data_CuH6Pb4(SO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74
_cell_length_b   7.9
_cell_length_c   7.94
_cell_angle_alpha   112.25
_cell_angle_beta   97.47
_cell_angle_gamma   100.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuH6Pb4(SO7)2
_chemical_formula_sum   'Cu1 H6 Pb4 S2 O14'
_cell_volume   320.26
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  H  H1  1  0.19  0.05  0.44  1.0
  H  H2  1  0.12  0.82  0.84  1.0
  H  H3  1  0.72  0.79  0.23  1.0
  H  H4  1  0.56  0.74  0.95  1.0
  H  H5  1  0.16  0.71  0.33  1.0
  H  H6  1  0.09  0.47  0.73  1.0
  Pb  Pb21  1  0.78  0.99  0.33  1.0
  Pb  Pb22  1  0.32  0.35  0.5  1.0
  Pb  Pb23  1  0.96  0.17  0.68  1.0
  Pb  Pb24  1  0.5  0.54  0.85  1.0
  S  S25  1  0.0  0.83  1.0  1.0
  S  S26  1  0.28  0.69  0.18  1.0
  O  O7  1  0.96  0.94  0.88  1.0
  O  O8  1  0.69  0.2  0.36  1.0
  O  O9  1  0.4  0.72  0.37  1.0
  O  O10  1  0.91  0.74  0.54  1.0
  O  O11  1  0.63  0.14  0.63  1.0
  O  O12  1  0.88  0.13  0.86  1.0
  O  O13  1  0.85  0.75  0.49  1.0
  O  O14  1  0.43  0.77  0.68  1.0
  O  O15  1  0.4  0.4  0.32  1.0
  O  O16  1  0.65  0.39  0.54  1.0
  O  O17  1  0.37  0.78  0.64  1.0
  O  O18  1  0.88  0.81  0.8  1.0
  O  O19  1  0.59  0.33  0.82  1.0
  O  O20  1  0.32  0.58  0.29  1.0

data_CuH6Pb4(SO7)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.74
_cell_length_b   7.9
_cell_length_c   7.94
_cell_angle_alpha   112.25
_cell_angle_beta   97.47
_cell_angle_gamma   100.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuH6Pb4(SO7)2
_chemical_formula_sum   'Cu1 H6 Pb4 S2 O14'
_cell_volume   320.26
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  H  H1  1  0.09  0.47  0.73  1.0
  H  H2  1  0.12  0.82  0.84  1.0
  H  H3  1  0.16  0.71  0.33  1.0
  H  H4  1  0.19  0.05  0.44  1.0
  H  H5  1  0.56  0.74  0.95  1.0
  H  H6  1  0.72  0.79  0.23  1.0
  Pb  Pb7  1  0.32  0.35  0.5  1.0
  Pb  Pb8  1  0.5  0.54  0.85  1.0
  Pb  Pb9  1  0.78  0.99  0.33  1.0
  Pb  Pb10  1  0.96  0.17  0.68  1.0
  S  S11  1  0.0  0.83  1.0  1.0
  S  S12  1  0.28  0.69  0.18  1.0
  O  O13  1  0.32  0.58  0.29  1.0
  O  O14  1  0.37  0.78  0.64  1.0
  O  O15  1  0.4  0.4  0.32  1.0
  O  O16  1  0.4  0.72  0.37  1.0
  O  O17  1  0.43  0.77  0.68  1.0
  O  O18  1  0.59  0.33  0.82  1.0
  O  O19  1  0.63  0.14  0.63  1.0
  O  O20  1  0.65  0.39  0.54  1.0
  O  O21  1  0.69  0.2  0.36  1.0
  O  O22  1  0.85  0.75  0.49  1.0
  O  O23  1  0.88  0.81  0.8  1.0
  O  O24  1  0.88  0.13  0.86  1.0
  O  O25  1  0.91  0.74  0.54  1.0
  O  O26  1  0.96  0.94  0.88  1.0

Cu H H H H H H Pb Pb Pb Pb S S O O O O O O O O O O O O O O