# generated using pymatgen data_Tb5Be5P7Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.49455605 _cell_length_b 12.40650000 _cell_length_c 3.93860527 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.61557156 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5Be5P7Ir19 _chemical_formula_sum 'Tb5 Be5 P7 Ir19' _cell_volume 530.77755384 _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 Tb Tb0 1 0.33436002 0.66683341 0.50000000 1.0 Tb Tb1 1 0.66492014 0.32177322 0.50000000 1.0 Tb Tb2 1 0.18809456 0.19062012 0.00000000 1.0 Tb Tb3 1 0.81210786 0.00127771 0.00000000 1.0 Tb Tb4 1 0.00594501 0.81737765 0.00000000 1.0 Be Be5 1 0.31068998 0.83517429 0.00000000 1.0 Be Be6 1 0.16444248 0.47658912 0.00000000 1.0 Be Be7 1 0.52298486 0.68650368 0.00000000 1.0 Be Be8 1 0.83090885 0.30545373 0.00000000 1.0 Be Be9 1 0.47754981 0.16566066 0.00000000 1.0 P P10 1 0.69401671 0.51570551 0.00000000 1.0 P P11 1 0.36769655 0.37581038 0.50000000 1.0 P P12 1 0.62421416 0.99969489 0.50000000 1.0 P P13 1 0.00710242 0.63064133 0.50000000 1.0 P P14 1 0.81724548 0.81919750 0.50000000 1.0 P P15 1 0.18668901 0.00532595 0.50000000 1.0 P P16 1 0.99959305 0.18415998 0.50000000 1.0 Ir Ir17 1 0.19447973 0.81887531 0.50000000 1.0 Ir Ir18 1 0.18117051 0.37710791 0.50000000 1.0 Ir Ir19 1 0.62432012 0.80926164 0.50000000 1.0 Ir Ir20 1 0.81424853 0.19024848 0.50000000 1.0 Ir Ir21 1 0.37778793 0.19123631 0.50000000 1.0 Ir Ir22 1 0.80906823 0.62220277 0.50000000 1.0 Ir Ir23 1 0.12400480 0.63874654 0.00000000 1.0 Ir Ir24 1 0.35907687 0.48557352 0.00000000 1.0 Ir Ir25 1 0.50931555 0.87035995 0.00000000 1.0 Ir Ir26 1 0.63694295 0.12189830 0.00000000 1.0 Ir Ir27 1 0.49847165 0.36613380 0.00000000 1.0 Ir Ir28 1 0.87212375 0.50708411 0.00000000 1.0 Ir Ir29 1 0.54826345 0.55771910 0.50000000 1.0 Ir Ir30 1 0.44434458 0.00216754 0.50000000 1.0 Ir Ir31 1 0.99639479 0.44351632 0.50000000 1.0 Ir Ir32 1 0.71898535 0.71497698 0.00000000 1.0 Ir Ir33 1 0.28360313 0.00382732 0.00000000 1.0 Ir Ir34 1 0.99862049 0.28134862 0.00000000 1.0 Ir Ir35 1 0.00021562 0.99991637 0.50000000 1.0