# GMTKN55, subset HAL59
# Geometries, charges and spins extraced from GMTKN archive
"11_benF3-benA": 11_benF3-benA.xyz
"11_benF3-benAB": 11_benF3-benAB.xyz
"11_benF3-benB": 11_benF3-benB.xyz
"12_benF6-benA": 12_benF6-benA.xyz
"12_benF6-benAB": 12_benF6-benAB.xyz
"12_benF6-benB": 12_benF6-benB.xyz
"19_benCl-acetoneA": 19_benCl-acetoneA.xyz
"19_benCl-acetoneAB": 19_benCl-acetoneAB.xyz
"19_benCl-acetoneB": 19_benCl-acetoneB.xyz
"20_benBr-acetoneA": 20_benBr-acetoneA.xyz
"20_benBr-acetoneAB": 20_benBr-acetoneAB.xyz
"20_benBr-acetoneB": 20_benBr-acetoneB.xyz
"21_benI-acetoneA": 21_benI-acetoneA.xyz
"21_benI-acetoneAB": 21_benI-acetoneAB.xyz
"21_benI-acetoneB": 21_benI-acetoneB.xyz
"22_benCl-Nm3A": 22_benCl-Nm3A.xyz
"22_benCl-Nm3AB": 22_benCl-Nm3AB.xyz
"22_benCl-Nm3B": 22_benCl-Nm3B.xyz
"23_benBr-Nm3A": 23_benBr-Nm3A.xyz
"23_benBr-Nm3AB": 23_benBr-Nm3AB.xyz
"23_benBr-Nm3B": 23_benBr-Nm3B.xyz
"24_benI-Nm3A": 24_benI-Nm3A.xyz
"24_benI-Nm3AB": 24_benI-Nm3AB.xyz
"24_benI-Nm3B": 24_benI-Nm3B.xyz
"25_benBr-mSHA": 25_benBr-mSHA.xyz
"25_benBr-mSHAB": 25_benBr-mSHAB.xyz
"25_benBr-mSHB": 25_benBr-mSHB.xyz
"26_benI-mSHA": 26_benI-mSHA.xyz
"26_benI-mSHAB": 26_benI-mSHAB.xyz
"26_benI-mSHB": 26_benI-mSHB.xyz
"27_CH3Br-benA": 27_CH3Br-benA.xyz
"27_CH3Br-benAB": 27_CH3Br-benAB.xyz
"27_CH3Br-benB": 27_CH3Br-benB.xyz
"28_CH3I-benA": 28_CH3I-benA.xyz
"28_CH3I-benAB": 28_CH3I-benAB.xyz
"28_CH3I-benB": 28_CH3I-benB.xyz
"29_CF3Br-benA": 29_CF3Br-benA.xyz
"29_CF3Br-benAB": 29_CF3Br-benAB.xyz
"29_CF3Br-benB": 29_CF3Br-benB.xyz
"30_CF3I-benA": 30_CF3I-benA.xyz
"30_CF3I-benAB": 30_CF3I-benAB.xyz
"30_CF3I-benB": 30_CF3I-benB.xyz
"BrBr": BrBr.xyz
"BrBr_FCCH": BrBr_FCCH.xyz
"BrBr_FMe": BrBr_FMe.xyz
"BrBr_NCH": BrBr_NCH.xyz
"BrBr_NH3": BrBr_NH3.xyz
"BrBr_OCH2": BrBr_OCH2.xyz
"BrBr_OPH3": BrBr_OPH3.xyz
"BrBr_PCH": BrBr_PCH.xyz
"BrBr_pyr": BrBr_pyr.xyz
"F3CI": F3CI.xyz
"FBr": FBr.xyz
"FCCH": FCCH.xyz
"FCl": FCl.xyz
"FI": FI.xyz
"FI_FCCH": FI_FCCH.xyz
"FI_FMe": FI_FMe.xyz
"FI_NCH": FI_NCH.xyz
"FI_NH3": FI_NH3.xyz
"FI_OCH2": FI_OCH2.xyz
"FI_OPH3": FI_OPH3.xyz
"FI_PCH": FI_PCH.xyz
"FI_pyr": FI_pyr.xyz
"FMe": FMe.xyz
"MeI": MeI.xyz
"MeI_FCCH": MeI_FCCH.xyz
"MeI_FMe": MeI_FMe.xyz
"MeI_NCH": MeI_NCH.xyz
"MeI_NH3": MeI_NH3.xyz
"MeI_OCH2": MeI_OCH2.xyz
"MeI_OPH3": MeI_OPH3.xyz
"MeI_PCH": MeI_PCH.xyz
"MeI_pyr": MeI_pyr.xyz
"NBS": NBS.xyz
"NCH": NCH.xyz
"NCH_F3CI": NCH_F3CI.xyz
"NCH_FBr": NCH_FBr.xyz
"NCH_FCl": NCH_FCl.xyz
"NCH_NBS": NCH_NBS.xyz
"NCH_NIS": NCH_NIS.xyz
"NCH_PhBr": NCH_PhBr.xyz
"NCH_PhI": NCH_PhI.xyz
"NH3": NH3.xyz
"NH3_F3CI": NH3_F3CI.xyz
"NH3_FBr": NH3_FBr.xyz
"NH3_FCl": NH3_FCl.xyz
"NH3_NBS": NH3_NBS.xyz
"NH3_NIS": NH3_NIS.xyz
"NH3_PhBr": NH3_PhBr.xyz
"NH3_PhI": NH3_PhI.xyz
"NIS": NIS.xyz
"OCH2": OCH2.xyz
"OPH3": OPH3.xyz
"PCH": PCH.xyz
"PCH_F3CI": PCH_F3CI.xyz
"PCH_FBr": PCH_FBr.xyz
"PCH_FCl": PCH_FCl.xyz
"PCH_NBS": PCH_NBS.xyz
"PCH_NIS": PCH_NIS.xyz
"PCH_PhBr": PCH_PhBr.xyz
"PCH_PhI": PCH_PhI.xyz
"PhBr": PhBr.xyz
"PhI": PhI.xyz
"pyr": pyr.xyz