PUBCHEM-ZINC05112939 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 31 0 0 1 0 0 0 0 0999 V2000 0.0820 1.5650 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.0480 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.4170 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 0.4080 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 1.9610 0.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5990 1.5300 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 3.4700 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 3.9350 0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 4.1890 1.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 5.6310 1.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2420 6.1450 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 5.8970 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 5.8850 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 6.6580 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 4.9640 3.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 4.9440 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 4.3050 3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 6.1820 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 5.2720 2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 1.9980 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.9930 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.4060 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.3700 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 3.7890 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 6.8870 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 5.1680 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -1.5990 -0.2590 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6900 7.4340 1.9670 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5230 1.3870 -0.3340 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2670 1.4620 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 0.4080 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 1.9700 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 24 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 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M CHG 1 29 1 M END