data_image0
_chemical_formula_structural       Zr2O2
_chemical_formula_sum              "Zr2 O2"
_cell_length_a       4.143237416410978
_cell_length_b       4.143237634352636
_cell_length_c       17.7829762
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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  Zr1       1.0  0.0  8.027998655908748e-39  0.49999997188322165  1.0000
  Zr  Zr2       1.0  0.5000000004331181  0.5000000006815157  0.5000000388011542  1.0000
  O   O1        1.0  0.0  0.5000000006815157  0.46455163675020833  1.0000
  O   O2        1.0  0.5000000004331181  0.0  0.535448374496503  1.0000