PUBCHEM-ZINC02128228 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.2800 1.6720 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 0.4870 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -0.2050 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -1.3760 1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -2.5930 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -2.7680 0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -3.6280 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -4.9480 1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -5.6750 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -6.8270 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -7.2280 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -6.3140 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -5.3870 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -6.1530 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -4.9370 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -4.7870 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -5.8470 -4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -7.0610 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -7.2110 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -5.6810 -6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -4.5310 -6.8230 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3810 -2.8730 2.8910 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -1.3090 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -0.3440 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 2.2120 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 2.1220 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.0150 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.5070 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 0.4590 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -5.5470 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -7.3220 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -8.0820 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -4.0870 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -3.8310 -4.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -7.9000 -4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -8.1750 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -6.6970 -6.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 23 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 21 -1 M END