# generated using pymatgen
data_Zr2SiPIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.89263233
_cell_length_b   6.55718305
_cell_length_c   7.38589693
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2SiPIr2
_chemical_formula_sum   'Zr4 Si2 P2 Ir4'
_cell_volume   188.52282339
_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
  Zr  Zr0  1  0.25000000  0.02228403  0.32425013  1.0
  Zr  Zr1  1  0.25000000  0.52228403  0.17574987  1.0
  Zr  Zr2  1  0.75000000  0.98028116  0.68068064  1.0
  Zr  Zr3  1  0.75000000  0.48028116  0.81931936  1.0
  Si  Si4  1  0.75000000  0.72725150  0.37994756  1.0
  Si  Si5  1  0.75000000  0.22725150  0.12005244  1.0
  P  P6  1  0.25000000  0.27007525  0.62033948  1.0
  P  P7  1  0.25000000  0.77007525  0.87966052  1.0
  Ir  Ir8  1  0.25000000  0.14785915  0.93595013  1.0
  Ir  Ir9  1  0.25000000  0.64785915  0.56404987  1.0
  Ir  Ir10  1  0.75000000  0.85224991  0.06208111  1.0
  Ir  Ir11  1  0.75000000  0.35224991  0.43791889  1.0