CHEMDIV-ZINC00214889 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.2500 1.2770 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.2390 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.6600 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.0130 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -2.8420 0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -2.3850 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.4780 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -2.1270 4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -3.8210 4.4260 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -3.7030 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -4.8270 2.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -6.1580 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -6.5820 3.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -7.1010 1.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0430 -6.6860 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -7.1290 1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -8.2510 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -9.2930 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -9.4630 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -8.5180 1.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3030 -8.9170 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -8.5880 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -7.5530 0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -1.5420 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.6690 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.6480 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 1.6750 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -0.6170 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.6230 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.3980 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -4.6270 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -7.2020 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -6.1790 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -8.2010 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -10.0700 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -10.5020 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -9.3240 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -1.8370 6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -1.8730 5.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -0.4480 5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -9.6880 1.5240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M CHG 1 41 -1 M END