# generated using pymatgen
data_CdSO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89057734
_cell_length_b   4.89057664
_cell_length_c   7.18375609
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.80663794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdSO4
_chemical_formula_sum   'Cd2 S2 O8'
_cell_volume   157.19963519
_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
  Cd  Cd0  1  -0.00000000  0.00000000  0.50000000  1.0
  Cd  Cd1  1  -0.00000000  0.00000000  0.00000000  1.0
  S  S2  1  0.63816894  0.36183106  0.25000000  1.0
  S  S3  1  0.36183106  0.63816894  0.75000000  1.0
  O  O4  1  0.24205239  0.30382625  0.75000000  1.0
  O  O5  1  0.75794761  0.69617375  0.25000000  1.0
  O  O6  1  0.30382625  0.24205239  0.25000000  1.0
  O  O7  1  0.69617375  0.75794761  0.75000000  1.0
  O  O8  1  0.26639597  0.73360403  0.92104949  1.0
  O  O9  1  0.73360403  0.26639597  0.42104949  1.0
  O  O10  1  0.73360403  0.26639597  0.07895051  1.0
  O  O11  1  0.26639597  0.73360403  0.57895051  1.0