# generated using pymatgen data_LaYB5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.25752238 _cell_length_b 7.24254800 _cell_length_c 7.25844917 _cell_angle_alpha 76.89472716 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaYB5 _chemical_formula_sum 'La4 Y4 B20' _cell_volume 371.58873916 _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 La La0 1 0.68701396 0.78327849 0.62029330 1.0 La La1 1 0.18701396 0.21672151 0.87970670 1.0 La La2 1 0.31298604 0.21672151 0.37970670 1.0 La La3 1 0.81298604 0.78327849 0.12029330 1.0 Y Y4 1 0.31654122 0.74739927 0.25627217 1.0 Y Y5 1 0.81654122 0.25260073 0.24372783 1.0 Y Y6 1 0.68345878 0.25260073 0.74372783 1.0 Y Y7 1 0.18345878 0.74739927 0.75627217 1.0 B B8 1 0.50505268 0.31583355 0.03777495 1.0 B B9 1 0.00505268 0.68416645 0.46222505 1.0 B B10 1 0.49494732 0.68416645 0.96222505 1.0 B B11 1 0.99494732 0.31583355 0.53777495 1.0 B B12 1 0.48037685 0.92364762 0.92991300 1.0 B B13 1 0.98037685 0.07635238 0.57008700 1.0 B B14 1 0.51962315 0.07635238 0.07008700 1.0 B B15 1 0.01962315 0.92364762 0.42991300 1.0 B B16 1 0.32867097 0.49472149 0.04079737 1.0 B B17 1 0.82867097 0.50527851 0.45920263 1.0 B B18 1 0.67132903 0.50527851 0.95920263 1.0 B B19 1 0.17132903 0.49472149 0.54079737 1.0 B B20 1 0.90781911 0.49936546 0.90849453 1.0 B B21 1 0.40781911 0.50063454 0.59150547 1.0 B B22 1 0.09218089 0.50063454 0.09150547 1.0 B B23 1 0.59218089 0.49936546 0.40849453 1.0 B B24 1 0.96002272 0.49664836 0.67188068 1.0 B B25 1 0.46002272 0.50335164 0.82811932 1.0 B B26 1 0.03997728 0.50335164 0.32811932 1.0 B B27 1 0.53997728 0.49664836 0.17188068 1.0