# generated using pymatgen
data_LaBeBIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61925026
_cell_length_b   5.61924909
_cell_length_c   6.41232272
_cell_angle_alpha   104.94697807
_cell_angle_beta   104.94697554
_cell_angle_gamma   114.28940733
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBeBIr2
_chemical_formula_sum   'La2 Be2 B2 Ir4'
_cell_volume   162.36121005
_cell_formula_units_Z   2
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  0.00000000  0.00000000  0.00000000  1.0
  La  La1  1  0.75000000  0.25000000  0.50000000  1.0
  Be  Be2  1  0.67410550  0.32589350  0.00000000  1.0
  Be  Be3  1  0.32589350  0.67410550  1.00000000  1.0
  B  B4  1  0.42405225  0.57594775  0.50000000  1.0
  B  B5  1  0.07594675  0.92405325  0.50000000  1.0
  Ir  Ir6  1  0.12816671  0.62816671  0.25633443  1.0
  Ir  Ir7  1  0.63958180  0.63958180  0.27916561  1.0
  Ir  Ir8  1  0.36041820  0.36041820  0.72083539  1.0
  Ir  Ir9  1  0.37183329  0.87183329  0.74366657  1.0