# generated using pymatgen data_TiBe8Re3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.37889902 _cell_length_b 4.37889765 _cell_length_c 7.19682978 _cell_angle_alpha 90.00010335 _cell_angle_beta 90.00004982 _cell_angle_gamma 119.99942581 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiBe8Re3 _chemical_formula_sum 'Ti1 Be8 Re3' _cell_volume 119.50995973 _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 Ti Ti0 1 0.33333014 0.66668116 0.06503096 1.0 Be Be1 1 0.99999962 0.00000391 0.99824501 1.0 Be Be2 1 0.99999950 0.99998815 0.49979206 1.0 Be Be3 1 0.82981813 0.65965264 0.25141572 1.0 Be Be4 1 0.16897510 0.83102639 0.74929197 1.0 Be Be5 1 0.66203178 0.83101650 0.74930508 1.0 Be Be6 1 0.34034219 0.17018038 0.25141693 1.0 Be Be7 1 0.82985915 0.17014234 0.25143935 1.0 Be Be8 1 0.16898500 0.33796931 0.74930534 1.0 Re Re9 1 0.66665941 0.33332398 0.56318822 1.0 Re Re10 1 0.66666627 0.33335312 0.93184630 1.0 Re Re11 1 0.33333471 0.66666114 0.43972307 1.0