# generated using pymatgen data_Rb2MgCu4H5(SO5)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.57144087 _cell_length_b 6.37290428 _cell_length_c 8.44838076 _cell_angle_alpha 90.25180724 _cell_angle_beta 67.76887538 _cell_angle_gamma 54.61421632 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb2MgCu4H5(SO5)4 _chemical_formula_sum 'Rb2 Mg1 Cu4 H5 S4 O20' _cell_volume 449.08024379 _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 0.98256816 0.48422961 0.48807604 1.0 Rb Rb1 1 0.53133698 0.50738601 0.47760727 1.0 Mg Mg2 1 0.24200799 0.40580443 0.71544087 1.0 Cu Cu3 1 0.25600721 0.98777447 0.99219917 1.0 Cu Cu4 1 0.25391074 0.47151777 0.03491249 1.0 Cu Cu5 1 0.76005059 0.99068694 0.99059152 1.0 Cu Cu6 1 0.75890246 0.48650042 0.00196745 1.0 H H7 1 0.03763103 0.45522956 0.00438469 1.0 H H8 1 0.30835639 0.70606022 0.20890637 1.0 H H9 1 0.48006089 0.52069888 0.02472933 1.0 H H10 1 0.70690943 0.30148142 0.81044050 1.0 H H11 1 0.78620806 0.72344189 0.18596953 1.0 S S12 1 0.43188363 0.08516323 0.27779102 1.0 S S13 1 0.08804158 0.90876245 0.67949637 1.0 S S14 1 0.93872744 0.06077859 0.26209386 1.0 S S15 1 0.56229044 0.93356950 0.72323591 1.0 O O16 1 0.04636072 0.13755843 0.19498720 1.0 O O17 1 0.03964572 0.76024287 0.22971532 1.0 O O18 1 0.32097252 0.19522383 0.19866184 1.0 O O19 1 0.33296136 0.18047432 0.47828347 1.0 O O20 1 0.15800699 0.34036520 0.94355064 1.0 O O21 1 0.35541134 0.64422297 0.07740333 1.0 O O22 1 0.16597559 0.85799666 0.48562424 1.0 O O23 1 0.52907629 0.17822642 0.22940531 1.0 O O24 1 0.21492701 0.75590961 0.74196784 1.0 O O25 1 0.43630289 0.24419028 0.77409784 1.0 O O26 1 0.53645887 0.78421160 0.22139224 1.0 O O27 1 0.84263699 0.14398396 0.16384184 1.0 O O28 1 0.47016251 0.82716475 0.78706549 1.0 O O29 1 0.83598810 0.19286600 0.45547409 1.0 O O30 1 0.66658242 0.33662474 0.94011742 1.0 O O31 1 0.84091560 0.65841272 0.05484598 1.0 O O32 1 0.65439034 0.83281511 0.52796496 1.0 O O33 1 0.66130016 0.86721128 0.81271820 1.0 O O34 1 0.97682346 0.20228930 0.77270894 1.0 O O35 1 0.00449510 0.78404955 0.73155042 1.0