# generated using pymatgen data_Li(ZrS2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64257161 _cell_length_b 6.28652299 _cell_length_c 6.52923659 _cell_angle_alpha 71.55245794 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li(ZrS2)2 _chemical_formula_sum 'Li1 Zr2 S4' _cell_volume 141.83076227 _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 Li Li0 1 0.00000000 0.50000000 0.50000000 1.0 Zr Zr1 1 0.00000000 -0.00000000 0.00000000 1.0 Zr Zr2 1 0.50000000 0.50000000 0.00000000 1.0 S S3 1 0.50000000 0.75246906 0.24641753 1.0 S S4 1 -0.00000000 0.25386809 0.24177065 1.0 S S5 1 0.50000000 0.24753094 0.75358247 1.0 S S6 1 0.00000000 0.74613191 0.75822935 1.0