# generated using pymatgen data_Ba2IrPtN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.40670122 _cell_length_b 5.40670122 _cell_length_c 8.71000971 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2IrPtN2 _chemical_formula_sum 'Ba4 Ir2 Pt2 N4' _cell_volume 254.61464523 _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 Ba Ba0 1 0.00000000 0.50000000 0.75000000 1.0 Ba Ba1 1 0.00000000 0.50000000 0.25000000 1.0 Ba Ba2 1 0.50000000 0.00000000 0.25000000 1.0 Ba Ba3 1 0.50000000 0.00000000 0.75000000 1.0 Ir Ir4 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir5 1 0.00000000 0.00000000 0.00000000 1.0 Pt Pt6 1 0.00000000 0.00000000 0.50000000 1.0 Pt Pt7 1 0.50000000 0.50000000 0.00000000 1.0 N N8 1 0.74434438 0.74434438 0.50000000 1.0 N N9 1 0.75565562 0.24434438 0.00000000 1.0 N N10 1 0.25565562 0.25565562 0.50000000 1.0 N N11 1 0.24434438 0.75565562 0.00000000 1.0