# generated using pymatgen data_Sc4P2Ir3Pt4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.02230909 _cell_length_b 6.42864613 _cell_length_c 15.83021345 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4P2Ir3Pt4 _chemical_formula_sum 'Sc8 P4 Ir6 Pt8' _cell_volume 409.33768726 _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 Sc Sc0 1 0.00000000 0.27994838 0.46142533 1.0 Sc Sc1 1 0.00000000 0.72005162 0.53857467 1.0 Sc Sc2 1 0.00000000 0.77994838 0.03857467 1.0 Sc Sc3 1 0.00000000 0.22005162 0.96142533 1.0 Sc Sc4 1 0.00000000 0.52786723 0.28974871 1.0 Sc Sc5 1 0.00000000 0.47213277 0.71025129 1.0 Sc Sc6 1 0.00000000 0.02786723 0.21025129 1.0 Sc Sc7 1 0.00000000 0.97213277 0.78974871 1.0 P P8 1 0.50000000 0.83730415 0.30670761 1.0 P P9 1 0.50000000 0.16269585 0.69329239 1.0 P P10 1 0.50000000 0.33730415 0.19329239 1.0 P P11 1 0.50000000 0.66269585 0.80670761 1.0 Ir Ir12 1 0.00000000 0.90296704 0.37997861 1.0 Ir Ir13 1 0.00000000 0.09703296 0.62002139 1.0 Ir Ir14 1 0.00000000 0.40296704 0.12002139 1.0 Ir Ir15 1 0.00000000 0.59703296 0.87997861 1.0 Ir Ir16 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir17 1 0.50000000 0.00000000 0.50000000 1.0 Pt Pt18 1 0.50000000 0.59871038 0.42089152 1.0 Pt Pt19 1 0.50000000 0.40128962 0.57910848 1.0 Pt Pt20 1 0.50000000 0.09871038 0.07910848 1.0 Pt Pt21 1 0.50000000 0.90128962 0.92089152 1.0 Pt Pt22 1 0.50000000 0.20689569 0.33462844 1.0 Pt Pt23 1 0.50000000 0.79310431 0.66537156 1.0 Pt Pt24 1 0.50000000 0.70689569 0.16537156 1.0 Pt Pt25 1 0.50000000 0.29310431 0.83462844 1.0