# generated using pymatgen
data_Zr4CuIrO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75811773
_cell_length_b   8.75311999
_cell_length_c   8.75811798
_cell_angle_alpha   59.98110983
_cell_angle_beta   59.99999905
_cell_angle_gamma   59.98110587
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4CuIrO
_chemical_formula_sum   'Zr16 Cu4 Ir4 O4'
_cell_volume   474.61928094
_cell_formula_units_Z   4
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  0.31443562  0.68530168  0.31443562  1.0
  Zr  Zr1  1  0.93226043  0.56417518  0.93226043  1.0
  Zr  Zr2  1  0.68011593  0.32090236  0.68011593  1.0
  Zr  Zr3  1  0.68011593  0.32090236  0.31886477  1.0
  Zr  Zr4  1  0.31443562  0.68530168  0.68582707  1.0
  Zr  Zr5  1  0.62556567  0.12718691  0.12362421  1.0
  Zr  Zr6  1  0.93382794  0.93448204  0.56584551  1.0
  Zr  Zr7  1  0.68582707  0.68530168  0.31443562  1.0
  Zr  Zr8  1  0.12102694  0.63691817  0.12102694  1.0
  Zr  Zr9  1  0.12362421  0.12718691  0.62556567  1.0
  Zr  Zr10  1  0.31886477  0.32090236  0.68011593  1.0
  Zr  Zr11  1  0.12362421  0.12718691  0.12362421  1.0
  Zr  Zr12  1  0.57130396  0.56417518  0.93226043  1.0
  Zr  Zr13  1  0.56584551  0.93448204  0.93382794  1.0
  Zr  Zr14  1  0.93226043  0.56417518  0.57130396  1.0
  Zr  Zr15  1  0.56584551  0.93448204  0.56584551  1.0
  Cu  Cu16  1  0.33252658  0.34033851  0.33252658  1.0
  Cu  Cu17  1  0.99460834  0.34033851  0.33252658  1.0
  Cu  Cu18  1  0.33252658  0.34033851  0.99460834  1.0
  Cu  Cu19  1  0.91231591  0.26305328  0.91231591  1.0
  Ir  Ir20  1  0.28701421  0.90634684  0.90331947  1.0
  Ir  Ir21  1  0.90331947  0.90634684  0.90331947  1.0
  Ir  Ir22  1  0.90331947  0.90634684  0.28701421  1.0
  Ir  Ir23  1  0.34601040  0.96196781  0.34601040  1.0
  O  O24  1  0.62422814  0.62527872  0.62422814  1.0
  O  O25  1  0.12626600  0.62527872  0.62422814  1.0
  O  O26  1  0.62422814  0.62527872  0.12626600  1.0
  O  O27  1  0.62465599  0.12603104  0.62465599  1.0