PUBCHEM-ZINC05834516 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1520 1.1910 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.1040 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -1.0050 0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.4230 0.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6040 -0.0590 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 0.7030 -0.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3950 0.2940 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 1.7750 -0.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8070 2.4810 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 2.5430 -1.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 1.2770 -0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 2.0580 -1.6550 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 2.6870 -1.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 1.0040 -2.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -1.4660 0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.6770 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 0.1410 1.0470 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6980 1.8650 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 2.8600 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -2.1190 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 3.0000 -2.0360 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.8940 1.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 21 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 M CHG 1 17 -1 M CHG 1 21 -1 M END