# generated using pymatgen
data_Ta3Be2BIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45024353
_cell_length_b   6.26518742
_cell_length_c   10.74685006
_cell_angle_alpha   89.93183293
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Be2BIr3
_chemical_formula_sum   'Ta6 Be4 B2 Ir6'
_cell_volume   232.30828592
_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
  Ta  Ta0  1  0.00000000  0.26800238  0.95888430  1.0
  Ta  Ta1  1  0.00000000  0.73199762  0.04111570  1.0
  Ta  Ta2  1  0.00000000  0.27873278  0.53890379  1.0
  Ta  Ta3  1  0.00000000  0.72126722  0.46109621  1.0
  Ta  Ta4  1  0.00000000  0.35817562  0.25542844  1.0
  Ta  Ta5  1  0.00000000  0.64182438  0.74457156  1.0
  Be  Be6  1  0.00000000  0.94143038  0.25313804  1.0
  Be  Be7  1  0.00000000  0.05856962  0.74686196  1.0
  Be  Be8  1  0.50000000  0.44741410  0.09376417  1.0
  Be  Be9  1  0.50000000  0.55258590  0.90623583  1.0
  B  B10  1  0.50000000  0.45178602  0.41492382  1.0
  B  B11  1  0.50000000  0.54821398  0.58507618  1.0
  Ir  Ir12  1  0.50000000  0.07533369  0.12371060  1.0
  Ir  Ir13  1  0.50000000  0.92466631  0.87628940  1.0
  Ir  Ir14  1  0.50000000  0.08167872  0.37940282  1.0
  Ir  Ir15  1  0.50000000  0.91832128  0.62059718  1.0
  Ir  Ir16  1  0.50000000  0.69431008  0.25548818  1.0
  Ir  Ir17  1  0.50000000  0.30568992  0.74451182  1.0