# generated using pymatgen
data_TiBe4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38414819
_cell_length_b   4.38414801
_cell_length_c   4.38414821
_cell_angle_alpha   60.00000601
_cell_angle_beta   60.00000744
_cell_angle_gamma   59.99999919
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBe4Ir
_chemical_formula_sum   'Ti1 Be4 Ir1'
_cell_volume   59.58551588
_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  0.00000000  0.00000000  0.00000000  1.0
  Be  Be1  1  0.62617445  0.62617445  0.12147664  1.0
  Be  Be2  1  0.62617445  0.12147664  0.62617445  1.0
  Be  Be3  1  0.12147664  0.62617445  0.62617445  1.0
  Be  Be4  1  0.62617445  0.62617445  0.62617445  1.0
  Ir  Ir5  1  0.25000000  0.25000000  0.25000000  1.0