PUBCHEM-ZINC03870898 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 2.1650 0.4300 -4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -0.9820 -4.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -1.4050 -3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -0.4900 -2.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 0.8780 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 1.3210 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 1.5310 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 0.5530 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -0.6890 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -1.9020 -0.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -3.1170 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -4.3100 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -4.4140 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -3.8730 1.8220 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -4.4210 1.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -2.3690 1.6600 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7230 -5.5690 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -6.6720 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -7.8730 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -7.9730 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -8.8930 1.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.0820 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -3.5690 -1.6620 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7510 0.7800 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 1.9010 1.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 0.7450 -5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -1.6710 -5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -2.4460 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 2.3740 -3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 2.5990 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -1.9770 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 -5.4290 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -3.7790 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -5.5870 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -6.7140 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -8.8400 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -9.7510 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -0.1180 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -2.5790 0.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 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 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 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 10 31 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 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 2 0 0 0 0 19 21 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 39 2 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 16 -1 M CHG 1 23 -1 M END