PUBCHEM-ZINC06073072 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 1.8240 3.2420 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.8030 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 0.8480 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -0.5180 2.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -1.4850 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -1.2010 4.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -2.9260 2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -3.7810 3.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -4.0730 4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -3.6580 5.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -4.9380 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -5.3980 7.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -5.1840 7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -5.4240 6.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -5.2210 6.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -4.7790 8.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -4.5380 9.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -4.7430 8.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -4.4910 9.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0440 -4.2040 10.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -4.5700 9.3820 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9600 -5.2420 5.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -4.2750 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -4.0180 2.3250 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 3.3390 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 3.9230 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 3.4880 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 1.7060 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 1.5570 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 0.9450 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 1.0940 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -3.0550 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -3.2040 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -5.9220 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -5.7690 5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -5.4060 6.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -4.6210 8.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -4.1930 10.1070 H 0 0 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 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 34 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END