# generated using pymatgen
data_CaCu4BiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.27404169
_cell_length_b   6.27404201
_cell_length_c   6.27404144
_cell_angle_alpha   125.60267083
_cell_angle_beta   125.60267231
_cell_angle_gamma   80.54215525
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCu4BiO8
_chemical_formula_sum   'Ca1 Cu4 Bi1 O8'
_cell_volume   157.47181471
_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
  Cu  Cu1  1  0.87603647  0.62717650  0.25402924  1.0
  Cu  Cu2  1  0.37314726  0.62200722  0.74597076  1.0
  Cu  Cu3  1  0.37799278  0.12396353  0.75114004  1.0
  Cu  Cu4  1  0.37282350  0.62685274  0.24885996  1.0
  Bi  Bi5  1  0.75000000  0.25000000  0.50000000  1.0
  O  O6  1  0.02337346  0.94447707  0.36987546  1.0
  O  O7  1  0.05552293  0.42539739  0.07889639  1.0
  O  O8  1  0.34650101  0.97662654  0.92110361  1.0
  O  O9  1  0.17279007  0.59238645  0.86325979  1.0
  O  O10  1  0.40761355  0.27087434  0.58040362  1.0
  O  O11  1  0.69046972  0.82720993  0.41959638  1.0
  O  O12  1  0.57460261  0.65349899  0.63012454  1.0
  O  O13  1  0.72912566  0.30953028  0.13674021  1.0