# generated using pymatgen data_Pr2B5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.34059541 _cell_length_b 7.37745900 _cell_length_c 8.50486814 _cell_angle_alpha 107.89692660 _cell_angle_beta 115.56613592 _cell_angle_gamma 90.00000336 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2B5 _chemical_formula_sum 'Pr8 B20' _cell_volume 390.63254903 _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 Pr Pr0 1 0.81765533 0.77908917 0.76349919 1.0 Pr Pr1 1 0.05415514 0.72091083 0.23650081 1.0 Pr Pr2 1 0.18234467 0.22091083 0.23650081 1.0 Pr Pr3 1 0.94584486 0.27908917 0.76349919 1.0 Pr Pr4 1 0.30934466 0.90752470 0.76398256 1.0 Pr Pr5 1 0.54536210 0.59247530 0.23601744 1.0 Pr Pr6 1 0.69065534 0.09247530 0.23601744 1.0 Pr Pr7 1 0.45463790 0.40752470 0.76398256 1.0 B B8 1 0.28849857 0.84783812 0.08762654 1.0 B B9 1 0.20087104 0.65216188 0.91237346 1.0 B B10 1 0.71150143 0.15216188 0.91237346 1.0 B B11 1 0.79912896 0.34783812 0.08762654 1.0 B B12 1 0.09386652 0.09367611 0.50092556 1.0 B B13 1 0.59293996 0.40632389 0.49907444 1.0 B B14 1 0.90613348 0.90632389 0.49907444 1.0 B B15 1 0.40706004 0.59367611 0.50092556 1.0 B B16 1 0.53908291 0.16955576 0.49775054 1.0 B B17 1 0.04133437 0.33044424 0.50224946 1.0 B B18 1 0.46091709 0.83044424 0.50224946 1.0 B B19 1 0.95866563 0.66955576 0.49775054 1.0 B B20 1 0.67038889 0.95959328 0.49949133 1.0 B B21 1 0.17089556 0.54040672 0.50050867 1.0 B B22 1 0.32961111 0.04040672 0.50050867 1.0 B B23 1 0.82910444 0.45959328 0.49949133 1.0 B B24 1 0.58992886 0.06287083 0.67892572 1.0 B B25 1 0.91100314 0.43712917 0.32107428 1.0 B B26 1 0.41007114 0.93712917 0.32107428 1.0 B B27 1 0.08899686 0.56287083 0.67892572 1.0