# generated using pymatgen
data_CaIn(CuO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17296261
_cell_length_b   6.17296238
_cell_length_c   6.17296184
_cell_angle_alpha   126.18319377
_cell_angle_beta   126.18319325
_cell_angle_gamma   79.58725738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaIn(CuO2)4
_chemical_formula_sum   'Ca1 In1 Cu4 O8'
_cell_volume   148.06946193
_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
  Ca  Ca0  1  0.00000000  0.00000000  0.00000000  1.0
  In  In1  1  0.75000000  0.25000000  0.50000000  1.0
  Cu  Cu2  1  0.87220972  0.63186789  0.25408810  1.0
  Cu  Cu3  1  0.37777979  0.61812162  0.74591190  1.0
  Cu  Cu4  1  0.38187838  0.12779028  0.75965716  1.0
  Cu  Cu5  1  0.36813211  0.62222021  0.24034284  1.0
  O  O6  1  0.01274189  0.96027683  0.37867432  1.0
  O  O7  1  0.03972317  0.41839749  0.05246506  1.0
  O  O8  1  0.36593243  0.98725811  0.94753494  1.0
  O  O9  1  0.15941624  0.58046191  0.84358996  1.0
  O  O10  1  0.41953809  0.26312805  0.57895434  1.0
  O  O11  1  0.68417372  0.84058376  0.42104566  1.0
  O  O12  1  0.58160251  0.63406757  0.62132568  1.0
  O  O13  1  0.73687195  0.31582628  0.15641004  1.0