# generated using pymatgen data_Rb2MgCu4H5(SO5)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.70985681 _cell_length_b 6.18195034 _cell_length_c 8.36821664 _cell_angle_alpha 90.34318557 _cell_angle_beta 63.54469781 _cell_angle_gamma 58.46553950 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb2MgCu4H5(SO5)4 _chemical_formula_sum 'Rb2 Mg1 Cu4 H5 S4 O20' _cell_volume 438.99217265 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Rb Rb0 1 0.01868472 0.46629941 0.53617381 1.0 Rb Rb1 1 0.47319637 0.52511583 0.50131970 1.0 Mg Mg2 1 0.94409075 0.55304870 0.19376766 1.0 Cu Cu3 1 0.28015778 0.96933371 0.98821061 1.0 Cu Cu4 1 0.28168438 0.46235145 0.98847506 1.0 Cu Cu5 1 0.73741353 0.01029948 0.99270879 1.0 Cu Cu6 1 0.73562072 0.51813836 0.99759278 1.0 H H7 1 0.18889992 0.30851969 0.83360947 1.0 H H8 1 0.31256145 0.68678391 0.18671019 1.0 H H9 1 0.54091237 0.45886158 0.95911347 1.0 H H10 1 0.71565855 0.28492299 0.76166264 1.0 H H11 1 0.69655258 0.81133064 0.23379033 1.0 S S12 1 0.41487631 0.08792066 0.27172384 1.0 S S13 1 0.06444599 0.93598857 0.74915765 1.0 S S14 1 0.90818731 0.08912835 0.31755173 1.0 S S15 1 0.60543722 0.89230631 0.68657679 1.0 O O16 1 0.01498199 0.18242360 0.23909749 1.0 O O17 1 0.01336892 0.78347278 0.24399378 1.0 O O18 1 0.31340580 0.18702149 0.18994966 1.0 O O19 1 0.32297776 0.18477897 0.47719048 1.0 O O20 1 0.17271433 0.32434070 0.95935690 1.0 O O21 1 0.35760098 0.64102258 0.05057904 1.0 O O22 1 0.15761511 0.85314663 0.54323959 1.0 O O23 1 0.51832954 0.18448571 0.20315479 1.0 O O24 1 0.16482166 0.82628513 0.83034223 1.0 O O25 1 0.50436219 0.19078231 0.73722548 1.0 O O26 1 0.51578479 0.78565987 0.20779726 1.0 O O27 1 0.80135418 0.19323692 0.24641061 1.0 O O28 1 0.50266792 0.79790285 0.73882011 1.0 O O29 1 0.82728678 0.17532407 0.52260088 1.0 O O30 1 0.66240958 0.33820829 0.90224172 1.0 O O31 1 0.79166837 0.71256390 0.10703008 1.0 O O32 1 0.72136899 0.77438864 0.47840823 1.0 O O33 1 0.69137440 0.80732463 0.78756346 1.0 O O34 1 0.96077543 0.23910782 0.82528454 1.0 O O35 1 0.95960931 0.84150645 0.80844414 1.0