# generated using pymatgen data_Ba2Cu2PPt6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.46331158 _cell_length_b 9.46330998 _cell_length_c 4.12711636 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 146.15459728 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Cu2PPt6 _chemical_formula_sum 'Ba2 Cu2 P1 Pt6' _cell_volume 205.85062806 _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 Ba Ba0 1 0.62080654 0.37399528 0.50000000 1.0 Ba Ba1 1 0.37399528 0.62080654 0.50000000 1.0 Cu Cu2 1 0.19885384 0.79290296 0.50000000 1.0 Cu Cu3 1 0.79290296 0.19885384 0.50000000 1.0 P P4 1 0.20685079 0.20685079 0.00000000 1.0 Pt Pt5 1 0.11484455 0.88536506 0.00000000 1.0 Pt Pt6 1 0.88536506 0.11484455 0.00000000 1.0 Pt Pt7 1 0.49740968 0.99612914 0.00000000 1.0 Pt Pt8 1 0.99612914 0.49740968 0.00000000 1.0 Pt Pt9 1 0.00088692 0.00088692 0.50000000 1.0 Pt Pt10 1 0.62555524 0.62555524 0.00000000 1.0