data_Rb2Ge2S5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.21
_cell_length_b   11.21
_cell_length_c   9.31
_cell_angle_alpha   100.41
_cell_angle_beta   100.41
_cell_angle_gamma   90.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Rb2Ge2S5
_chemical_formula_sum   'Rb8 Ge8 S20'
_cell_volume   1129.81
_cell_formula_units_Z   4
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
  Rb  Rb0  1  0.31  0.1  0.86  1.0
  Rb  Rb1  1  0.93  0.1  0.63  1.0
  Rb  Rb2  1  0.12  0.9  0.13  1.0
  Rb  Rb3  1  0.51  0.9  0.37  1.0
  Rb  Rb4  1  0.63  0.82  0.64  1.0
  Rb  Rb5  1  0.62  0.82  0.85  1.0
  Rb  Rb6  1  0.81  0.18  0.35  1.0
  Rb  Rb7  1  0.82  0.18  0.15  1.0
  Ge  Ge8  1  0.58  0.06  0.59  1.0
  Ge  Ge9  1  0.04  0.06  0.91  1.0
  Ge  Ge10  1  0.85  0.94  0.41  1.0
  Ge  Ge11  1  0.39  0.94  0.09  1.0
  Ge  Ge12  1  0.75  0.3  0.96  1.0
  Ge  Ge13  1  0.49  0.3  0.53  1.0
  Ge  Ge14  1  0.68  0.7  0.03  1.0
  Ge  Ge15  1  0.94  0.7  0.46  1.0
  S  S16  1  0.97  0.39  0.34  1.0
  S  S17  1  0.66  0.39  0.16  1.0
  S  S18  1  0.47  0.61  0.65  1.0
  S  S19  1  0.77  0.61  0.84  1.0
  S  S20  1  0.19  0.57  0.16  1.0
  S  S21  1  0.44  0.57  0.34  1.0
  S  S22  1  0.25  0.43  0.84  1.0
  S  S23  1  1.0  0.43  0.66  1.0
  S  S24  1  0.79  0.88  0.9  1.0
  S  S25  1  0.46  0.88  0.59  1.0
  S  S26  1  0.65  0.12  0.09  1.0
  S  S27  1  0.98  0.12  0.41  1.0
  S  S28  1  0.51  0.95  0.78  1.0
  S  S29  1  0.74  0.95  0.72  1.0
  S  S30  1  0.93  0.05  0.22  1.0
  S  S31  1  0.7  0.05  0.28  1.0
  S  S32  1  0.31  0.05  0.25  1.0
  S  S33  1  0.12  0.95  0.75  1.0
  S  S34  1  0.31  0.75  0.25  1.0
  S  S35  1  0.12  0.25  0.75  1.0

data_Rb2Ge2S5
_symmetry_space_group_name_H-M   P-1
_cell_length_a   9.31
_cell_length_b   11.21
_cell_length_c   11.21
_cell_angle_alpha   90.23
_cell_angle_beta   100.41
_cell_angle_gamma   100.41
_symmetry_Int_Tables_number   2
_chemical_formula_structural   Rb2Ge2S5
_chemical_formula_sum   'Rb8 Ge8 S20'
_cell_volume   1129.81
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Rb  Rb0  2  0.13  0.71  0.1  1.0
  Rb  Rb1  2  0.15  0.41  0.82  1.0
  Rb  Rb2  2  0.35  0.4  0.82  1.0
  Rb  Rb3  2  0.37  0.1  0.1  1.0
  Ge  Ge4  2  0.03  0.27  0.3  1.0
  Ge  Ge5  2  0.09  0.37  0.06  1.0
  Ge  Ge6  2  0.41  0.82  0.06  1.0
  Ge  Ge7  2  0.46  0.54  0.3  1.0
  S  S8  2  0.09  0.24  0.88  1.0
  S  S9  2  0.16  0.25  0.61  1.0
  S  S10  2  0.16  0.78  0.43  1.0
  S  S11  2  0.22  0.52  0.95  1.0
  S  S12  2  0.25  0.9  0.25  1.0
  S  S13  2  0.25  0.9  0.95  1.0
  S  S14  2  0.28  0.29  0.95  1.0
  S  S15  2  0.34  0.03  0.43  1.0
  S  S16  2  0.34  0.56  0.61  1.0
  S  S17  2  0.41  0.57  0.88  1.0

Rb Rb Rb Rb Rb Rb Rb Rb Ge Ge Ge Ge Ge Ge Ge Ge S S S S S S S S S S S S S S S S S S S S