# generated using pymatgen data_NdTh3(Al8Pt3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.57009759 _cell_length_b 7.59050802 _cell_length_c 13.18503017 _cell_angle_alpha 84.49216250 _cell_angle_beta 78.93697310 _cell_angle_gamma 59.92519095 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh3(Al8Pt3)3 _chemical_formula_sum 'Nd1 Th3 Al24 Pt9' _cell_volume 643.44234277 _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 Nd Nd0 1 0.39443825 0.16776913 0.80779652 1.0 Th Th1 1 0.60521665 0.83220129 0.19355126 1.0 Th Th2 1 0.73399156 0.49889153 0.80551052 1.0 Th Th3 1 0.26597485 0.50146298 0.19359857 1.0 Al Al4 1 0.68630219 0.83490093 0.94533504 1.0 Al Al5 1 0.31266590 0.16647441 0.05258863 1.0 Al Al6 1 0.14645855 0.83270955 0.56078245 1.0 Al Al7 1 0.85320244 0.16660724 0.44068495 1.0 Al Al8 1 0.48060145 0.16651244 0.55879988 1.0 Al Al9 1 0.51813188 0.83406660 0.44317504 1.0 Al Al10 1 0.21049518 0.16552505 0.33715832 1.0 Al Al11 1 0.78586928 0.83773227 0.66395183 1.0 Al Al12 1 0.43567266 0.50748154 0.66413360 1.0 Al Al13 1 0.56423348 0.48904976 0.33719313 1.0 Al Al14 1 0.11532744 0.15589595 0.66275922 1.0 Al Al15 1 0.88739086 0.84434783 0.33854740 1.0 Al Al16 1 0.34852895 0.50153797 0.94522311 1.0 Al Al17 1 0.65266417 0.49627336 0.05311848 1.0 Al Al18 1 0.01585284 0.16473316 0.95484440 1.0 Al Al19 1 0.98610459 0.83607169 0.04202913 1.0 Al Al20 1 0.18633703 0.49969565 0.44317458 1.0 Al Al21 1 0.81389587 0.50005395 0.55718620 1.0 Al Al22 1 0.73861658 0.16392261 0.18386694 1.0 Al Al23 1 0.26256380 0.83663425 0.81604555 1.0 Al Al24 1 0.06227889 0.63393974 0.81429624 1.0 Al Al25 1 0.93842723 0.36439902 0.18530492 1.0 Al Al26 1 0.85889009 0.03759602 0.81537549 1.0 Al Al27 1 0.13935446 0.96355892 0.18415115 1.0 Pt Pt28 1 0.11889234 0.49375863 0.63767110 1.0 Pt Pt29 1 0.87974433 0.50830210 0.36114963 1.0 Pt Pt30 1 0.65683258 0.17164558 0.00069552 1.0 Pt Pt31 1 0.34316405 0.82760281 0.00104153 1.0 Pt Pt32 1 0.53741315 0.16684585 0.36167705 1.0 Pt Pt33 1 0.46285866 0.83123762 0.63771870 1.0 Pt Pt34 1 0.78130208 0.17483019 0.63663384 1.0 Pt Pt35 1 0.22106187 0.82497486 0.36234029 1.0 Pt Pt36 1 0.99924582 0.50075852 0.00088978 1.0