PUBCHEM-ZINC03872751 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.0530 0.8630 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.4500 -0.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.7080 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 0.4490 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 1.4590 -0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 2.8790 -0.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1230 3.0370 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 3.5040 -1.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5800 4.3980 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 3.9260 -2.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3170 3.0720 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 4.3610 -1.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2130 4.1120 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 3.5960 0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 5.8410 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 6.0900 0.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 5.3450 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 4.9670 -3.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 4.7050 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 2.6340 -2.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 3.3520 -3.2310 P 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 4.0830 -2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 0.5800 0.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -2.6360 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -0.5610 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -1.7930 0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.9650 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -3.0690 0.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -0.5860 1.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.4320 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 6.1220 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 6.4880 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 0.3080 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 -1.4260 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 2.1950 -4.0350 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8970 4.2800 -4.0080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 23 25 2 0 0 0 0 24 26 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END