# generated using pymatgen data_LaSnBIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.70707340 _cell_length_b 5.70707253 _cell_length_c 7.22599906 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000504 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaSnBIr3 _chemical_formula_sum 'La2 Sn2 B2 Ir6' _cell_volume 203.82401918 _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 La La0 1 0.00000000 0.00000000 0.50000000 1.0 La La1 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn2 1 0.66666700 0.33333300 0.00000000 1.0 Sn Sn3 1 0.33333300 0.66666700 0.00000000 1.0 B B4 1 0.66666700 0.33333300 0.50000000 1.0 B B5 1 0.33333300 0.66666700 0.50000000 1.0 Ir Ir6 1 0.50000000 0.50000000 0.30036857 1.0 Ir Ir7 1 0.50000000 0.00000000 0.30036857 1.0 Ir Ir8 1 0.50000000 0.00000000 0.69963143 1.0 Ir Ir9 1 0.50000000 0.50000000 0.69963143 1.0 Ir Ir10 1 0.00000000 0.50000000 0.69963143 1.0 Ir Ir11 1 0.00000000 0.50000000 0.30036857 1.0