# generated using pymatgen data_PaPt3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.72580834 _cell_length_b 5.72580236 _cell_length_c 5.07262511 _cell_angle_alpha 90.00005827 _cell_angle_beta 90.00006579 _cell_angle_gamma 119.99921715 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaPt3 _chemical_formula_sum 'Pa2 Pt6' _cell_volume 144.02569679 _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 Pa Pa0 1 0.66666531 0.33333247 0.25000348 1.0 Pa Pa1 1 0.33333398 0.66666915 0.75000327 1.0 Pt Pt2 1 0.83472605 0.16527264 0.75000288 1.0 Pt Pt3 1 0.33055092 0.16527383 0.75000290 1.0 Pt Pt4 1 0.83472625 0.66944895 0.75000288 1.0 Pt Pt5 1 0.16527631 0.83472698 0.24999465 1.0 Pt Pt6 1 0.66944614 0.83472520 0.24999855 1.0 Pt Pt7 1 0.16527504 0.33055376 0.24999939 1.0