# GMTKN55, subset BHROT27
# Geometries, charges and spins extraced from GMTKN archive
"acetamide_RC": acetamide_RC.xyz
"acetamide_TS1": acetamide_TS1.xyz
"acetamide_TS2": acetamide_TS2.xyz
"bifuran_anti": bifuran_anti.xyz
"bifuran_syn": bifuran_syn.xyz
"bifuran_TS": bifuran_TS.xyz
"biphenyl": biphenyl.xyz
"biphenyl_TS": biphenyl_TS.xyz
"bithiophene_anti": bithiophene_anti.xyz
"bithiophene_syn": bithiophene_syn.xyz
"bithiophene_TS": bithiophene_TS.xyz
"butadiene_scis": butadiene_scis.xyz
"butadiene_strans": butadiene_strans.xyz
"butadiene_TS": butadiene_TS.xyz
"ethane_ecl": ethane_ecl.xyz
"ethane_st": ethane_st.xyz
"ethylthiourea_0": ethylthiourea_0.xyz
"ethylthiourea_180": ethylthiourea_180.xyz
"ethylthiourea_TS1": ethylthiourea_TS1.xyz
"ethylthiourea_TS2": ethylthiourea_TS2.xyz
"h2o2": h2o2.xyz
"h2o2_cis": h2o2_cis.xyz
"h2o2_trans": h2o2_trans.xyz
"h2s2": h2s2.xyz
"h2s2_cis": h2s2_cis.xyz
"h2s2_trans": h2s2_trans.xyz
"methanol_ecl": methanol_ecl.xyz
"methanol_st": methanol_st.xyz
"methylamine_ecl": methylamine_ecl.xyz
"methylamine_st": methylamine_st.xyz
"n2h4_ecl1": n2h4_ecl1.xyz
"n2h4_ecl2": n2h4_ecl2.xyz
"n2h4_st1": n2h4_st1.xyz
"nh2oh_ecl": nh2oh_ecl.xyz
"nh2oh_st1": nh2oh_st1.xyz
"nh2oh_st2": nh2oh_st2.xyz
"tmethane_0": tmethane_0.xyz
"tmethane_120": tmethane_120.xyz
"tmethane_180": tmethane_180.xyz
"tmethane_60": tmethane_60.xyz