# generated using pymatgen
data_Zr3BeP2Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33014253
_cell_length_b   6.33014256
_cell_length_c   3.92187543
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00031738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3BeP2Ir3
_chemical_formula_sum   'Zr3 Be1 P2 Ir3'
_cell_volume   136.09745919
_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
  Zr  Zr0  1  0.00000379  0.41345948  0.50000000  1.0
  Zr  Zr1  1  0.58653327  0.58653327  0.50000000  1.0
  Zr  Zr2  1  0.41345948  0.00000379  0.50000000  1.0
  Be  Be3  1  0.00000527  0.00000527  0.50000000  1.0
  P  P4  1  0.66666499  0.33333300  0.00000000  1.0
  P  P5  1  0.33333300  0.66666499  0.00000000  1.0
  Ir  Ir6  1  0.99999855  0.75466119  0.00000000  1.0
  Ir  Ir7  1  0.24534045  0.24534045  0.00000000  1.0
  Ir  Ir8  1  0.75466119  0.99999855  0.00000000  1.0