# generated using pymatgen data_Zr10InBi5B2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67947367 _cell_length_b 8.64574231 _cell_length_c 5.86486910 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.87152683 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10InBi5B2 _chemical_formula_sum 'Zr10 In1 Bi5 B2' _cell_volume 381.63254748 _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 Zr Zr0 1 0.66672040 0.33358425 0.00145400 1.0 Zr Zr1 1 0.33327960 0.66686585 0.00145400 1.0 Zr Zr2 1 0.33327960 0.66686585 0.49854600 1.0 Zr Zr3 1 0.66672040 0.33358425 0.49854600 1.0 Zr Zr4 1 0.77461566 0.77223153 0.75000000 1.0 Zr Zr5 1 0.22538434 0.99761588 0.75000000 1.0 Zr Zr6 1 1.00000000 0.22564794 0.75000000 1.0 Zr Zr7 1 0.22388191 0.22987510 0.25000000 1.0 Zr Zr8 1 0.77611809 0.00599319 0.25000000 1.0 Zr Zr9 1 0.00000000 0.76983966 0.25000000 1.0 In In10 1 0.00000000 0.40183684 0.25000000 1.0 Bi Bi11 1 0.39740745 0.39800394 0.75000000 1.0 Bi Bi12 1 0.60259255 0.00059649 0.75000000 1.0 Bi Bi13 1 1.00000000 0.59328134 0.75000000 1.0 Bi Bi14 1 0.60297887 0.60406752 0.25000000 1.0 Bi Bi15 1 0.39702113 0.00108865 0.25000000 1.0 B B16 1 1.00000000 0.99951237 0.00097337 1.0 B B17 1 1.00000000 0.99951237 0.49902663 1.0