# generated using pymatgen data_BaPr3(PPt3)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53258212 _cell_length_b 8.53258212 _cell_length_c 8.53258212 _cell_angle_alpha 89.94037936 _cell_angle_beta 89.94037936 _cell_angle_gamma 89.94037936 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaPr3(PPt3)8 _chemical_formula_sum 'Ba1 Pr3 P8 Pt24' _cell_volume 621.21327207 _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 0.00000000 0.00000000 0.00000000 1.0 Pr Pr1 1 0.50000000 0.50000000 0.00000000 1.0 Pr Pr2 1 0.50000000 0.00000000 0.50000000 1.0 Pr Pr3 1 0.00000000 0.50000000 0.50000000 1.0 P P4 1 0.80083421 0.30594636 0.19180434 1.0 P P5 1 0.19180434 0.80083421 0.30594636 1.0 P P6 1 0.69614405 0.69614405 0.69614405 1.0 P P7 1 0.30594636 0.19180434 0.80083421 1.0 P P8 1 0.19916579 0.69405364 0.80819566 1.0 P P9 1 0.80819566 0.19916579 0.69405364 1.0 P P10 1 0.30385595 0.30385595 0.30385595 1.0 P P11 1 0.69405364 0.80819566 0.19916579 1.0 Pt Pt12 1 0.41869298 0.84365079 0.16024691 1.0 Pt Pt13 1 0.57600280 0.34464616 0.34101320 1.0 Pt Pt14 1 0.07600537 0.16462940 0.64916548 1.0 Pt Pt15 1 0.92620880 0.65230586 0.83504090 1.0 Pt Pt16 1 0.16024691 0.41869298 0.84365079 1.0 Pt Pt17 1 0.34101320 0.57600280 0.34464616 1.0 Pt Pt18 1 0.64916548 0.07600537 0.16462940 1.0 Pt Pt19 1 0.83504090 0.92620880 0.65230586 1.0 Pt Pt20 1 0.84365079 0.16024691 0.41869298 1.0 Pt Pt21 1 0.34464616 0.34101320 0.57600280 1.0 Pt Pt22 1 0.16462940 0.64916548 0.07600537 1.0 Pt Pt23 1 0.65230586 0.83504090 0.92620880 1.0 Pt Pt24 1 0.58130702 0.15634921 0.83975309 1.0 Pt Pt25 1 0.42399720 0.65535384 0.65898680 1.0 Pt Pt26 1 0.92399463 0.83537060 0.35083452 1.0 Pt Pt27 1 0.07379120 0.34769414 0.16495910 1.0 Pt Pt28 1 0.83975309 0.58130702 0.15634921 1.0 Pt Pt29 1 0.65898680 0.42399720 0.65535384 1.0 Pt Pt30 1 0.35083452 0.92399463 0.83537060 1.0 Pt Pt31 1 0.16495910 0.07379120 0.34769414 1.0 Pt Pt32 1 0.15634921 0.83975309 0.58130702 1.0 Pt Pt33 1 0.65535384 0.65898680 0.42399720 1.0 Pt Pt34 1 0.83537060 0.35083452 0.92399463 1.0 Pt Pt35 1 0.34769414 0.16495910 0.07379120 1.0