# generated using pymatgen
data_SrCuO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.59470019
_cell_length_b   3.92119811
_cell_length_c   8.29855074
_cell_angle_alpha   90.00000000
_cell_angle_beta   102.50859537
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCuO2
_chemical_formula_sum   'Sr2 Cu2 O4'
_cell_volume   114.19596967
_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
  Sr  Sr0  1  0.33255387  0.75000000  0.66510775  1.0
  Sr  Sr1  1  0.66744613  0.25000000  0.33489225  1.0
  Cu  Cu2  1  0.93714889  0.25000000  0.87429877  1.0
  Cu  Cu3  1  0.06285111  0.75000000  0.12570123  1.0
  O  O4  1  0.17960206  0.75000000  0.35920611  1.0
  O  O5  1  0.82039794  0.25000000  0.64079389  1.0
  O  O6  1  0.05390671  0.25000000  0.10781241  1.0
  O  O7  1  0.94609329  0.75000000  0.89218759  1.0