debug db2 62 mol2 7 smi 616578

FAIL FGADLO.xaa.db2.gz 7584

FAIL FGADLO.xab.db2.gz 7597

FAIL FGADLO.xac.db2.gz 7598

FAIL FGADLO.xad.db2.gz 7658

FAIL FGADLO.xae.db2.gz 7435

FAIL FGADLO.xaf.db2.gz 7358

FAIL FGADLO.xag.db2.gz 7570

FAIL FGADLO.xah.db2.gz 7447

FAIL FGADLO.xai.db2.gz 7575

FAIL FGADLO.xaj.db2.gz 7885

FAIL FGADLO.xak.db2.gz 7829

FAIL FGADLO.xal.db2.gz 7858

FAIL FGADLO.xam.db2.gz 7713

FAIL FGADLO.xan.db2.gz 7446

FAIL FGADLO.xao.db2.gz 7412

FAIL FGADLO.xap.db2.gz 7374

FAIL FGADLO.xaq.db2.gz 7478

FAIL FGADLO.xar.db2.gz 7632

FAIL FGADLO.xas.db2.gz 7475

FAIL FGADLO.xat.db2.gz 7816

FAIL FGADLO.xau.db2.gz 7802

FAIL FGADLO.xav.db2.gz 7579

FAIL FGADLO.xaw.db2.gz 7463

FAIL FGADLO.xax.db2.gz 7466

FAIL FGADLO.xay.db2.gz 7595

FAIL FGADLO.xaz.db2.gz 7753

FAIL FGADLO.xba.db2.gz 7616

FAIL FGADLO.xbb.db2.gz 7932

FAIL FGADLO.xbc.db2.gz 7703

FAIL FGADLO.xbd.db2.gz 7824

FAIL FGADLO.xbe.db2.gz 7885

FAIL FGADLO.xbf.db2.gz 7791

FAIL FGADLO.xbg.db2.gz 7920

FAIL FGADLO.xbh.db2.gz 7657

FAIL FGADLO.xbi.db2.gz 7653

FAIL FGADLO.xbj.db2.gz 7699

FAIL FGADLO.xbk.db2.gz 7485

FAIL FGADLO.xbl.db2.gz 7534

FAIL FGADLO.xbm.db2.gz 7665

FAIL FGADLO.xbn.db2.gz 7628

FAIL FGADLO.xbo.db2.gz 7592

FAIL FGADLO.xbp.db2.gz 7293

FAIL FGADLO.xbq.db2.gz 7535

FAIL FGADLO.xbr.db2.gz 7430

FAIL FGADLO.xbs.db2.gz 7303

FAIL FGADLO.xbt.db2.gz 7421

FAIL FGADLO.xbu.db2.gz 7560

FAIL FGADLO.xbv.db2.gz 7711

FAIL FGADLO.xbw.db2.gz 7721

FAIL FGADLO.xbx.db2.gz 7619

FAIL FGADLO.xby.db2.gz 7700

FAIL FGADLO.xbz.db2.gz 7920

FAIL FGADLO.xca.db2.gz 7540

FAIL FGADLO.xcb.db2.gz 7601

FAIL FGADLO.xcc.db2.gz 7256

FAIL FGADLO.xcd.db2.gz 7359

FAIL FGADLO.xce.db2.gz 7385

FAIL FGADLO.xcf.db2.gz 7562

FAIL FGADLO.xcg.db2.gz 7534

FAIL FGADLO.xch.db2.gz 7563

FAIL FGADLO.xci.db2.gz 7576

FAIL FGADLO.xcj.db2.gz 468688 numsmi is 616578


FAIL FGADLO.xaa.mol2.gz 75701 numsmi is 616578

FAIL FGADLO.xab.mol2.gz 151729 numsmi is 616578

FAIL FGADLO.xac.mol2.gz 228452 numsmi is 616578

FAIL FGADLO.xad.mol2.gz 305361 numsmi is 616578

FAIL FGADLO.xae.mol2.gz 380535 numsmi is 616578

FAIL FGADLO.xaf.mol2.gz 455944 numsmi is 616578
FAIL FGADLO.xag.mol2.gz 468636 numsmi is 616578