# generated using pymatgen data_Li2BiS2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.99784300 _cell_length_b 4.02644800 _cell_length_c 13.49954700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2BiS2 _chemical_formula_sum 'Li4 Bi2 S4' _cell_volume 217.30365186 _cell_formula_units_Z 2 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 0.42905500 0.50000000 0.24290700 1.0 Li Li1 1 0.07094500 0.00000000 0.74290700 1.0 Li Li2 1 0.92905500 0.00000000 0.25709300 1.0 Li Li3 1 0.57094500 0.50000000 0.75709300 1.0 Bi Bi4 1 0.00000000 0.00000000 0.00000000 1.0 Bi Bi5 1 0.50000000 0.50000000 0.50000000 1.0 S S6 1 0.43166200 0.00000000 0.35296500 1.0 S S7 1 0.06833800 0.50000000 0.85296500 1.0 S S8 1 0.93166200 0.50000000 0.14703500 1.0 S S9 1 0.56833800 0.00000000 0.64703500 1.0