# generated using pymatgen data_Li2SO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.92078882 _cell_length_b 8.20029857 _cell_length_c 8.38784496 _cell_angle_alpha 72.19538381 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2SO4 _chemical_formula_sum 'Li8 S4 O16' _cell_volume 322.25489529 _cell_formula_units_Z 4 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 Li Li0 1 0.92529938 0.06148153 0.12892390 1.0 Li Li1 1 0.42529938 0.43851847 0.87107610 1.0 Li Li2 1 0.07470062 0.93851847 0.87107610 1.0 Li Li3 1 0.57470062 0.56148153 0.12892390 1.0 Li Li4 1 0.92978445 0.30165907 0.37873345 1.0 Li Li5 1 0.42978445 0.19834093 0.62126655 1.0 Li Li6 1 0.07021555 0.69834093 0.62126655 1.0 Li Li7 1 0.57021555 0.80165907 0.37873345 1.0 S S8 1 0.43553592 0.18685304 0.25148713 1.0 S S9 1 0.56446408 0.81314696 0.74851287 1.0 S S10 1 0.06446408 0.68685304 0.25148713 1.0 S S11 1 0.93553592 0.31314696 0.74851287 1.0 O O12 1 0.55281201 0.22200962 0.39990754 1.0 O O13 1 0.44718799 0.77799038 0.60009246 1.0 O O14 1 0.05281201 0.27799038 0.60009246 1.0 O O15 1 0.64048820 0.34142813 0.72537403 1.0 O O16 1 0.35951180 0.65857187 0.27462597 1.0 O O17 1 0.85951180 0.84142813 0.72537403 1.0 O O18 1 0.93552070 0.53405362 0.22735609 1.0 O O19 1 0.14048820 0.15857187 0.27462597 1.0 O O20 1 0.43552070 0.96594638 0.77264391 1.0 O O21 1 0.06447930 0.46594638 0.77264391 1.0 O O22 1 0.00778211 0.83601386 0.10462019 1.0 O O23 1 0.56447930 0.03405362 0.22735609 1.0 O O24 1 0.49221789 0.33601386 0.10462019 1.0 O O25 1 0.99221789 0.16398614 0.89537981 1.0 O O26 1 0.50778211 0.66398614 0.89537981 1.0 O O27 1 0.94718799 0.72200962 0.39990754 1.0