 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 -0.1540 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 0.7860 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 1.9720 0.2170 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1020 1.4210 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.3750 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 1.8390 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 1.1050 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -2.3700 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -3.6730 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 1.3500 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -1.1930 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -8.0010 2.8410 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.4410 0.2500 -0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 29 39 1 0 0 0 0 30 31 1 0 0 0 0 30 40 1 0 0 0 0 31 32 1 0 0 0 0 31 42 2 0 0 0 0 M CHG 1 32 -1 M CHG 1 41 -1 M END