#===============================================================================
# W4-17 data set
# Amir Karton, Nitai Sylvetsky, Jan M. L. Martin
# DOI: 10.1002/jcc.24854
#===============================================================================

"acetaldehyde": acetaldehyde.xyz
"acetic": acetic.xyz
"alcl3": alcl3.xyz
"alcl": alcl.xyz
"alf3": alf3.xyz
"alf": alf.xyz
"alh3": alh3.xyz
"alh": alh.xyz
"allene": allene.xyz
"allyl": allyl.xyz
"b2h6": b2h6.xyz
"benzene": benzene.xyz
"beta-lactim": beta-lactim.xyz
"bf3": bf3.xyz
"bf": bf.xyz
"bh3": bh3.xyz
"bhf2": bhf2.xyz
"bh": bh.xyz
"bn3pi": bn3pi.xyz
"borole": borole.xyz
"c2cl2": c2cl2.xyz
"c2cl4": c2cl4.xyz
"c2cl6": c2cl6.xyz
"c2clh3": c2clh3.xyz
"c2clh5": c2clh5.xyz
"c2clh": c2clh.xyz
"c2f4": c2f4.xyz
"c2f6": c2f6.xyz
"c2h2": c2h2.xyz
"c2h3f": c2h3f.xyz
"c2h4": c2h4.xyz
"c2h5f": c2h5f.xyz
"c2h6": c2h6.xyz
"cch": cch.xyz
"ccl2h2": ccl2h2.xyz
"ccl2o": ccl2o.xyz
"ccl2": ccl2.xyz
"ccl3h": ccl3h.xyz
"ccl4": ccl4.xyz
"cclh3": cclh3.xyz
"cf2cl2": cf2cl2.xyz
"cf2": cf2.xyz
"cf4": cf4.xyz
"cf": cf.xyz
"ch2ch": ch2ch.xyz
"ch2clf": ch2clf.xyz
"ch2c": ch2c.xyz
"ch2f2": ch2f2.xyz
"ch2nh2": ch2nh2.xyz
"ch2nh": ch2nh.xyz
"ch2-sing": ch2-sing.xyz
"ch2-trip": ch2-trip.xyz
"ch3f": ch3f.xyz
"ch3nh2": ch3nh2.xyz
"ch3nh": ch3nh.xyz
"ch3ph2": ch3ph2.xyz
"ch3": ch3.xyz
"ch4": ch4.xyz
"c-hcoh": c-hcoh.xyz
"chf3": chf3.xyz
"c-hono": c-hono.xyz
"c-hooo": c-hooo.xyz
"ch": ch.xyz
"cis-c2f2cl2": cis-c2f2cl2.xyz
"cl2": cl2.xyz
"clcn": clcn.xyz
"clcof": clcof.xyz
"clf": clf.xyz
"clno": clno.xyz
"clo": clo.xyz
"c-n2h2": c-n2h2.xyz
"cn": cn.xyz
"co2": co2.xyz
"co": co.xyz
"cs2": cs2.xyz
"cs": cs.xyz
"cyclobutadiene": cyclobutadiene.xyz
"cyclobutane": cyclobutane.xyz
"cyclobutene": cyclobutene.xyz
"cyclopentadiene": cyclopentadiene.xyz
"cyclopropane": cyclopropane.xyz
"cyclopropene": cyclopropene.xyz
"cyclopropyl": cyclopropyl.xyz
"dioxetan2one": dioxetan2one.xyz
"dioxetane": dioxetane.xyz
"dioxirane": dioxirane.xyz
"dithiotane": dithiotane.xyz
"ethanol": ethanol.xyz
"f2co": f2co.xyz
"f2": f2.xyz
"fccf": fccf.xyz
"fno": fno.xyz
"formamide": formamide.xyz
"formic-anhydride": formic-anhydride.xyz
"formic": formic.xyz
"furan": furan.xyz
"glyoxal": glyoxal.xyz
"h2ccn": h2ccn.xyz
"h2cn": h2cn.xyz
"h2co": h2co.xyz
"h2no": h2no.xyz
"h2o": h2o.xyz
"h2s": h2s.xyz
"h2": h2.xyz
"hccf": hccf.xyz
"hclo4": hclo4.xyz
"hcl": hcl.xyz
"hcnh": hcnh.xyz
"hcno": hcno.xyz
"hcn": hcn.xyz
"hcof": hcof.xyz
"hco": hco.xyz
"hf": hf.xyz
"hnco": hnco.xyz
"hnc": hnc.xyz
"hnnn": hnnn.xyz
"hno": hno.xyz
"hoclo2": hoclo2.xyz
"hoclo": hoclo.xyz
"hocl": hocl.xyz
"hocn": hocn.xyz
"hof": hof.xyz
"honc": honc.xyz
"hooh": hooh.xyz
"hoo": hoo.xyz
"hs": hs.xyz
"ketene": ketene.xyz
"methanol": methanol.xyz
"n2h4": n2h4.xyz
"n2h": n2h.xyz
"n2o4": n2o4.xyz
"n2o": n2o.xyz
"n2": n2.xyz
"n-butane": n-butane.xyz
"nccn": nccn.xyz
"nh2cl": nh2cl.xyz
"nh2f": nh2f.xyz
"nh2oh": nh2oh.xyz
"nh2": nh2.xyz
"nh3": nh3.xyz
"nh": nh.xyz
"no2": no2.xyz
"no": no.xyz
"n-pentane": n-pentane.xyz
"o2": o2.xyz
"ocs": ocs.xyz
"oh": oh.xyz
"oxadiazole": oxadiazole.xyz
"oxetane": oxetane.xyz
"oxirane": oxirane.xyz
"oxirene": oxirene.xyz
"p2": p2.xyz
"p4": p4.xyz
"pf3": pf3.xyz
"pf5": pf5.xyz
"ph3": ph3.xyz
"propane": propane.xyz
"propene": propene.xyz
"propyne": propyne.xyz
"pyrrole": pyrrole.xyz
"s2o": s2o.xyz
"s2": s2.xyz
"sf6": sf6.xyz
"si2h6": si2h6.xyz
"sif4": sif4.xyz
"sif": sif.xyz
"sih3f": sih3f.xyz
"sih4": sih4.xyz
"sih": sih.xyz
"silole": silole.xyz
"sio": sio.xyz
"so2": so2.xyz
"so3": so3.xyz
"so": so.xyz
"ssh": ssh.xyz
"t-butadiene": t-butadiene.xyz
"tetrahedrane": tetrahedrane.xyz
"t-hcoh": t-hcoh.xyz
"thiophene": thiophene.xyz
"t-hono": t-hono.xyz
"t-hooo": t-hooo.xyz
"t-n2h2": t-n2h2.xyz
"trans-c2f2cl2": trans-c2f2cl2.xyz
# Multireference subset
"b2": mr_b2.xyz
"bn": mr_bn.xyz
"c2": mr_c2.xyz
"cl2o": mr_cl2o.xyz
"clf3": mr_clf3.xyz
"clf5": mr_clf5.xyz
"clo3": mr_clo3.xyz
"cloocl": mr_cloocl.xyz
"cloo": mr_cloo.xyz
"f2o": mr_f2o.xyz
"fo2": mr_fo2.xyz
"foof": mr_foof.xyz
"o3": mr_o3.xyz
"oclo": mr_oclo.xyz
"of": mr_of.xyz
"s3": mr_s3.xyz
"s4-c2v": mr_s4-c2v.xyz