# geometries for the R160x10 data set
C2H2_p_C2H2_p_1.00: C2H2_p_C2H2_p_1.00.xyz
C2H2_p_C2H2_p_1.05: C2H2_p_C2H2_p_1.05.xyz
C2H2_p_C2H2_p_1.10: C2H2_p_C2H2_p_1.10.xyz
C2H2_p_C2H2_p_1.15: C2H2_p_C2H2_p_1.15.xyz
C2H2_p_C2H2_p_1.25: C2H2_p_C2H2_p_1.25.xyz
C2H2_p_C2H2_p_1.65: C2H2_p_C2H2_p_1.65.xyz
C2H2_p_C2H2_a_1.00: C2H2_p_C2H2_a_1.00.xyz
C2H2_p_C2H2_a_1.05: C2H2_p_C2H2_a_1.05.xyz
C2H2_p_C2H2_a_1.10: C2H2_p_C2H2_a_1.10.xyz
C2H2_p_C2H2_a_1.15: C2H2_p_C2H2_a_1.15.xyz
C2H2_p_C2H2_a_1.25: C2H2_p_C2H2_a_1.25.xyz
C2H2_p_C2H2_a_1.65: C2H2_p_C2H2_a_1.65.xyz
C2H2_p_NH3_l_1.00: C2H2_p_NH3_l_1.00.xyz
C2H2_p_NH3_l_1.05: C2H2_p_NH3_l_1.05.xyz
C2H2_p_NH3_l_1.10: C2H2_p_NH3_l_1.10.xyz
C2H2_p_NH3_l_1.15: C2H2_p_NH3_l_1.15.xyz
C2H2_p_NH3_l_1.25: C2H2_p_NH3_l_1.25.xyz
C2H2_p_NH3_l_1.65: C2H2_p_NH3_l_1.65.xyz
C2H2_p_benzene_p_1.00: C2H2_p_benzene_p_1.00.xyz
C2H2_p_benzene_p_1.05: C2H2_p_benzene_p_1.05.xyz
C2H2_p_benzene_p_1.10: C2H2_p_benzene_p_1.10.xyz
C2H2_p_benzene_p_1.15: C2H2_p_benzene_p_1.15.xyz
C2H2_p_benzene_p_1.25: C2H2_p_benzene_p_1.25.xyz
C2H2_p_benzene_p_1.65: C2H2_p_benzene_p_1.65.xyz
C2H2_p_C2H4_p_1.00: C2H2_p_C2H4_p_1.00.xyz
C2H2_p_C2H4_p_1.05: C2H2_p_C2H4_p_1.05.xyz
C2H2_p_C2H4_p_1.10: C2H2_p_C2H4_p_1.10.xyz
C2H2_p_C2H4_p_1.15: C2H2_p_C2H4_p_1.15.xyz
C2H2_p_C2H4_p_1.25: C2H2_p_C2H4_p_1.25.xyz
C2H2_p_C2H4_p_1.65: C2H2_p_C2H4_p_1.65.xyz
C2H2_p_C2H4_a_1.00: C2H2_p_C2H4_a_1.00.xyz
C2H2_p_C2H4_a_1.05: C2H2_p_C2H4_a_1.05.xyz
C2H2_p_C2H4_a_1.10: C2H2_p_C2H4_a_1.10.xyz
C2H2_p_C2H4_a_1.15: C2H2_p_C2H4_a_1.15.xyz
C2H2_p_C2H4_a_1.25: C2H2_p_C2H4_a_1.25.xyz
C2H2_p_C2H4_a_1.65: C2H2_p_C2H4_a_1.65.xyz
C2H2_p_HCHO_c_p_1.00: C2H2_p_HCHO_c_p_1.00.xyz
C2H2_p_HCHO_c_p_1.05: C2H2_p_HCHO_c_p_1.05.xyz
C2H2_p_HCHO_c_p_1.10: C2H2_p_HCHO_c_p_1.10.xyz
C2H2_p_HCHO_c_p_1.15: C2H2_p_HCHO_c_p_1.15.xyz
C2H2_p_HCHO_c_p_1.25: C2H2_p_HCHO_c_p_1.25.xyz
C2H2_p_HCHO_c_p_1.65: C2H2_p_HCHO_c_p_1.65.xyz
C2H2_p_CH4_l_1.00: C2H2_p_CH4_l_1.00.xyz
C2H2_p_CH4_l_1.05: C2H2_p_CH4_l_1.05.xyz
C2H2_p_CH4_l_1.10: C2H2_p_CH4_l_1.10.xyz
C2H2_p_CH4_l_1.15: C2H2_p_CH4_l_1.15.xyz
C2H2_p_CH4_l_1.25: C2H2_p_CH4_l_1.25.xyz
C2H2_p_CH4_l_1.65: C2H2_p_CH4_l_1.65.xyz
C2H2_p_water_l_1.00: C2H2_p_water_l_1.00.xyz
C2H2_p_water_l_1.05: C2H2_p_water_l_1.05.xyz
C2H2_p_water_l_1.10: C2H2_p_water_l_1.10.xyz
C2H2_p_water_l_1.15: C2H2_p_water_l_1.15.xyz
C2H2_p_water_l_1.25: C2H2_p_water_l_1.25.xyz
C2H2_p_water_l_1.65: C2H2_p_water_l_1.65.xyz
C2H2_a_C2H2_a_1.00: C2H2_a_C2H2_a_1.00.xyz
C2H2_a_C2H2_a_1.05: C2H2_a_C2H2_a_1.05.xyz
C2H2_a_C2H2_a_1.10: C2H2_a_C2H2_a_1.10.xyz
C2H2_a_C2H2_a_1.15: C2H2_a_C2H2_a_1.15.xyz
C2H2_a_C2H2_a_1.25: C2H2_a_C2H2_a_1.25.xyz
C2H2_a_C2H2_a_1.65: C2H2_a_C2H2_a_1.65.xyz
C2H2_a_NH3_l_1.00: C2H2_a_NH3_l_1.00.xyz
C2H2_a_NH3_l_1.05: C2H2_a_NH3_l_1.05.xyz
C2H2_a_NH3_l_1.10: C2H2_a_NH3_l_1.10.xyz
C2H2_a_NH3_l_1.15: C2H2_a_NH3_l_1.15.xyz
C2H2_a_NH3_l_1.25: C2H2_a_NH3_l_1.25.xyz
C2H2_a_NH3_l_1.65: C2H2_a_NH3_l_1.65.xyz
C2H2_a_benzene_p_1.00: C2H2_a_benzene_p_1.00.xyz
C2H2_a_benzene_p_1.05: C2H2_a_benzene_p_1.05.xyz
C2H2_a_benzene_p_1.10: C2H2_a_benzene_p_1.10.xyz
C2H2_a_benzene_p_1.15: C2H2_a_benzene_p_1.15.xyz
C2H2_a_benzene_p_1.25: C2H2_a_benzene_p_1.25.xyz
C2H2_a_benzene_p_1.65: C2H2_a_benzene_p_1.65.xyz
C2H2_a_C2H4_p_1.00: C2H2_a_C2H4_p_1.00.xyz
C2H2_a_C2H4_p_1.05: C2H2_a_C2H4_p_1.05.xyz
C2H2_a_C2H4_p_1.10: C2H2_a_C2H4_p_1.10.xyz
C2H2_a_C2H4_p_1.15: C2H2_a_C2H4_p_1.15.xyz
C2H2_a_C2H4_p_1.25: C2H2_a_C2H4_p_1.25.xyz
C2H2_a_C2H4_p_1.65: C2H2_a_C2H4_p_1.65.xyz
C2H2_a_C2H4_a_1.00: C2H2_a_C2H4_a_1.00.xyz
C2H2_a_C2H4_a_1.05: C2H2_a_C2H4_a_1.05.xyz
C2H2_a_C2H4_a_1.10: C2H2_a_C2H4_a_1.10.xyz
C2H2_a_C2H4_a_1.15: C2H2_a_C2H4_a_1.15.xyz
C2H2_a_C2H4_a_1.25: C2H2_a_C2H4_a_1.25.xyz
C2H2_a_C2H4_a_1.65: C2H2_a_C2H4_a_1.65.xyz
C2H2_a_HCHO_c_p_1.00: C2H2_a_HCHO_c_p_1.00.xyz
C2H2_a_HCHO_c_p_1.05: C2H2_a_HCHO_c_p_1.05.xyz
C2H2_a_HCHO_c_p_1.10: C2H2_a_HCHO_c_p_1.10.xyz
C2H2_a_HCHO_c_p_1.15: C2H2_a_HCHO_c_p_1.15.xyz
C2H2_a_HCHO_c_p_1.25: C2H2_a_HCHO_c_p_1.25.xyz
C2H2_a_HCHO_c_p_1.65: C2H2_a_HCHO_c_p_1.65.xyz
C2H2_a_CH4_l_1.00: C2H2_a_CH4_l_1.00.xyz
C2H2_a_CH4_l_1.05: C2H2_a_CH4_l_1.05.xyz
C2H2_a_CH4_l_1.10: C2H2_a_CH4_l_1.10.xyz
C2H2_a_CH4_l_1.15: C2H2_a_CH4_l_1.15.xyz
C2H2_a_CH4_l_1.25: C2H2_a_CH4_l_1.25.xyz
C2H2_a_CH4_l_1.65: C2H2_a_CH4_l_1.65.xyz
C2H2_a_water_l_1.00: C2H2_a_water_l_1.00.xyz
C2H2_a_water_l_1.05: C2H2_a_water_l_1.05.xyz
C2H2_a_water_l_1.10: C2H2_a_water_l_1.10.xyz
C2H2_a_water_l_1.15: C2H2_a_water_l_1.15.xyz
C2H2_a_water_l_1.25: C2H2_a_water_l_1.25.xyz
C2H2_a_water_l_1.65: C2H2_a_water_l_1.65.xyz
NH3_l_NH3_l_1.00: NH3_l_NH3_l_1.00.xyz
NH3_l_NH3_l_1.05: NH3_l_NH3_l_1.05.xyz
NH3_l_NH3_l_1.10: NH3_l_NH3_l_1.10.xyz
NH3_l_NH3_l_1.15: NH3_l_NH3_l_1.15.xyz
NH3_l_NH3_l_1.25: NH3_l_NH3_l_1.25.xyz
NH3_l_NH3_l_1.65: NH3_l_NH3_l_1.65.xyz
NH3_l_benzene_p_1.00: NH3_l_benzene_p_1.00.xyz
NH3_l_benzene_p_1.05: NH3_l_benzene_p_1.05.xyz
NH3_l_benzene_p_1.10: NH3_l_benzene_p_1.10.xyz
NH3_l_benzene_p_1.15: NH3_l_benzene_p_1.15.xyz
NH3_l_benzene_p_1.25: NH3_l_benzene_p_1.25.xyz
NH3_l_benzene_p_1.65: NH3_l_benzene_p_1.65.xyz
NH3_l_C2H4_p_1.00: NH3_l_C2H4_p_1.00.xyz
NH3_l_C2H4_p_1.05: NH3_l_C2H4_p_1.05.xyz
NH3_l_C2H4_p_1.10: NH3_l_C2H4_p_1.10.xyz
NH3_l_C2H4_p_1.15: NH3_l_C2H4_p_1.15.xyz
NH3_l_C2H4_p_1.25: NH3_l_C2H4_p_1.25.xyz
NH3_l_C2H4_p_1.65: NH3_l_C2H4_p_1.65.xyz
NH3_l_C2H4_a_1.00: NH3_l_C2H4_a_1.00.xyz
NH3_l_C2H4_a_1.05: NH3_l_C2H4_a_1.05.xyz
NH3_l_C2H4_a_1.10: NH3_l_C2H4_a_1.10.xyz
NH3_l_C2H4_a_1.15: NH3_l_C2H4_a_1.15.xyz
NH3_l_C2H4_a_1.25: NH3_l_C2H4_a_1.25.xyz
NH3_l_C2H4_a_1.65: NH3_l_C2H4_a_1.65.xyz
NH3_l_HCHO_c_p_1.00: NH3_l_HCHO_c_p_1.00.xyz
NH3_l_HCHO_c_p_1.05: NH3_l_HCHO_c_p_1.05.xyz
NH3_l_HCHO_c_p_1.10: NH3_l_HCHO_c_p_1.10.xyz
NH3_l_HCHO_c_p_1.15: NH3_l_HCHO_c_p_1.15.xyz
NH3_l_HCHO_c_p_1.25: NH3_l_HCHO_c_p_1.25.xyz
NH3_l_HCHO_c_p_1.65: NH3_l_HCHO_c_p_1.65.xyz
NH3_l_CH4_l_1.00: NH3_l_CH4_l_1.00.xyz
NH3_l_CH4_l_1.05: NH3_l_CH4_l_1.05.xyz
NH3_l_CH4_l_1.10: NH3_l_CH4_l_1.10.xyz
NH3_l_CH4_l_1.15: NH3_l_CH4_l_1.15.xyz
NH3_l_CH4_l_1.25: NH3_l_CH4_l_1.25.xyz
NH3_l_CH4_l_1.65: NH3_l_CH4_l_1.65.xyz
NH3_l_water_l_1.00: NH3_l_water_l_1.00.xyz
NH3_l_water_l_1.05: NH3_l_water_l_1.05.xyz
NH3_l_water_l_1.10: NH3_l_water_l_1.10.xyz
NH3_l_water_l_1.15: NH3_l_water_l_1.15.xyz
NH3_l_water_l_1.25: NH3_l_water_l_1.25.xyz
NH3_l_water_l_1.65: NH3_l_water_l_1.65.xyz
benzene_p_C2H4_a_1.00: benzene_p_C2H4_a_1.00.xyz
benzene_p_C2H4_a_1.05: benzene_p_C2H4_a_1.05.xyz
benzene_p_C2H4_a_1.10: benzene_p_C2H4_a_1.10.xyz
benzene_p_C2H4_a_1.15: benzene_p_C2H4_a_1.15.xyz
benzene_p_C2H4_a_1.25: benzene_p_C2H4_a_1.25.xyz
benzene_p_C2H4_a_1.65: benzene_p_C2H4_a_1.65.xyz
benzene_p_water_l_1.00: benzene_p_water_l_1.00.xyz
benzene_p_water_l_1.05: benzene_p_water_l_1.05.xyz
benzene_p_water_l_1.10: benzene_p_water_l_1.10.xyz
benzene_p_water_l_1.15: benzene_p_water_l_1.15.xyz
benzene_p_water_l_1.25: benzene_p_water_l_1.25.xyz
benzene_p_water_l_1.65: benzene_p_water_l_1.65.xyz
CO_a_C2H2_p_1.00: CO_a_C2H2_p_1.00.xyz
CO_a_C2H2_p_1.05: CO_a_C2H2_p_1.05.xyz
CO_a_C2H2_p_1.10: CO_a_C2H2_p_1.10.xyz
CO_a_C2H2_p_1.15: CO_a_C2H2_p_1.15.xyz
CO_a_C2H2_p_1.25: CO_a_C2H2_p_1.25.xyz
CO_a_C2H2_p_1.65: CO_a_C2H2_p_1.65.xyz
CO_a_C2H2_a_1.00: CO_a_C2H2_a_1.00.xyz
CO_a_C2H2_a_1.05: CO_a_C2H2_a_1.05.xyz
CO_a_C2H2_a_1.10: CO_a_C2H2_a_1.10.xyz
CO_a_C2H2_a_1.15: CO_a_C2H2_a_1.15.xyz
CO_a_C2H2_a_1.25: CO_a_C2H2_a_1.25.xyz
CO_a_C2H2_a_1.65: CO_a_C2H2_a_1.65.xyz
CO_a_NH3_l_1.00: CO_a_NH3_l_1.00.xyz
CO_a_NH3_l_1.05: CO_a_NH3_l_1.05.xyz
CO_a_NH3_l_1.10: CO_a_NH3_l_1.10.xyz
CO_a_NH3_l_1.15: CO_a_NH3_l_1.15.xyz
CO_a_NH3_l_1.25: CO_a_NH3_l_1.25.xyz
CO_a_NH3_l_1.65: CO_a_NH3_l_1.65.xyz
CO_a_C2H4_p_1.00: CO_a_C2H4_p_1.00.xyz
CO_a_C2H4_p_1.05: CO_a_C2H4_p_1.05.xyz
CO_a_C2H4_p_1.10: CO_a_C2H4_p_1.10.xyz
CO_a_C2H4_p_1.15: CO_a_C2H4_p_1.15.xyz
CO_a_C2H4_p_1.25: CO_a_C2H4_p_1.25.xyz
CO_a_C2H4_p_1.65: CO_a_C2H4_p_1.65.xyz
CO_a_C2H4_a_1.00: CO_a_C2H4_a_1.00.xyz
CO_a_C2H4_a_1.05: CO_a_C2H4_a_1.05.xyz
CO_a_C2H4_a_1.10: CO_a_C2H4_a_1.10.xyz
CO_a_C2H4_a_1.15: CO_a_C2H4_a_1.15.xyz
CO_a_C2H4_a_1.25: CO_a_C2H4_a_1.25.xyz
CO_a_C2H4_a_1.65: CO_a_C2H4_a_1.65.xyz
CO_a_HCHO_c_p_1.00: CO_a_HCHO_c_p_1.00.xyz
CO_a_HCHO_c_p_1.05: CO_a_HCHO_c_p_1.05.xyz
CO_a_HCHO_c_p_1.10: CO_a_HCHO_c_p_1.10.xyz
CO_a_HCHO_c_p_1.15: CO_a_HCHO_c_p_1.15.xyz
CO_a_HCHO_c_p_1.25: CO_a_HCHO_c_p_1.25.xyz
CO_a_HCHO_c_p_1.65: CO_a_HCHO_c_p_1.65.xyz
CO_a_water_l_1.00: CO_a_water_l_1.00.xyz
CO_a_water_l_1.05: CO_a_water_l_1.05.xyz
CO_a_water_l_1.10: CO_a_water_l_1.10.xyz
CO_a_water_l_1.15: CO_a_water_l_1.15.xyz
CO_a_water_l_1.25: CO_a_water_l_1.25.xyz
CO_a_water_l_1.65: CO_a_water_l_1.65.xyz
C2H4_p_benzene_p_1.00: C2H4_p_benzene_p_1.00.xyz
C2H4_p_benzene_p_1.05: C2H4_p_benzene_p_1.05.xyz
C2H4_p_benzene_p_1.10: C2H4_p_benzene_p_1.10.xyz
C2H4_p_benzene_p_1.15: C2H4_p_benzene_p_1.15.xyz
C2H4_p_benzene_p_1.25: C2H4_p_benzene_p_1.25.xyz
C2H4_p_benzene_p_1.65: C2H4_p_benzene_p_1.65.xyz
C2H4_p_C2H4_p_1.00: C2H4_p_C2H4_p_1.00.xyz
C2H4_p_C2H4_p_1.05: C2H4_p_C2H4_p_1.05.xyz
C2H4_p_C2H4_p_1.10: C2H4_p_C2H4_p_1.10.xyz
C2H4_p_C2H4_p_1.15: C2H4_p_C2H4_p_1.15.xyz
C2H4_p_C2H4_p_1.25: C2H4_p_C2H4_p_1.25.xyz
C2H4_p_C2H4_p_1.65: C2H4_p_C2H4_p_1.65.xyz
C2H4_p_C2H4_a_1.00: C2H4_p_C2H4_a_1.00.xyz
C2H4_p_C2H4_a_1.05: C2H4_p_C2H4_a_1.05.xyz
C2H4_p_C2H4_a_1.10: C2H4_p_C2H4_a_1.10.xyz
C2H4_p_C2H4_a_1.15: C2H4_p_C2H4_a_1.15.xyz
C2H4_p_C2H4_a_1.25: C2H4_p_C2H4_a_1.25.xyz
C2H4_p_C2H4_a_1.65: C2H4_p_C2H4_a_1.65.xyz
C2H4_p_CH4_l_1.00: C2H4_p_CH4_l_1.00.xyz
C2H4_p_CH4_l_1.05: C2H4_p_CH4_l_1.05.xyz
C2H4_p_CH4_l_1.10: C2H4_p_CH4_l_1.10.xyz
C2H4_p_CH4_l_1.15: C2H4_p_CH4_l_1.15.xyz
C2H4_p_CH4_l_1.25: C2H4_p_CH4_l_1.25.xyz
C2H4_p_CH4_l_1.65: C2H4_p_CH4_l_1.65.xyz
C2H4_p_water_l_1.00: C2H4_p_water_l_1.00.xyz
C2H4_p_water_l_1.05: C2H4_p_water_l_1.05.xyz
C2H4_p_water_l_1.10: C2H4_p_water_l_1.10.xyz
C2H4_p_water_l_1.15: C2H4_p_water_l_1.15.xyz
C2H4_p_water_l_1.25: C2H4_p_water_l_1.25.xyz
C2H4_p_water_l_1.65: C2H4_p_water_l_1.65.xyz
C2H4_a_C2H4_a_1.00: C2H4_a_C2H4_a_1.00.xyz
C2H4_a_C2H4_a_1.05: C2H4_a_C2H4_a_1.05.xyz
C2H4_a_C2H4_a_1.10: C2H4_a_C2H4_a_1.10.xyz
C2H4_a_C2H4_a_1.15: C2H4_a_C2H4_a_1.15.xyz
C2H4_a_C2H4_a_1.25: C2H4_a_C2H4_a_1.25.xyz
C2H4_a_C2H4_a_1.65: C2H4_a_C2H4_a_1.65.xyz
C2H4_a_HCHO_c_p_1.00: C2H4_a_HCHO_c_p_1.00.xyz
C2H4_a_HCHO_c_p_1.05: C2H4_a_HCHO_c_p_1.05.xyz
C2H4_a_HCHO_c_p_1.10: C2H4_a_HCHO_c_p_1.10.xyz
C2H4_a_HCHO_c_p_1.15: C2H4_a_HCHO_c_p_1.15.xyz
C2H4_a_HCHO_c_p_1.25: C2H4_a_HCHO_c_p_1.25.xyz
C2H4_a_HCHO_c_p_1.65: C2H4_a_HCHO_c_p_1.65.xyz
C2H4_a_CH4_l_1.00: C2H4_a_CH4_l_1.00.xyz
C2H4_a_CH4_l_1.05: C2H4_a_CH4_l_1.05.xyz
C2H4_a_CH4_l_1.10: C2H4_a_CH4_l_1.10.xyz
C2H4_a_CH4_l_1.15: C2H4_a_CH4_l_1.15.xyz
C2H4_a_CH4_l_1.25: C2H4_a_CH4_l_1.25.xyz
C2H4_a_CH4_l_1.65: C2H4_a_CH4_l_1.65.xyz
C2H4_a_water_l_1.00: C2H4_a_water_l_1.00.xyz
C2H4_a_water_l_1.05: C2H4_a_water_l_1.05.xyz
C2H4_a_water_l_1.10: C2H4_a_water_l_1.10.xyz
C2H4_a_water_l_1.15: C2H4_a_water_l_1.15.xyz
C2H4_a_water_l_1.25: C2H4_a_water_l_1.25.xyz
C2H4_a_water_l_1.65: C2H4_a_water_l_1.65.xyz
HCHO_c_p_benzene_p_1.00: HCHO_c_p_benzene_p_1.00.xyz
HCHO_c_p_benzene_p_1.05: HCHO_c_p_benzene_p_1.05.xyz
HCHO_c_p_benzene_p_1.10: HCHO_c_p_benzene_p_1.10.xyz
HCHO_c_p_benzene_p_1.15: HCHO_c_p_benzene_p_1.15.xyz
HCHO_c_p_benzene_p_1.25: HCHO_c_p_benzene_p_1.25.xyz
HCHO_c_p_benzene_p_1.65: HCHO_c_p_benzene_p_1.65.xyz
HCHO_c_p_C2H4_p_1.00: HCHO_c_p_C2H4_p_1.00.xyz
HCHO_c_p_C2H4_p_1.05: HCHO_c_p_C2H4_p_1.05.xyz
HCHO_c_p_C2H4_p_1.10: HCHO_c_p_C2H4_p_1.10.xyz
HCHO_c_p_C2H4_p_1.15: HCHO_c_p_C2H4_p_1.15.xyz
HCHO_c_p_C2H4_p_1.25: HCHO_c_p_C2H4_p_1.25.xyz
HCHO_c_p_C2H4_p_1.65: HCHO_c_p_C2H4_p_1.65.xyz
HCHO_c_p_HCHO_c_p_1.00: HCHO_c_p_HCHO_c_p_1.00.xyz
HCHO_c_p_HCHO_c_p_1.05: HCHO_c_p_HCHO_c_p_1.05.xyz
HCHO_c_p_HCHO_c_p_1.10: HCHO_c_p_HCHO_c_p_1.10.xyz
HCHO_c_p_HCHO_c_p_1.15: HCHO_c_p_HCHO_c_p_1.15.xyz
HCHO_c_p_HCHO_c_p_1.25: HCHO_c_p_HCHO_c_p_1.25.xyz
HCHO_c_p_HCHO_c_p_1.65: HCHO_c_p_HCHO_c_p_1.65.xyz
HCHO_c_p_CH4_l_1.00: HCHO_c_p_CH4_l_1.00.xyz
HCHO_c_p_CH4_l_1.05: HCHO_c_p_CH4_l_1.05.xyz
HCHO_c_p_CH4_l_1.10: HCHO_c_p_CH4_l_1.10.xyz
HCHO_c_p_CH4_l_1.15: HCHO_c_p_CH4_l_1.15.xyz
HCHO_c_p_CH4_l_1.25: HCHO_c_p_CH4_l_1.25.xyz
HCHO_c_p_CH4_l_1.65: HCHO_c_p_CH4_l_1.65.xyz
HCHO_c_p_water_l_1.00: HCHO_c_p_water_l_1.00.xyz
HCHO_c_p_water_l_1.05: HCHO_c_p_water_l_1.05.xyz
HCHO_c_p_water_l_1.10: HCHO_c_p_water_l_1.10.xyz
HCHO_c_p_water_l_1.15: HCHO_c_p_water_l_1.15.xyz
HCHO_c_p_water_l_1.25: HCHO_c_p_water_l_1.25.xyz
HCHO_c_p_water_l_1.65: HCHO_c_p_water_l_1.65.xyz
H2_a_C2H2_p_1.00: H2_a_C2H2_p_1.00.xyz
H2_a_C2H2_p_1.05: H2_a_C2H2_p_1.05.xyz
H2_a_C2H2_p_1.10: H2_a_C2H2_p_1.10.xyz
H2_a_C2H2_p_1.15: H2_a_C2H2_p_1.15.xyz
H2_a_C2H2_p_1.25: H2_a_C2H2_p_1.25.xyz
H2_a_C2H2_p_1.65: H2_a_C2H2_p_1.65.xyz
H2_a_C2H2_a_1.00: H2_a_C2H2_a_1.00.xyz
H2_a_C2H2_a_1.05: H2_a_C2H2_a_1.05.xyz
H2_a_C2H2_a_1.10: H2_a_C2H2_a_1.10.xyz
H2_a_C2H2_a_1.15: H2_a_C2H2_a_1.15.xyz
H2_a_C2H2_a_1.25: H2_a_C2H2_a_1.25.xyz
H2_a_C2H2_a_1.65: H2_a_C2H2_a_1.65.xyz
H2_a_NH3_l_1.00: H2_a_NH3_l_1.00.xyz
H2_a_NH3_l_1.05: H2_a_NH3_l_1.05.xyz
H2_a_NH3_l_1.10: H2_a_NH3_l_1.10.xyz
H2_a_NH3_l_1.15: H2_a_NH3_l_1.15.xyz
H2_a_NH3_l_1.25: H2_a_NH3_l_1.25.xyz
H2_a_NH3_l_1.65: H2_a_NH3_l_1.65.xyz
H2_a_C2H4_p_1.00: H2_a_C2H4_p_1.00.xyz
H2_a_C2H4_p_1.05: H2_a_C2H4_p_1.05.xyz
H2_a_C2H4_p_1.10: H2_a_C2H4_p_1.10.xyz
H2_a_C2H4_p_1.15: H2_a_C2H4_p_1.15.xyz
H2_a_C2H4_p_1.25: H2_a_C2H4_p_1.25.xyz
H2_a_C2H4_p_1.65: H2_a_C2H4_p_1.65.xyz
H2_a_C2H4_a_1.00: H2_a_C2H4_a_1.00.xyz
H2_a_C2H4_a_1.05: H2_a_C2H4_a_1.05.xyz
H2_a_C2H4_a_1.10: H2_a_C2H4_a_1.10.xyz
H2_a_C2H4_a_1.15: H2_a_C2H4_a_1.15.xyz
H2_a_C2H4_a_1.25: H2_a_C2H4_a_1.25.xyz
H2_a_C2H4_a_1.65: H2_a_C2H4_a_1.65.xyz
H2_a_HCHO_c_p_1.00: H2_a_HCHO_c_p_1.00.xyz
H2_a_HCHO_c_p_1.05: H2_a_HCHO_c_p_1.05.xyz
H2_a_HCHO_c_p_1.10: H2_a_HCHO_c_p_1.10.xyz
H2_a_HCHO_c_p_1.15: H2_a_HCHO_c_p_1.15.xyz
H2_a_HCHO_c_p_1.25: H2_a_HCHO_c_p_1.25.xyz
H2_a_HCHO_c_p_1.65: H2_a_HCHO_c_p_1.65.xyz
H2_a_water_l_1.00: H2_a_water_l_1.00.xyz
H2_a_water_l_1.05: H2_a_water_l_1.05.xyz
H2_a_water_l_1.10: H2_a_water_l_1.10.xyz
H2_a_water_l_1.15: H2_a_water_l_1.15.xyz
H2_a_water_l_1.25: H2_a_water_l_1.25.xyz
H2_a_water_l_1.65: H2_a_water_l_1.65.xyz
CH4_l_water_l_1.00: CH4_l_water_l_1.00.xyz
CH4_l_water_l_1.05: CH4_l_water_l_1.05.xyz
CH4_l_water_l_1.10: CH4_l_water_l_1.10.xyz
CH4_l_water_l_1.15: CH4_l_water_l_1.15.xyz
CH4_l_water_l_1.25: CH4_l_water_l_1.25.xyz
CH4_l_water_l_1.65: CH4_l_water_l_1.65.xyz
water_l_water_l_1.00: water_l_water_l_1.00.xyz
water_l_water_l_1.05: water_l_water_l_1.05.xyz
water_l_water_l_1.10: water_l_water_l_1.10.xyz
water_l_water_l_1.15: water_l_water_l_1.15.xyz
water_l_water_l_1.25: water_l_water_l_1.25.xyz
water_l_water_l_1.65: water_l_water_l_1.65.xyz
NH3_a_NH3_a_1.00: NH3_a_NH3_a_1.00.xyz
NH3_a_NH3_a_1.05: NH3_a_NH3_a_1.05.xyz
NH3_a_NH3_a_1.10: NH3_a_NH3_a_1.10.xyz
NH3_a_NH3_a_1.15: NH3_a_NH3_a_1.15.xyz
NH3_a_NH3_a_1.25: NH3_a_NH3_a_1.25.xyz
NH3_a_NH3_a_1.65: NH3_a_NH3_a_1.65.xyz
NH3_a_benzene_p_1.00: NH3_a_benzene_p_1.00.xyz
NH3_a_benzene_p_1.05: NH3_a_benzene_p_1.05.xyz
NH3_a_benzene_p_1.10: NH3_a_benzene_p_1.10.xyz
NH3_a_benzene_p_1.15: NH3_a_benzene_p_1.15.xyz
NH3_a_benzene_p_1.25: NH3_a_benzene_p_1.25.xyz
NH3_a_benzene_p_1.65: NH3_a_benzene_p_1.65.xyz
NH3_a_HCHO_l_1.00: NH3_a_HCHO_l_1.00.xyz
NH3_a_HCHO_l_1.05: NH3_a_HCHO_l_1.05.xyz
NH3_a_HCHO_l_1.10: NH3_a_HCHO_l_1.10.xyz
NH3_a_HCHO_l_1.15: NH3_a_HCHO_l_1.15.xyz
NH3_a_HCHO_l_1.25: NH3_a_HCHO_l_1.25.xyz
NH3_a_HCHO_l_1.65: NH3_a_HCHO_l_1.65.xyz
NH3_a_HCHO_p_1.00: NH3_a_HCHO_p_1.00.xyz
NH3_a_HCHO_p_1.05: NH3_a_HCHO_p_1.05.xyz
NH3_a_HCHO_p_1.10: NH3_a_HCHO_p_1.10.xyz
NH3_a_HCHO_p_1.15: NH3_a_HCHO_p_1.15.xyz
NH3_a_HCHO_p_1.25: NH3_a_HCHO_p_1.25.xyz
NH3_a_HCHO_p_1.65: NH3_a_HCHO_p_1.65.xyz
NH3_a_CH4_l_1.00: NH3_a_CH4_l_1.00.xyz
NH3_a_CH4_l_1.05: NH3_a_CH4_l_1.05.xyz
NH3_a_CH4_l_1.10: NH3_a_CH4_l_1.10.xyz
NH3_a_CH4_l_1.15: NH3_a_CH4_l_1.15.xyz
NH3_a_CH4_l_1.25: NH3_a_CH4_l_1.25.xyz
NH3_a_CH4_l_1.65: NH3_a_CH4_l_1.65.xyz
NH3_a_CH3OH_a_1.00: NH3_a_CH3OH_a_1.00.xyz
NH3_a_CH3OH_a_1.05: NH3_a_CH3OH_a_1.05.xyz
NH3_a_CH3OH_a_1.10: NH3_a_CH3OH_a_1.10.xyz
NH3_a_CH3OH_a_1.15: NH3_a_CH3OH_a_1.15.xyz
NH3_a_CH3OH_a_1.25: NH3_a_CH3OH_a_1.25.xyz
NH3_a_CH3OH_a_1.65: NH3_a_CH3OH_a_1.65.xyz
NH3_a_CH3OH_p_1.00: NH3_a_CH3OH_p_1.00.xyz
NH3_a_CH3OH_p_1.05: NH3_a_CH3OH_p_1.05.xyz
NH3_a_CH3OH_p_1.10: NH3_a_CH3OH_p_1.10.xyz
NH3_a_CH3OH_p_1.15: NH3_a_CH3OH_p_1.15.xyz
NH3_a_CH3OH_p_1.25: NH3_a_CH3OH_p_1.25.xyz
NH3_a_CH3OH_p_1.65: NH3_a_CH3OH_p_1.65.xyz
NH3_a_pyridine_a_1.00: NH3_a_pyridine_a_1.00.xyz
NH3_a_pyridine_a_1.05: NH3_a_pyridine_a_1.05.xyz
NH3_a_pyridine_a_1.10: NH3_a_pyridine_a_1.10.xyz
NH3_a_pyridine_a_1.15: NH3_a_pyridine_a_1.15.xyz
NH3_a_pyridine_a_1.25: NH3_a_pyridine_a_1.25.xyz
NH3_a_pyridine_a_1.65: NH3_a_pyridine_a_1.65.xyz
NH3_a_pyridine_p_1.00: NH3_a_pyridine_p_1.00.xyz
NH3_a_pyridine_p_1.05: NH3_a_pyridine_p_1.05.xyz
NH3_a_pyridine_p_1.10: NH3_a_pyridine_p_1.10.xyz
NH3_a_pyridine_p_1.15: NH3_a_pyridine_p_1.15.xyz
NH3_a_pyridine_p_1.25: NH3_a_pyridine_p_1.25.xyz
NH3_a_pyridine_p_1.65: NH3_a_pyridine_p_1.65.xyz
NH3_a_water_a_1.00: NH3_a_water_a_1.00.xyz
NH3_a_water_a_1.05: NH3_a_water_a_1.05.xyz
NH3_a_water_a_1.10: NH3_a_water_a_1.10.xyz
NH3_a_water_a_1.15: NH3_a_water_a_1.15.xyz
NH3_a_water_a_1.25: NH3_a_water_a_1.25.xyz
NH3_a_water_a_1.65: NH3_a_water_a_1.65.xyz
NH3_a_water_p_1.00: NH3_a_water_p_1.00.xyz
NH3_a_water_p_1.05: NH3_a_water_p_1.05.xyz
NH3_a_water_p_1.10: NH3_a_water_p_1.10.xyz
NH3_a_water_p_1.15: NH3_a_water_p_1.15.xyz
NH3_a_water_p_1.25: NH3_a_water_p_1.25.xyz
NH3_a_water_p_1.65: NH3_a_water_p_1.65.xyz
benzene_p_benzene_p_1.00: benzene_p_benzene_p_1.00.xyz
benzene_p_benzene_p_1.05: benzene_p_benzene_p_1.05.xyz
benzene_p_benzene_p_1.10: benzene_p_benzene_p_1.10.xyz
benzene_p_benzene_p_1.15: benzene_p_benzene_p_1.15.xyz
benzene_p_benzene_p_1.25: benzene_p_benzene_p_1.25.xyz
benzene_p_benzene_p_1.65: benzene_p_benzene_p_1.65.xyz
benzene_p_HCHO_l_1.00: benzene_p_HCHO_l_1.00.xyz
benzene_p_HCHO_l_1.05: benzene_p_HCHO_l_1.05.xyz
benzene_p_HCHO_l_1.10: benzene_p_HCHO_l_1.10.xyz
benzene_p_HCHO_l_1.15: benzene_p_HCHO_l_1.15.xyz
benzene_p_HCHO_l_1.25: benzene_p_HCHO_l_1.25.xyz
benzene_p_HCHO_l_1.65: benzene_p_HCHO_l_1.65.xyz
benzene_p_HCHO_p_1.00: benzene_p_HCHO_p_1.00.xyz
benzene_p_HCHO_p_1.05: benzene_p_HCHO_p_1.05.xyz
benzene_p_HCHO_p_1.10: benzene_p_HCHO_p_1.10.xyz
benzene_p_HCHO_p_1.15: benzene_p_HCHO_p_1.15.xyz
benzene_p_HCHO_p_1.25: benzene_p_HCHO_p_1.25.xyz
benzene_p_HCHO_p_1.65: benzene_p_HCHO_p_1.65.xyz
benzene_p_CH4_l_1.00: benzene_p_CH4_l_1.00.xyz
benzene_p_CH4_l_1.05: benzene_p_CH4_l_1.05.xyz
benzene_p_CH4_l_1.10: benzene_p_CH4_l_1.10.xyz
benzene_p_CH4_l_1.15: benzene_p_CH4_l_1.15.xyz
benzene_p_CH4_l_1.25: benzene_p_CH4_l_1.25.xyz
benzene_p_CH4_l_1.65: benzene_p_CH4_l_1.65.xyz
benzene_p_CH3OH_a_1.00: benzene_p_CH3OH_a_1.00.xyz
benzene_p_CH3OH_a_1.05: benzene_p_CH3OH_a_1.05.xyz
benzene_p_CH3OH_a_1.10: benzene_p_CH3OH_a_1.10.xyz
benzene_p_CH3OH_a_1.15: benzene_p_CH3OH_a_1.15.xyz
benzene_p_CH3OH_a_1.25: benzene_p_CH3OH_a_1.25.xyz
benzene_p_CH3OH_a_1.65: benzene_p_CH3OH_a_1.65.xyz
benzene_p_CH3OH_p_1.00: benzene_p_CH3OH_p_1.00.xyz
benzene_p_CH3OH_p_1.05: benzene_p_CH3OH_p_1.05.xyz
benzene_p_CH3OH_p_1.10: benzene_p_CH3OH_p_1.10.xyz
benzene_p_CH3OH_p_1.15: benzene_p_CH3OH_p_1.15.xyz
benzene_p_CH3OH_p_1.25: benzene_p_CH3OH_p_1.25.xyz
benzene_p_CH3OH_p_1.65: benzene_p_CH3OH_p_1.65.xyz
benzene_p_pyridine_a_1.00: benzene_p_pyridine_a_1.00.xyz
benzene_p_pyridine_a_1.05: benzene_p_pyridine_a_1.05.xyz
benzene_p_pyridine_a_1.10: benzene_p_pyridine_a_1.10.xyz
benzene_p_pyridine_a_1.15: benzene_p_pyridine_a_1.15.xyz
benzene_p_pyridine_a_1.25: benzene_p_pyridine_a_1.25.xyz
benzene_p_pyridine_a_1.65: benzene_p_pyridine_a_1.65.xyz
benzene_p_water_a_1.00: benzene_p_water_a_1.00.xyz
benzene_p_water_a_1.05: benzene_p_water_a_1.05.xyz
benzene_p_water_a_1.10: benzene_p_water_a_1.10.xyz
benzene_p_water_a_1.15: benzene_p_water_a_1.15.xyz
benzene_p_water_a_1.25: benzene_p_water_a_1.25.xyz
benzene_p_water_a_1.65: benzene_p_water_a_1.65.xyz
benzene_p_water_p_1.00: benzene_p_water_p_1.00.xyz
benzene_p_water_p_1.05: benzene_p_water_p_1.05.xyz
benzene_p_water_p_1.10: benzene_p_water_p_1.10.xyz
benzene_p_water_p_1.15: benzene_p_water_p_1.15.xyz
benzene_p_water_p_1.25: benzene_p_water_p_1.25.xyz
benzene_p_water_p_1.65: benzene_p_water_p_1.65.xyz
CO_a_NH3_a_1.00: CO_a_NH3_a_1.00.xyz
CO_a_NH3_a_1.05: CO_a_NH3_a_1.05.xyz
CO_a_NH3_a_1.10: CO_a_NH3_a_1.10.xyz
CO_a_NH3_a_1.15: CO_a_NH3_a_1.15.xyz
CO_a_NH3_a_1.25: CO_a_NH3_a_1.25.xyz
CO_a_NH3_a_1.65: CO_a_NH3_a_1.65.xyz
CO_a_benzene_p_1.00: CO_a_benzene_p_1.00.xyz
CO_a_benzene_p_1.05: CO_a_benzene_p_1.05.xyz
CO_a_benzene_p_1.10: CO_a_benzene_p_1.10.xyz
CO_a_benzene_p_1.15: CO_a_benzene_p_1.15.xyz
CO_a_benzene_p_1.25: CO_a_benzene_p_1.25.xyz
CO_a_benzene_p_1.65: CO_a_benzene_p_1.65.xyz
CO_a_CO_a_1.00: CO_a_CO_a_1.00.xyz
CO_a_CO_a_1.05: CO_a_CO_a_1.05.xyz
CO_a_CO_a_1.10: CO_a_CO_a_1.10.xyz
CO_a_CO_a_1.15: CO_a_CO_a_1.15.xyz
CO_a_CO_a_1.25: CO_a_CO_a_1.25.xyz
CO_a_CO_a_1.65: CO_a_CO_a_1.65.xyz
CO_a_HCHO_l_1.00: CO_a_HCHO_l_1.00.xyz
CO_a_HCHO_l_1.05: CO_a_HCHO_l_1.05.xyz
CO_a_HCHO_l_1.10: CO_a_HCHO_l_1.10.xyz
CO_a_HCHO_l_1.15: CO_a_HCHO_l_1.15.xyz
CO_a_HCHO_l_1.25: CO_a_HCHO_l_1.25.xyz
CO_a_HCHO_l_1.65: CO_a_HCHO_l_1.65.xyz
CO_a_HCHO_p_1.00: CO_a_HCHO_p_1.00.xyz
CO_a_HCHO_p_1.05: CO_a_HCHO_p_1.05.xyz
CO_a_HCHO_p_1.10: CO_a_HCHO_p_1.10.xyz
CO_a_HCHO_p_1.15: CO_a_HCHO_p_1.15.xyz
CO_a_HCHO_p_1.25: CO_a_HCHO_p_1.25.xyz
CO_a_HCHO_p_1.65: CO_a_HCHO_p_1.65.xyz
CO_a_H2_a_1.00: CO_a_H2_a_1.00.xyz
CO_a_H2_a_1.05: CO_a_H2_a_1.05.xyz
CO_a_H2_a_1.10: CO_a_H2_a_1.10.xyz
CO_a_H2_a_1.15: CO_a_H2_a_1.15.xyz
CO_a_H2_a_1.25: CO_a_H2_a_1.25.xyz
CO_a_H2_a_1.65: CO_a_H2_a_1.65.xyz
CO_a_CH4_l_1.00: CO_a_CH4_l_1.00.xyz
CO_a_CH4_l_1.05: CO_a_CH4_l_1.05.xyz
CO_a_CH4_l_1.10: CO_a_CH4_l_1.10.xyz
CO_a_CH4_l_1.15: CO_a_CH4_l_1.15.xyz
CO_a_CH4_l_1.25: CO_a_CH4_l_1.25.xyz
CO_a_CH4_l_1.65: CO_a_CH4_l_1.65.xyz
CO_a_CH3OH_a_1.00: CO_a_CH3OH_a_1.00.xyz
CO_a_CH3OH_a_1.05: CO_a_CH3OH_a_1.05.xyz
CO_a_CH3OH_a_1.10: CO_a_CH3OH_a_1.10.xyz
CO_a_CH3OH_a_1.15: CO_a_CH3OH_a_1.15.xyz
CO_a_CH3OH_a_1.25: CO_a_CH3OH_a_1.25.xyz
CO_a_CH3OH_a_1.65: CO_a_CH3OH_a_1.65.xyz
CO_a_CH3OH_p_1.00: CO_a_CH3OH_p_1.00.xyz
CO_a_CH3OH_p_1.05: CO_a_CH3OH_p_1.05.xyz
CO_a_CH3OH_p_1.10: CO_a_CH3OH_p_1.10.xyz
CO_a_CH3OH_p_1.15: CO_a_CH3OH_p_1.15.xyz
CO_a_CH3OH_p_1.25: CO_a_CH3OH_p_1.25.xyz
CO_a_CH3OH_p_1.65: CO_a_CH3OH_p_1.65.xyz
CO_a_N2_a_1.00: CO_a_N2_a_1.00.xyz
CO_a_N2_a_1.05: CO_a_N2_a_1.05.xyz
CO_a_N2_a_1.10: CO_a_N2_a_1.10.xyz
CO_a_N2_a_1.15: CO_a_N2_a_1.15.xyz
CO_a_N2_a_1.25: CO_a_N2_a_1.25.xyz
CO_a_N2_a_1.65: CO_a_N2_a_1.65.xyz
CO_a_pyridine_a_1.00: CO_a_pyridine_a_1.00.xyz
CO_a_pyridine_a_1.05: CO_a_pyridine_a_1.05.xyz
CO_a_pyridine_a_1.10: CO_a_pyridine_a_1.10.xyz
CO_a_pyridine_a_1.15: CO_a_pyridine_a_1.15.xyz
CO_a_pyridine_a_1.25: CO_a_pyridine_a_1.25.xyz
CO_a_pyridine_a_1.65: CO_a_pyridine_a_1.65.xyz
CO_a_pyridine_p_1.00: CO_a_pyridine_p_1.00.xyz
CO_a_pyridine_p_1.05: CO_a_pyridine_p_1.05.xyz
CO_a_pyridine_p_1.10: CO_a_pyridine_p_1.10.xyz
CO_a_pyridine_p_1.15: CO_a_pyridine_p_1.15.xyz
CO_a_pyridine_p_1.25: CO_a_pyridine_p_1.25.xyz
CO_a_pyridine_p_1.65: CO_a_pyridine_p_1.65.xyz
CO_a_water_a_1.00: CO_a_water_a_1.00.xyz
CO_a_water_a_1.05: CO_a_water_a_1.05.xyz
CO_a_water_a_1.10: CO_a_water_a_1.10.xyz
CO_a_water_a_1.15: CO_a_water_a_1.15.xyz
CO_a_water_a_1.25: CO_a_water_a_1.25.xyz
CO_a_water_a_1.65: CO_a_water_a_1.65.xyz
CO_a_water_p_1.00: CO_a_water_p_1.00.xyz
CO_a_water_p_1.05: CO_a_water_p_1.05.xyz
CO_a_water_p_1.10: CO_a_water_p_1.10.xyz
CO_a_water_p_1.15: CO_a_water_p_1.15.xyz
CO_a_water_p_1.25: CO_a_water_p_1.25.xyz
CO_a_water_p_1.65: CO_a_water_p_1.65.xyz
HCHO_l_HCHO_l_1.00: HCHO_l_HCHO_l_1.00.xyz
HCHO_l_HCHO_l_1.05: HCHO_l_HCHO_l_1.05.xyz
HCHO_l_HCHO_l_1.10: HCHO_l_HCHO_l_1.10.xyz
HCHO_l_HCHO_l_1.15: HCHO_l_HCHO_l_1.15.xyz
HCHO_l_HCHO_l_1.25: HCHO_l_HCHO_l_1.25.xyz
HCHO_l_HCHO_l_1.65: HCHO_l_HCHO_l_1.65.xyz
HCHO_l_HCHO_p_1.00: HCHO_l_HCHO_p_1.00.xyz
HCHO_l_HCHO_p_1.05: HCHO_l_HCHO_p_1.05.xyz
HCHO_l_HCHO_p_1.10: HCHO_l_HCHO_p_1.10.xyz
HCHO_l_HCHO_p_1.15: HCHO_l_HCHO_p_1.15.xyz
HCHO_l_HCHO_p_1.25: HCHO_l_HCHO_p_1.25.xyz
HCHO_l_HCHO_p_1.65: HCHO_l_HCHO_p_1.65.xyz
HCHO_l_CH4_l_1.00: HCHO_l_CH4_l_1.00.xyz
HCHO_l_CH4_l_1.05: HCHO_l_CH4_l_1.05.xyz
HCHO_l_CH4_l_1.10: HCHO_l_CH4_l_1.10.xyz
HCHO_l_CH4_l_1.15: HCHO_l_CH4_l_1.15.xyz
HCHO_l_CH4_l_1.25: HCHO_l_CH4_l_1.25.xyz
HCHO_l_CH4_l_1.65: HCHO_l_CH4_l_1.65.xyz
HCHO_l_CH3OH_a_1.00: HCHO_l_CH3OH_a_1.00.xyz
HCHO_l_CH3OH_a_1.05: HCHO_l_CH3OH_a_1.05.xyz
HCHO_l_CH3OH_a_1.10: HCHO_l_CH3OH_a_1.10.xyz
HCHO_l_CH3OH_a_1.15: HCHO_l_CH3OH_a_1.15.xyz
HCHO_l_CH3OH_a_1.25: HCHO_l_CH3OH_a_1.25.xyz
HCHO_l_CH3OH_a_1.65: HCHO_l_CH3OH_a_1.65.xyz
HCHO_l_CH3OH_p_1.00: HCHO_l_CH3OH_p_1.00.xyz
HCHO_l_CH3OH_p_1.05: HCHO_l_CH3OH_p_1.05.xyz
HCHO_l_CH3OH_p_1.10: HCHO_l_CH3OH_p_1.10.xyz
HCHO_l_CH3OH_p_1.15: HCHO_l_CH3OH_p_1.15.xyz
HCHO_l_CH3OH_p_1.25: HCHO_l_CH3OH_p_1.25.xyz
HCHO_l_CH3OH_p_1.65: HCHO_l_CH3OH_p_1.65.xyz
HCHO_l_pyridine_a_1.00: HCHO_l_pyridine_a_1.00.xyz
HCHO_l_pyridine_a_1.05: HCHO_l_pyridine_a_1.05.xyz
HCHO_l_pyridine_a_1.10: HCHO_l_pyridine_a_1.10.xyz
HCHO_l_pyridine_a_1.15: HCHO_l_pyridine_a_1.15.xyz
HCHO_l_pyridine_a_1.25: HCHO_l_pyridine_a_1.25.xyz
HCHO_l_pyridine_a_1.65: HCHO_l_pyridine_a_1.65.xyz
HCHO_l_pyridine_p_1.00: HCHO_l_pyridine_p_1.00.xyz
HCHO_l_pyridine_p_1.05: HCHO_l_pyridine_p_1.05.xyz
HCHO_l_pyridine_p_1.10: HCHO_l_pyridine_p_1.10.xyz
HCHO_l_pyridine_p_1.15: HCHO_l_pyridine_p_1.15.xyz
HCHO_l_pyridine_p_1.25: HCHO_l_pyridine_p_1.25.xyz
HCHO_l_pyridine_p_1.65: HCHO_l_pyridine_p_1.65.xyz
HCHO_l_water_a_1.00: HCHO_l_water_a_1.00.xyz
HCHO_l_water_a_1.05: HCHO_l_water_a_1.05.xyz
HCHO_l_water_a_1.10: HCHO_l_water_a_1.10.xyz
HCHO_l_water_a_1.15: HCHO_l_water_a_1.15.xyz
HCHO_l_water_a_1.25: HCHO_l_water_a_1.25.xyz
HCHO_l_water_a_1.65: HCHO_l_water_a_1.65.xyz
HCHO_l_water_p_1.00: HCHO_l_water_p_1.00.xyz
HCHO_l_water_p_1.05: HCHO_l_water_p_1.05.xyz
HCHO_l_water_p_1.10: HCHO_l_water_p_1.10.xyz
HCHO_l_water_p_1.15: HCHO_l_water_p_1.15.xyz
HCHO_l_water_p_1.25: HCHO_l_water_p_1.25.xyz
HCHO_l_water_p_1.65: HCHO_l_water_p_1.65.xyz
HCHO_p_HCHO_p_1.00: HCHO_p_HCHO_p_1.00.xyz
HCHO_p_HCHO_p_1.05: HCHO_p_HCHO_p_1.05.xyz
HCHO_p_HCHO_p_1.10: HCHO_p_HCHO_p_1.10.xyz
HCHO_p_HCHO_p_1.15: HCHO_p_HCHO_p_1.15.xyz
HCHO_p_HCHO_p_1.25: HCHO_p_HCHO_p_1.25.xyz
HCHO_p_HCHO_p_1.65: HCHO_p_HCHO_p_1.65.xyz
HCHO_p_CH4_l_1.00: HCHO_p_CH4_l_1.00.xyz
HCHO_p_CH4_l_1.05: HCHO_p_CH4_l_1.05.xyz
HCHO_p_CH4_l_1.10: HCHO_p_CH4_l_1.10.xyz
HCHO_p_CH4_l_1.15: HCHO_p_CH4_l_1.15.xyz
HCHO_p_CH4_l_1.25: HCHO_p_CH4_l_1.25.xyz
HCHO_p_CH4_l_1.65: HCHO_p_CH4_l_1.65.xyz
HCHO_p_CH3OH_a_1.00: HCHO_p_CH3OH_a_1.00.xyz
HCHO_p_CH3OH_a_1.05: HCHO_p_CH3OH_a_1.05.xyz
HCHO_p_CH3OH_a_1.10: HCHO_p_CH3OH_a_1.10.xyz
HCHO_p_CH3OH_a_1.15: HCHO_p_CH3OH_a_1.15.xyz
HCHO_p_CH3OH_a_1.25: HCHO_p_CH3OH_a_1.25.xyz
HCHO_p_CH3OH_a_1.65: HCHO_p_CH3OH_a_1.65.xyz
HCHO_p_CH3OH_p_1.00: HCHO_p_CH3OH_p_1.00.xyz
HCHO_p_CH3OH_p_1.05: HCHO_p_CH3OH_p_1.05.xyz
HCHO_p_CH3OH_p_1.10: HCHO_p_CH3OH_p_1.10.xyz
HCHO_p_CH3OH_p_1.15: HCHO_p_CH3OH_p_1.15.xyz
HCHO_p_CH3OH_p_1.25: HCHO_p_CH3OH_p_1.25.xyz
HCHO_p_CH3OH_p_1.65: HCHO_p_CH3OH_p_1.65.xyz
HCHO_p_pyridine_a_1.00: HCHO_p_pyridine_a_1.00.xyz
HCHO_p_pyridine_a_1.05: HCHO_p_pyridine_a_1.05.xyz
HCHO_p_pyridine_a_1.10: HCHO_p_pyridine_a_1.10.xyz
HCHO_p_pyridine_a_1.15: HCHO_p_pyridine_a_1.15.xyz
HCHO_p_pyridine_a_1.25: HCHO_p_pyridine_a_1.25.xyz
HCHO_p_pyridine_a_1.65: HCHO_p_pyridine_a_1.65.xyz
HCHO_p_pyridine_p_1.00: HCHO_p_pyridine_p_1.00.xyz
HCHO_p_pyridine_p_1.05: HCHO_p_pyridine_p_1.05.xyz
HCHO_p_pyridine_p_1.10: HCHO_p_pyridine_p_1.10.xyz
HCHO_p_pyridine_p_1.15: HCHO_p_pyridine_p_1.15.xyz
HCHO_p_pyridine_p_1.25: HCHO_p_pyridine_p_1.25.xyz
HCHO_p_pyridine_p_1.65: HCHO_p_pyridine_p_1.65.xyz
HCHO_p_water_a_1.00: HCHO_p_water_a_1.00.xyz
HCHO_p_water_a_1.05: HCHO_p_water_a_1.05.xyz
HCHO_p_water_a_1.10: HCHO_p_water_a_1.10.xyz
HCHO_p_water_a_1.15: HCHO_p_water_a_1.15.xyz
HCHO_p_water_a_1.25: HCHO_p_water_a_1.25.xyz
HCHO_p_water_a_1.65: HCHO_p_water_a_1.65.xyz
HCHO_p_water_p_1.00: HCHO_p_water_p_1.00.xyz
HCHO_p_water_p_1.05: HCHO_p_water_p_1.05.xyz
HCHO_p_water_p_1.10: HCHO_p_water_p_1.10.xyz
HCHO_p_water_p_1.15: HCHO_p_water_p_1.15.xyz
HCHO_p_water_p_1.25: HCHO_p_water_p_1.25.xyz
HCHO_p_water_p_1.65: HCHO_p_water_p_1.65.xyz
H2_a_NH3_a_1.00: H2_a_NH3_a_1.00.xyz
H2_a_NH3_a_1.05: H2_a_NH3_a_1.05.xyz
H2_a_NH3_a_1.10: H2_a_NH3_a_1.10.xyz
H2_a_NH3_a_1.15: H2_a_NH3_a_1.15.xyz
H2_a_NH3_a_1.25: H2_a_NH3_a_1.25.xyz
H2_a_NH3_a_1.65: H2_a_NH3_a_1.65.xyz
H2_a_benzene_p_1.00: H2_a_benzene_p_1.00.xyz
H2_a_benzene_p_1.05: H2_a_benzene_p_1.05.xyz
H2_a_benzene_p_1.10: H2_a_benzene_p_1.10.xyz
H2_a_benzene_p_1.15: H2_a_benzene_p_1.15.xyz
H2_a_benzene_p_1.25: H2_a_benzene_p_1.25.xyz
H2_a_benzene_p_1.65: H2_a_benzene_p_1.65.xyz
H2_a_HCHO_l_1.00: H2_a_HCHO_l_1.00.xyz
H2_a_HCHO_l_1.05: H2_a_HCHO_l_1.05.xyz
H2_a_HCHO_l_1.10: H2_a_HCHO_l_1.10.xyz
H2_a_HCHO_l_1.15: H2_a_HCHO_l_1.15.xyz
H2_a_HCHO_l_1.25: H2_a_HCHO_l_1.25.xyz
H2_a_HCHO_l_1.65: H2_a_HCHO_l_1.65.xyz
H2_a_HCHO_p_1.00: H2_a_HCHO_p_1.00.xyz
H2_a_HCHO_p_1.05: H2_a_HCHO_p_1.05.xyz
H2_a_HCHO_p_1.10: H2_a_HCHO_p_1.10.xyz
H2_a_HCHO_p_1.15: H2_a_HCHO_p_1.15.xyz
H2_a_HCHO_p_1.25: H2_a_HCHO_p_1.25.xyz
H2_a_HCHO_p_1.65: H2_a_HCHO_p_1.65.xyz
H2_a_H2_a_1.00: H2_a_H2_a_1.00.xyz
H2_a_H2_a_1.05: H2_a_H2_a_1.05.xyz
H2_a_H2_a_1.10: H2_a_H2_a_1.10.xyz
H2_a_H2_a_1.15: H2_a_H2_a_1.15.xyz
H2_a_H2_a_1.25: H2_a_H2_a_1.25.xyz
H2_a_H2_a_1.65: H2_a_H2_a_1.65.xyz
H2_a_CH4_l_1.00: H2_a_CH4_l_1.00.xyz
H2_a_CH4_l_1.05: H2_a_CH4_l_1.05.xyz
H2_a_CH4_l_1.10: H2_a_CH4_l_1.10.xyz
H2_a_CH4_l_1.15: H2_a_CH4_l_1.15.xyz
H2_a_CH4_l_1.25: H2_a_CH4_l_1.25.xyz
H2_a_CH4_l_1.65: H2_a_CH4_l_1.65.xyz
H2_a_CH3OH_a_1.00: H2_a_CH3OH_a_1.00.xyz
H2_a_CH3OH_a_1.05: H2_a_CH3OH_a_1.05.xyz
H2_a_CH3OH_a_1.10: H2_a_CH3OH_a_1.10.xyz
H2_a_CH3OH_a_1.15: H2_a_CH3OH_a_1.15.xyz
H2_a_CH3OH_a_1.25: H2_a_CH3OH_a_1.25.xyz
H2_a_CH3OH_a_1.65: H2_a_CH3OH_a_1.65.xyz
H2_a_CH3OH_p_1.00: H2_a_CH3OH_p_1.00.xyz
H2_a_CH3OH_p_1.05: H2_a_CH3OH_p_1.05.xyz
H2_a_CH3OH_p_1.10: H2_a_CH3OH_p_1.10.xyz
H2_a_CH3OH_p_1.15: H2_a_CH3OH_p_1.15.xyz
H2_a_CH3OH_p_1.25: H2_a_CH3OH_p_1.25.xyz
H2_a_CH3OH_p_1.65: H2_a_CH3OH_p_1.65.xyz
H2_a_N2_a_1.00: H2_a_N2_a_1.00.xyz
H2_a_N2_a_1.05: H2_a_N2_a_1.05.xyz
H2_a_N2_a_1.10: H2_a_N2_a_1.10.xyz
H2_a_N2_a_1.15: H2_a_N2_a_1.15.xyz
H2_a_N2_a_1.25: H2_a_N2_a_1.25.xyz
H2_a_N2_a_1.65: H2_a_N2_a_1.65.xyz
H2_a_pyridine_a_1.00: H2_a_pyridine_a_1.00.xyz
H2_a_pyridine_a_1.05: H2_a_pyridine_a_1.05.xyz
H2_a_pyridine_a_1.10: H2_a_pyridine_a_1.10.xyz
H2_a_pyridine_a_1.15: H2_a_pyridine_a_1.15.xyz
H2_a_pyridine_a_1.25: H2_a_pyridine_a_1.25.xyz
H2_a_pyridine_a_1.65: H2_a_pyridine_a_1.65.xyz
H2_a_pyridine_p_1.00: H2_a_pyridine_p_1.00.xyz
H2_a_pyridine_p_1.05: H2_a_pyridine_p_1.05.xyz
H2_a_pyridine_p_1.10: H2_a_pyridine_p_1.10.xyz
H2_a_pyridine_p_1.15: H2_a_pyridine_p_1.15.xyz
H2_a_pyridine_p_1.25: H2_a_pyridine_p_1.25.xyz
H2_a_pyridine_p_1.65: H2_a_pyridine_p_1.65.xyz
H2_a_water_a_1.00: H2_a_water_a_1.00.xyz
H2_a_water_a_1.05: H2_a_water_a_1.05.xyz
H2_a_water_a_1.10: H2_a_water_a_1.10.xyz
H2_a_water_a_1.15: H2_a_water_a_1.15.xyz
H2_a_water_a_1.25: H2_a_water_a_1.25.xyz
H2_a_water_a_1.65: H2_a_water_a_1.65.xyz
H2_a_water_p_1.00: H2_a_water_p_1.00.xyz
H2_a_water_p_1.05: H2_a_water_p_1.05.xyz
H2_a_water_p_1.10: H2_a_water_p_1.10.xyz
H2_a_water_p_1.15: H2_a_water_p_1.15.xyz
H2_a_water_p_1.25: H2_a_water_p_1.25.xyz
H2_a_water_p_1.65: H2_a_water_p_1.65.xyz
CH4_l_CH4_l_1.00: CH4_l_CH4_l_1.00.xyz
CH4_l_CH4_l_1.05: CH4_l_CH4_l_1.05.xyz
CH4_l_CH4_l_1.10: CH4_l_CH4_l_1.10.xyz
CH4_l_CH4_l_1.15: CH4_l_CH4_l_1.15.xyz
CH4_l_CH4_l_1.25: CH4_l_CH4_l_1.25.xyz
CH4_l_CH4_l_1.65: CH4_l_CH4_l_1.65.xyz
CH4_l_CH3OH_a_1.00: CH4_l_CH3OH_a_1.00.xyz
CH4_l_CH3OH_a_1.05: CH4_l_CH3OH_a_1.05.xyz
CH4_l_CH3OH_a_1.10: CH4_l_CH3OH_a_1.10.xyz
CH4_l_CH3OH_a_1.15: CH4_l_CH3OH_a_1.15.xyz
CH4_l_CH3OH_a_1.25: CH4_l_CH3OH_a_1.25.xyz
CH4_l_CH3OH_a_1.65: CH4_l_CH3OH_a_1.65.xyz
CH4_l_CH3OH_p_1.00: CH4_l_CH3OH_p_1.00.xyz
CH4_l_CH3OH_p_1.05: CH4_l_CH3OH_p_1.05.xyz
CH4_l_CH3OH_p_1.10: CH4_l_CH3OH_p_1.10.xyz
CH4_l_CH3OH_p_1.15: CH4_l_CH3OH_p_1.15.xyz
CH4_l_CH3OH_p_1.25: CH4_l_CH3OH_p_1.25.xyz
CH4_l_CH3OH_p_1.65: CH4_l_CH3OH_p_1.65.xyz
CH4_l_pyridine_a_1.00: CH4_l_pyridine_a_1.00.xyz
CH4_l_pyridine_a_1.05: CH4_l_pyridine_a_1.05.xyz
CH4_l_pyridine_a_1.10: CH4_l_pyridine_a_1.10.xyz
CH4_l_pyridine_a_1.15: CH4_l_pyridine_a_1.15.xyz
CH4_l_pyridine_a_1.25: CH4_l_pyridine_a_1.25.xyz
CH4_l_pyridine_a_1.65: CH4_l_pyridine_a_1.65.xyz
CH4_l_pyridine_p_1.00: CH4_l_pyridine_p_1.00.xyz
CH4_l_pyridine_p_1.05: CH4_l_pyridine_p_1.05.xyz
CH4_l_pyridine_p_1.10: CH4_l_pyridine_p_1.10.xyz
CH4_l_pyridine_p_1.15: CH4_l_pyridine_p_1.15.xyz
CH4_l_pyridine_p_1.25: CH4_l_pyridine_p_1.25.xyz
CH4_l_pyridine_p_1.65: CH4_l_pyridine_p_1.65.xyz
CH4_l_water_a_1.00: CH4_l_water_a_1.00.xyz
CH4_l_water_a_1.05: CH4_l_water_a_1.05.xyz
CH4_l_water_a_1.10: CH4_l_water_a_1.10.xyz
CH4_l_water_a_1.15: CH4_l_water_a_1.15.xyz
CH4_l_water_a_1.25: CH4_l_water_a_1.25.xyz
CH4_l_water_a_1.65: CH4_l_water_a_1.65.xyz
CH4_l_water_p_1.00: CH4_l_water_p_1.00.xyz
CH4_l_water_p_1.05: CH4_l_water_p_1.05.xyz
CH4_l_water_p_1.10: CH4_l_water_p_1.10.xyz
CH4_l_water_p_1.15: CH4_l_water_p_1.15.xyz
CH4_l_water_p_1.25: CH4_l_water_p_1.25.xyz
CH4_l_water_p_1.65: CH4_l_water_p_1.65.xyz
CH3OH_a_CH3OH_a_1.00: CH3OH_a_CH3OH_a_1.00.xyz
CH3OH_a_CH3OH_a_1.05: CH3OH_a_CH3OH_a_1.05.xyz
CH3OH_a_CH3OH_a_1.10: CH3OH_a_CH3OH_a_1.10.xyz
CH3OH_a_CH3OH_a_1.15: CH3OH_a_CH3OH_a_1.15.xyz
CH3OH_a_CH3OH_a_1.25: CH3OH_a_CH3OH_a_1.25.xyz
CH3OH_a_CH3OH_a_1.65: CH3OH_a_CH3OH_a_1.65.xyz
CH3OH_a_CH3OH_p_1.00: CH3OH_a_CH3OH_p_1.00.xyz
CH3OH_a_CH3OH_p_1.05: CH3OH_a_CH3OH_p_1.05.xyz
CH3OH_a_CH3OH_p_1.10: CH3OH_a_CH3OH_p_1.10.xyz
CH3OH_a_CH3OH_p_1.15: CH3OH_a_CH3OH_p_1.15.xyz
CH3OH_a_CH3OH_p_1.25: CH3OH_a_CH3OH_p_1.25.xyz
CH3OH_a_CH3OH_p_1.65: CH3OH_a_CH3OH_p_1.65.xyz
CH3OH_a_pyridine_a_1.00: CH3OH_a_pyridine_a_1.00.xyz
CH3OH_a_pyridine_a_1.05: CH3OH_a_pyridine_a_1.05.xyz
CH3OH_a_pyridine_a_1.10: CH3OH_a_pyridine_a_1.10.xyz
CH3OH_a_pyridine_a_1.15: CH3OH_a_pyridine_a_1.15.xyz
CH3OH_a_pyridine_a_1.25: CH3OH_a_pyridine_a_1.25.xyz
CH3OH_a_pyridine_a_1.65: CH3OH_a_pyridine_a_1.65.xyz
CH3OH_a_pyridine_p_1.00: CH3OH_a_pyridine_p_1.00.xyz
CH3OH_a_pyridine_p_1.05: CH3OH_a_pyridine_p_1.05.xyz
CH3OH_a_pyridine_p_1.10: CH3OH_a_pyridine_p_1.10.xyz
CH3OH_a_pyridine_p_1.15: CH3OH_a_pyridine_p_1.15.xyz
CH3OH_a_pyridine_p_1.25: CH3OH_a_pyridine_p_1.25.xyz
CH3OH_a_pyridine_p_1.65: CH3OH_a_pyridine_p_1.65.xyz
CH3OH_a_water_a_1.00: CH3OH_a_water_a_1.00.xyz
CH3OH_a_water_a_1.05: CH3OH_a_water_a_1.05.xyz
CH3OH_a_water_a_1.10: CH3OH_a_water_a_1.10.xyz
CH3OH_a_water_a_1.15: CH3OH_a_water_a_1.15.xyz
CH3OH_a_water_a_1.25: CH3OH_a_water_a_1.25.xyz
CH3OH_a_water_a_1.65: CH3OH_a_water_a_1.65.xyz
CH3OH_a_water_p_1.00: CH3OH_a_water_p_1.00.xyz
CH3OH_a_water_p_1.05: CH3OH_a_water_p_1.05.xyz
CH3OH_a_water_p_1.10: CH3OH_a_water_p_1.10.xyz
CH3OH_a_water_p_1.15: CH3OH_a_water_p_1.15.xyz
CH3OH_a_water_p_1.25: CH3OH_a_water_p_1.25.xyz
CH3OH_a_water_p_1.65: CH3OH_a_water_p_1.65.xyz
CH3OH_p_CH3OH_p_1.00: CH3OH_p_CH3OH_p_1.00.xyz
CH3OH_p_CH3OH_p_1.05: CH3OH_p_CH3OH_p_1.05.xyz
CH3OH_p_CH3OH_p_1.10: CH3OH_p_CH3OH_p_1.10.xyz
CH3OH_p_CH3OH_p_1.15: CH3OH_p_CH3OH_p_1.15.xyz
CH3OH_p_CH3OH_p_1.25: CH3OH_p_CH3OH_p_1.25.xyz
CH3OH_p_CH3OH_p_1.65: CH3OH_p_CH3OH_p_1.65.xyz
CH3OH_p_pyridine_a_1.00: CH3OH_p_pyridine_a_1.00.xyz
CH3OH_p_pyridine_a_1.05: CH3OH_p_pyridine_a_1.05.xyz
CH3OH_p_pyridine_a_1.10: CH3OH_p_pyridine_a_1.10.xyz
CH3OH_p_pyridine_a_1.15: CH3OH_p_pyridine_a_1.15.xyz
CH3OH_p_pyridine_a_1.25: CH3OH_p_pyridine_a_1.25.xyz
CH3OH_p_pyridine_a_1.65: CH3OH_p_pyridine_a_1.65.xyz
CH3OH_p_pyridine_p_1.00: CH3OH_p_pyridine_p_1.00.xyz
CH3OH_p_pyridine_p_1.05: CH3OH_p_pyridine_p_1.05.xyz
CH3OH_p_pyridine_p_1.10: CH3OH_p_pyridine_p_1.10.xyz
CH3OH_p_pyridine_p_1.15: CH3OH_p_pyridine_p_1.15.xyz
CH3OH_p_pyridine_p_1.25: CH3OH_p_pyridine_p_1.25.xyz
CH3OH_p_pyridine_p_1.65: CH3OH_p_pyridine_p_1.65.xyz
CH3OH_p_water_a_1.00: CH3OH_p_water_a_1.00.xyz
CH3OH_p_water_a_1.05: CH3OH_p_water_a_1.05.xyz
CH3OH_p_water_a_1.10: CH3OH_p_water_a_1.10.xyz
CH3OH_p_water_a_1.15: CH3OH_p_water_a_1.15.xyz
CH3OH_p_water_a_1.25: CH3OH_p_water_a_1.25.xyz
CH3OH_p_water_a_1.65: CH3OH_p_water_a_1.65.xyz
CH3OH_p_water_p_1.00: CH3OH_p_water_p_1.00.xyz
CH3OH_p_water_p_1.05: CH3OH_p_water_p_1.05.xyz
CH3OH_p_water_p_1.10: CH3OH_p_water_p_1.10.xyz
CH3OH_p_water_p_1.15: CH3OH_p_water_p_1.15.xyz
CH3OH_p_water_p_1.25: CH3OH_p_water_p_1.25.xyz
CH3OH_p_water_p_1.65: CH3OH_p_water_p_1.65.xyz
N2_a_NH3_a_1.00: N2_a_NH3_a_1.00.xyz
N2_a_NH3_a_1.05: N2_a_NH3_a_1.05.xyz
N2_a_NH3_a_1.10: N2_a_NH3_a_1.10.xyz
N2_a_NH3_a_1.15: N2_a_NH3_a_1.15.xyz
N2_a_NH3_a_1.25: N2_a_NH3_a_1.25.xyz
N2_a_NH3_a_1.65: N2_a_NH3_a_1.65.xyz
N2_a_benzene_p_1.00: N2_a_benzene_p_1.00.xyz
N2_a_benzene_p_1.05: N2_a_benzene_p_1.05.xyz
N2_a_benzene_p_1.10: N2_a_benzene_p_1.10.xyz
N2_a_benzene_p_1.15: N2_a_benzene_p_1.15.xyz
N2_a_benzene_p_1.25: N2_a_benzene_p_1.25.xyz
N2_a_benzene_p_1.65: N2_a_benzene_p_1.65.xyz
N2_a_HCHO_l_1.00: N2_a_HCHO_l_1.00.xyz
N2_a_HCHO_l_1.05: N2_a_HCHO_l_1.05.xyz
N2_a_HCHO_l_1.10: N2_a_HCHO_l_1.10.xyz
N2_a_HCHO_l_1.15: N2_a_HCHO_l_1.15.xyz
N2_a_HCHO_l_1.25: N2_a_HCHO_l_1.25.xyz
N2_a_HCHO_l_1.65: N2_a_HCHO_l_1.65.xyz
N2_a_HCHO_p_1.00: N2_a_HCHO_p_1.00.xyz
N2_a_HCHO_p_1.05: N2_a_HCHO_p_1.05.xyz
N2_a_HCHO_p_1.10: N2_a_HCHO_p_1.10.xyz
N2_a_HCHO_p_1.15: N2_a_HCHO_p_1.15.xyz
N2_a_HCHO_p_1.25: N2_a_HCHO_p_1.25.xyz
N2_a_HCHO_p_1.65: N2_a_HCHO_p_1.65.xyz
N2_a_CH4_l_1.00: N2_a_CH4_l_1.00.xyz
N2_a_CH4_l_1.05: N2_a_CH4_l_1.05.xyz
N2_a_CH4_l_1.10: N2_a_CH4_l_1.10.xyz
N2_a_CH4_l_1.15: N2_a_CH4_l_1.15.xyz
N2_a_CH4_l_1.25: N2_a_CH4_l_1.25.xyz
N2_a_CH4_l_1.65: N2_a_CH4_l_1.65.xyz
N2_a_CH3OH_a_1.00: N2_a_CH3OH_a_1.00.xyz
N2_a_CH3OH_a_1.05: N2_a_CH3OH_a_1.05.xyz
N2_a_CH3OH_a_1.10: N2_a_CH3OH_a_1.10.xyz
N2_a_CH3OH_a_1.15: N2_a_CH3OH_a_1.15.xyz
N2_a_CH3OH_a_1.25: N2_a_CH3OH_a_1.25.xyz
N2_a_CH3OH_a_1.65: N2_a_CH3OH_a_1.65.xyz
N2_a_CH3OH_p_1.00: N2_a_CH3OH_p_1.00.xyz
N2_a_CH3OH_p_1.05: N2_a_CH3OH_p_1.05.xyz
N2_a_CH3OH_p_1.10: N2_a_CH3OH_p_1.10.xyz
N2_a_CH3OH_p_1.15: N2_a_CH3OH_p_1.15.xyz
N2_a_CH3OH_p_1.25: N2_a_CH3OH_p_1.25.xyz
N2_a_CH3OH_p_1.65: N2_a_CH3OH_p_1.65.xyz
N2_a_N2_a_1.00: N2_a_N2_a_1.00.xyz
N2_a_N2_a_1.05: N2_a_N2_a_1.05.xyz
N2_a_N2_a_1.10: N2_a_N2_a_1.10.xyz
N2_a_N2_a_1.15: N2_a_N2_a_1.15.xyz
N2_a_N2_a_1.25: N2_a_N2_a_1.25.xyz
N2_a_N2_a_1.65: N2_a_N2_a_1.65.xyz
N2_a_pyridine_a_1.00: N2_a_pyridine_a_1.00.xyz
N2_a_pyridine_a_1.05: N2_a_pyridine_a_1.05.xyz
N2_a_pyridine_a_1.10: N2_a_pyridine_a_1.10.xyz
N2_a_pyridine_a_1.15: N2_a_pyridine_a_1.15.xyz
N2_a_pyridine_a_1.25: N2_a_pyridine_a_1.25.xyz
N2_a_pyridine_a_1.65: N2_a_pyridine_a_1.65.xyz
N2_a_pyridine_p_1.00: N2_a_pyridine_p_1.00.xyz
N2_a_pyridine_p_1.05: N2_a_pyridine_p_1.05.xyz
N2_a_pyridine_p_1.10: N2_a_pyridine_p_1.10.xyz
N2_a_pyridine_p_1.15: N2_a_pyridine_p_1.15.xyz
N2_a_pyridine_p_1.25: N2_a_pyridine_p_1.25.xyz
N2_a_pyridine_p_1.65: N2_a_pyridine_p_1.65.xyz
N2_a_water_a_1.00: N2_a_water_a_1.00.xyz
N2_a_water_a_1.05: N2_a_water_a_1.05.xyz
N2_a_water_a_1.10: N2_a_water_a_1.10.xyz
N2_a_water_a_1.15: N2_a_water_a_1.15.xyz
N2_a_water_a_1.25: N2_a_water_a_1.25.xyz
N2_a_water_a_1.65: N2_a_water_a_1.65.xyz
N2_a_water_p_1.00: N2_a_water_p_1.00.xyz
N2_a_water_p_1.05: N2_a_water_p_1.05.xyz
N2_a_water_p_1.10: N2_a_water_p_1.10.xyz
N2_a_water_p_1.15: N2_a_water_p_1.15.xyz
N2_a_water_p_1.25: N2_a_water_p_1.25.xyz
N2_a_water_p_1.65: N2_a_water_p_1.65.xyz
pyridine_a_pyridine_a_1.00: pyridine_a_pyridine_a_1.00.xyz
pyridine_a_pyridine_a_1.05: pyridine_a_pyridine_a_1.05.xyz
pyridine_a_pyridine_a_1.10: pyridine_a_pyridine_a_1.10.xyz
pyridine_a_pyridine_a_1.15: pyridine_a_pyridine_a_1.15.xyz
pyridine_a_pyridine_a_1.25: pyridine_a_pyridine_a_1.25.xyz
pyridine_a_pyridine_a_1.65: pyridine_a_pyridine_a_1.65.xyz
pyridine_a_pyridine_p_1.00: pyridine_a_pyridine_p_1.00.xyz
pyridine_a_pyridine_p_1.05: pyridine_a_pyridine_p_1.05.xyz
pyridine_a_pyridine_p_1.10: pyridine_a_pyridine_p_1.10.xyz
pyridine_a_pyridine_p_1.15: pyridine_a_pyridine_p_1.15.xyz
pyridine_a_pyridine_p_1.25: pyridine_a_pyridine_p_1.25.xyz
pyridine_a_pyridine_p_1.65: pyridine_a_pyridine_p_1.65.xyz
pyridine_a_water_a_1.00: pyridine_a_water_a_1.00.xyz
pyridine_a_water_a_1.05: pyridine_a_water_a_1.05.xyz
pyridine_a_water_a_1.10: pyridine_a_water_a_1.10.xyz
pyridine_a_water_a_1.15: pyridine_a_water_a_1.15.xyz
pyridine_a_water_a_1.25: pyridine_a_water_a_1.25.xyz
pyridine_a_water_a_1.65: pyridine_a_water_a_1.65.xyz
pyridine_a_water_p_1.00: pyridine_a_water_p_1.00.xyz
pyridine_a_water_p_1.05: pyridine_a_water_p_1.05.xyz
pyridine_a_water_p_1.10: pyridine_a_water_p_1.10.xyz
pyridine_a_water_p_1.15: pyridine_a_water_p_1.15.xyz
pyridine_a_water_p_1.25: pyridine_a_water_p_1.25.xyz
pyridine_a_water_p_1.65: pyridine_a_water_p_1.65.xyz
pyridine_p_pyridine_p_1.00: pyridine_p_pyridine_p_1.00.xyz
pyridine_p_pyridine_p_1.05: pyridine_p_pyridine_p_1.05.xyz
pyridine_p_pyridine_p_1.10: pyridine_p_pyridine_p_1.10.xyz
pyridine_p_pyridine_p_1.15: pyridine_p_pyridine_p_1.15.xyz
pyridine_p_pyridine_p_1.25: pyridine_p_pyridine_p_1.25.xyz
pyridine_p_pyridine_p_1.65: pyridine_p_pyridine_p_1.65.xyz
pyridine_p_water_a_1.00: pyridine_p_water_a_1.00.xyz
pyridine_p_water_a_1.05: pyridine_p_water_a_1.05.xyz
pyridine_p_water_a_1.10: pyridine_p_water_a_1.10.xyz
pyridine_p_water_a_1.15: pyridine_p_water_a_1.15.xyz
pyridine_p_water_a_1.25: pyridine_p_water_a_1.25.xyz
pyridine_p_water_a_1.65: pyridine_p_water_a_1.65.xyz
pyridine_p_water_p_1.00: pyridine_p_water_p_1.00.xyz
pyridine_p_water_p_1.05: pyridine_p_water_p_1.05.xyz
pyridine_p_water_p_1.10: pyridine_p_water_p_1.10.xyz
pyridine_p_water_p_1.15: pyridine_p_water_p_1.15.xyz
pyridine_p_water_p_1.25: pyridine_p_water_p_1.25.xyz
pyridine_p_water_p_1.65: pyridine_p_water_p_1.65.xyz
water_a_water_a_1.00: water_a_water_a_1.00.xyz
water_a_water_a_1.05: water_a_water_a_1.05.xyz
water_a_water_a_1.10: water_a_water_a_1.10.xyz
water_a_water_a_1.15: water_a_water_a_1.15.xyz
water_a_water_a_1.25: water_a_water_a_1.25.xyz
water_a_water_a_1.65: water_a_water_a_1.65.xyz
water_a_water_p_1.00: water_a_water_p_1.00.xyz
water_a_water_p_1.05: water_a_water_p_1.05.xyz
water_a_water_p_1.10: water_a_water_p_1.10.xyz
water_a_water_p_1.15: water_a_water_p_1.15.xyz
water_a_water_p_1.25: water_a_water_p_1.25.xyz
water_a_water_p_1.65: water_a_water_p_1.65.xyz
water_p_water_p_1.00: water_p_water_p_1.00.xyz
water_p_water_p_1.05: water_p_water_p_1.05.xyz
water_p_water_p_1.10: water_p_water_p_1.10.xyz
water_p_water_p_1.15: water_p_water_p_1.15.xyz
water_p_water_p_1.25: water_p_water_p_1.25.xyz
water_p_water_p_1.65: water_p_water_p_1.65.xyz