# generated using pymatgen data_Zr8Bi13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.03398600 _cell_length_b 7.03398600 _cell_length_c 45.67798100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8Bi13 _chemical_formula_sum 'Zr32 Bi52' _cell_volume 2260.00759534 _cell_formula_units_Z 4 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 Zr Zr0 1 0.50000000 0.50000000 0.18887000 1.0 Zr Zr1 1 0.50000000 0.50000000 0.81113000 1.0 Zr Zr2 1 0.50000000 0.50000000 0.68887000 1.0 Zr Zr3 1 0.50000000 0.50000000 0.31113000 1.0 Zr Zr4 1 0.00000000 0.00000000 0.25000000 1.0 Zr Zr5 1 0.00000000 0.00000000 0.75000000 1.0 Zr Zr6 1 0.00000000 0.50000000 0.40785800 1.0 Zr Zr7 1 0.50000000 0.00000000 0.59214200 1.0 Zr Zr8 1 0.00000000 0.50000000 0.90785800 1.0 Zr Zr9 1 0.50000000 0.00000000 0.09214200 1.0 Zr Zr10 1 0.00000000 0.50000000 0.03323600 1.0 Zr Zr11 1 0.50000000 0.00000000 0.96676400 1.0 Zr Zr12 1 0.00000000 0.50000000 0.53323600 1.0 Zr Zr13 1 0.50000000 0.00000000 0.46676400 1.0 Zr Zr14 1 0.00000000 0.50000000 0.15552500 1.0 Zr Zr15 1 0.50000000 0.00000000 0.84447500 1.0 Zr Zr16 1 0.00000000 0.50000000 0.65552500 1.0 Zr Zr17 1 0.50000000 0.00000000 0.34447500 1.0 Zr Zr18 1 0.00000000 0.00000000 0.12241400 1.0 Zr Zr19 1 0.00000000 0.00000000 0.87758600 1.0 Zr Zr20 1 0.00000000 0.00000000 0.62241400 1.0 Zr Zr21 1 0.00000000 0.00000000 0.37758600 1.0 Zr Zr22 1 0.00000000 0.50000000 0.27834500 1.0 Zr Zr23 1 0.50000000 0.00000000 0.72165500 1.0 Zr Zr24 1 0.00000000 0.50000000 0.77834500 1.0 Zr Zr25 1 0.50000000 0.00000000 0.22165500 1.0 Zr Zr26 1 0.50000000 0.50000000 0.06513400 1.0 Zr Zr27 1 0.50000000 0.50000000 0.93486600 1.0 Zr Zr28 1 0.50000000 0.50000000 0.56513400 1.0 Zr Zr29 1 0.50000000 0.50000000 0.43486600 1.0 Zr Zr30 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr31 1 0.00000000 0.00000000 0.50000000 1.0 Bi Bi32 1 0.65508300 0.28638900 0.13393900 1.0 Bi Bi33 1 0.34491700 0.71361100 0.13393900 1.0 Bi Bi34 1 0.28638900 0.34491700 0.86606100 1.0 Bi Bi35 1 0.65508300 0.71361100 0.63393900 1.0 Bi Bi36 1 0.71361100 0.65508300 0.86606100 1.0 Bi Bi37 1 0.34491700 0.28638900 0.63393900 1.0 Bi Bi38 1 0.28638900 0.65508300 0.36606100 1.0 Bi Bi39 1 0.71361100 0.34491700 0.36606100 1.0 Bi Bi40 1 0.34532700 0.22808900 0.01989300 1.0 Bi Bi41 1 0.65467300 0.77191100 0.01989300 1.0 Bi Bi42 1 0.22808900 0.65467300 0.98010700 1.0 Bi Bi43 1 0.34532700 0.77191100 0.51989300 1.0 Bi Bi44 1 0.77191100 0.34532700 0.98010700 1.0 Bi Bi45 1 0.65467300 0.22808900 0.51989300 1.0 Bi Bi46 1 0.22808900 0.34532700 0.48010700 1.0 Bi Bi47 1 0.77191100 0.65467300 0.48010700 1.0 Bi Bi48 1 0.32987900 0.32987900 0.25000000 1.0 Bi Bi49 1 0.67012100 0.67012100 0.25000000 1.0 Bi Bi50 1 0.32987900 0.67012100 0.75000000 1.0 Bi Bi51 1 0.67012100 0.32987900 0.75000000 1.0 Bi Bi52 1 0.17737400 0.33530800 0.09608400 1.0 Bi Bi53 1 0.82262600 0.66469200 0.09608400 1.0 Bi Bi54 1 0.33530800 0.82262600 0.90391600 1.0 Bi Bi55 1 0.17737400 0.66469200 0.59608400 1.0 Bi Bi56 1 0.66469200 0.17737400 0.90391600 1.0 Bi Bi57 1 0.82262600 0.33530800 0.59608400 1.0 Bi Bi58 1 0.33530800 0.17737400 0.40391600 1.0 Bi Bi59 1 0.66469200 0.82262600 0.40391600 1.0 Bi Bi60 1 0.18729800 0.16031400 0.55789200 1.0 Bi Bi61 1 0.81270200 0.83968600 0.55789200 1.0 Bi Bi62 1 0.16031400 0.81270200 0.44210800 1.0 Bi Bi63 1 0.18729800 0.83968600 0.05789200 1.0 Bi Bi64 1 0.83968600 0.18729800 0.44210800 1.0 Bi Bi65 1 0.81270200 0.16031400 0.05789200 1.0 Bi Bi66 1 0.16031400 0.18729800 0.94210800 1.0 Bi Bi67 1 0.83968600 0.81270200 0.94210800 1.0 Bi Bi68 1 0.15702300 0.69975800 0.21198500 1.0 Bi Bi69 1 0.84297700 0.30024200 0.21198500 1.0 Bi Bi70 1 0.69975800 0.84297700 0.78801500 1.0 Bi Bi71 1 0.15702300 0.30024200 0.71198500 1.0 Bi Bi72 1 0.30024200 0.15702300 0.78801500 1.0 Bi Bi73 1 0.84297700 0.69975800 0.71198500 1.0 Bi Bi74 1 0.69975800 0.15702300 0.28801500 1.0 Bi Bi75 1 0.30024200 0.84297700 0.28801500 1.0 Bi Bi76 1 0.24271600 0.15510900 0.17335200 1.0 Bi Bi77 1 0.75728400 0.84489100 0.17335200 1.0 Bi Bi78 1 0.15510900 0.75728400 0.82664800 1.0 Bi Bi79 1 0.24271600 0.84489100 0.67335200 1.0 Bi Bi80 1 0.84489100 0.24271600 0.82664800 1.0 Bi Bi81 1 0.75728400 0.15510900 0.67335200 1.0 Bi Bi82 1 0.15510900 0.24271600 0.32664800 1.0 Bi Bi83 1 0.84489100 0.75728400 0.32664800 1.0