# generated using pymatgen
data_Be(BIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88020227
_cell_length_b   2.88020168
_cell_length_c   6.36483005
_cell_angle_alpha   103.07693138
_cell_angle_beta   103.07692886
_cell_angle_gamma   90.00001281
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be(BIr)2
_chemical_formula_sum   'Be1 B2 Ir2'
_cell_volume   50.02388442
_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
  Be  Be0  1  0.00000000  0.00000000  0.00000000  1.0
  B  B1  1  0.75000100  0.25000000  0.50000000  1.0
  B  B2  1  0.25000000  0.75000100  0.50000000  1.0
  Ir  Ir3  1  0.61682729  0.61682729  0.23365358  1.0
  Ir  Ir4  1  0.38317371  0.38317371  0.76634742  1.0