# generated using pymatgen data_LiLa4Sb8Ir5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.59780227 _cell_length_b 11.32337752 _cell_length_c 16.26432692 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiLa4Sb8Ir5 _chemical_formula_sum 'Li2 La8 Sb16 Ir10' _cell_volume 846.76397453 _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 0.25000000 0.46747745 0.55554417 1.0 Li Li1 1 0.25000000 0.03252255 0.05554417 1.0 La La2 1 0.25000000 0.75210131 0.50533553 1.0 La La3 1 0.25000000 0.74789869 0.00533553 1.0 La La4 1 0.75000000 0.24720135 0.48981061 1.0 La La5 1 0.75000000 0.25279865 0.98981061 1.0 La La6 1 0.25000000 0.60003148 0.75519895 1.0 La La7 1 0.25000000 0.89996852 0.25519895 1.0 La La8 1 0.75000000 0.40590038 0.24834353 1.0 La La9 1 0.75000000 0.09409962 0.74834353 1.0 Sb Sb10 1 0.25000000 0.26540692 0.64990180 1.0 Sb Sb11 1 0.25000000 0.23459308 0.14990180 1.0 Sb Sb12 1 0.75000000 0.72045843 0.35298256 1.0 Sb Sb13 1 0.75000000 0.77954157 0.85298256 1.0 Sb Sb14 1 0.25000000 0.89309748 0.71109099 1.0 Sb Sb15 1 0.25000000 0.60690252 0.21109099 1.0 Sb Sb16 1 0.75000000 0.10994735 0.29103175 1.0 Sb Sb17 1 0.75000000 0.39005265 0.79103175 1.0 Sb Sb18 1 0.25000000 0.06317888 0.89171472 1.0 Sb Sb19 1 0.25000000 0.43682112 0.39171472 1.0 Sb Sb20 1 0.75000000 0.91770356 0.10485479 1.0 Sb Sb21 1 0.75000000 0.58229644 0.60485479 1.0 Sb Sb22 1 0.25000000 0.45160355 0.93067991 1.0 Sb Sb23 1 0.25000000 0.04839645 0.43067991 1.0 Sb Sb24 1 0.75000000 0.55159336 0.06629817 1.0 Sb Sb25 1 0.75000000 0.94840664 0.56629817 1.0 Ir Ir26 1 0.75000000 0.52699537 0.44739290 1.0 Ir Ir27 1 0.75000000 0.97300463 0.94739290 1.0 Ir Ir28 1 0.25000000 0.05130675 0.59126857 1.0 Ir Ir29 1 0.25000000 0.44869325 0.09126857 1.0 Ir Ir30 1 0.75000000 0.94153422 0.40568699 1.0 Ir Ir31 1 0.75000000 0.55846578 0.90568699 1.0 Ir Ir32 1 0.25000000 0.28080879 0.81802037 1.0 Ir Ir33 1 0.25000000 0.21919121 0.31802037 1.0 Ir Ir34 1 0.75000000 0.71173095 0.18484368 1.0 Ir Ir35 1 0.75000000 0.78826905 0.68484368 1.0