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Name		Name	Last commit message	Last commit date
parent directory ..
cli24_KB		cli24_KB
cli24_out_tmpl_0		cli24_out_tmpl_0
cli24_out_tmpl_1		cli24_out_tmpl_1
cli24_out_tmpl_2		cli24_out_tmpl_2
cli34_data		cli34_data
cli36_wdir		cli36_wdir
cli40_out_tmpl_0		cli40_out_tmpl_0
cli40_out_tmpl_1		cli40_out_tmpl_1
cli40_out_tmpl_2		cli40_out_tmpl_2
cli41_KB		cli41_KB
cli41_out_tmpl_0		cli41_out_tmpl_0
cli41_out_tmpl_1		cli41_out_tmpl_1
cli41_out_tmpl_2		cli41_out_tmpl_2
cli42_KB		cli42_KB
cli42_out_tmpl_0		cli42_out_tmpl_0
cli42_out_tmpl_1		cli42_out_tmpl_1
cli43_KB		cli43_KB
cli43_out_tmpl_0		cli43_out_tmpl_0
cli43_out_tmpl_1		cli43_out_tmpl_1
cli44_KB		cli44_KB
cli44_out_tmpl_0		cli44_out_tmpl_0
cli44_out_tmpl_1		cli44_out_tmpl_1
cli47_KB		cli47_KB
cli47_out_tmpl_0		cli47_out_tmpl_0
cli47_out_tmpl_1		cli47_out_tmpl_1
cli47_out_tmpl_2		cli47_out_tmpl_2
cli48_KB		cli48_KB
cli48_out_tmpl_0		cli48_out_tmpl_0
cli48_out_tmpl_1		cli48_out_tmpl_1
cli48_out_tmpl_2		cli48_out_tmpl_2
cli48_out_tmpl_3		cli48_out_tmpl_3
cli48_out_tmpl_4		cli48_out_tmpl_4
cli49_data		cli49_data
data		data
t11_KB		t11_KB
t124_KB		t124_KB
t153.spardir		t153.spardir
t154-xtb		t154-xtb
t155-xtb		t155-xtb
t156-out.spardir		t156-out.spardir
t168_data		t168_data
t1_KB		t1_KB
t71.spartan		t71.spartan
t72.spartan		t72.spartan
t81.Conf.mol.spardir		t81.Conf.mol.spardir
t82-models		t82-models
cli0.check		cli0.check
cli0.sh		cli0.sh
cli1.check		cli1.check
cli1.sh		cli1.sh
cli10-mol.sdf		cli10-mol.sdf
cli10.check		cli10.check
cli10.sh		cli10.sh
cli11.check		cli11.check
cli11.sh		cli11.sh
cli12.check		cli12.check
cli12.sh		cli12.sh
cli12_log4j2.xml		cli12_log4j2.xml
cli13-mol.sdf		cli13-mol.sdf
cli13.check		cli13.check
cli13.json		cli13.json
cli13.sh		cli13.sh
cli14-mol.sdf		cli14-mol.sdf
cli14.check		cli14.check
cli14.params		cli14.params
cli14.sh		cli14.sh
cli15-a.json		cli15-a.json
cli15-mol.sdf		cli15-mol.sdf
cli15.check		cli15.check
cli15.sh		cli15.sh
cli16-g16.json		cli16-g16.json
cli16-mol.xyz		cli16-mol.xyz
cli16-ref.sdf		cli16-ref.sdf
cli16.check		cli16.check
cli16.json		cli16.json
cli16.sh		cli16.sh
cli17-crtMove		cli17-crtMove
cli17-mol.sdf		cli17-mol.sdf
cli17.check		cli17.check
cli17.sh		cli17.sh
cli18.check		cli18.check
cli18.par		cli18.par
cli18.sh		cli18.sh
cli19-mol.sdf		cli19-mol.sdf
cli19.check		cli19.check
cli19.json		cli19.json
cli19.sh		cli19.sh
cli2.check		cli2.check
cli2.sdf		cli2.sdf
cli2.sh		cli2.sh
cli20-mol.xyz		cli20-mol.xyz
cli20.check		cli20.check
cli20.sh		cli20.sh
cli21-mol.sdf		cli21-mol.sdf
cli21.check		cli21.check
cli21.sh		cli21.sh
cli22-mol.sdf		cli22-mol.sdf
cli22-xtb.out		cli22-xtb.out
cli22.check		cli22.check
cli22.json		cli22.json
View all files