data_Ge3S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64
_cell_length_b   5.53
_cell_length_c   8.24
_cell_angle_alpha   63.86
_cell_angle_beta   40.54
_cell_angle_gamma   75.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge3S2
_chemical_formula_sum   'Ge6 S4'
_cell_volume   201.24
_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
  Ge  Ge0  1  0.15  0.6  0.05  1.0
  Ge  Ge1  1  0.81  0.24  0.05  1.0
  Ge  Ge2  1  0.4  0.78  0.42  1.0
  Ge  Ge3  1  0.57  0.06  0.42  1.0
  Ge  Ge4  1  0.48  0.92  0.52  1.0
  Ge  Ge5  1  0.24  0.46  0.14  1.0
  S  S6  1  0.82  0.18  0.18  1.0
  S  S7  1  0.14  0.66  0.18  1.0
  S  S8  1  0.07  0.12  0.8  1.0
  S  S9  1  0.9  0.72  0.8  1.0

data_Ge3S2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   7.64
_cell_angle_alpha   104.41
_cell_angle_beta   104.41
_cell_angle_gamma   108.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge3S2
_chemical_formula_sum   'Ge6 S4'
_cell_volume   201.24
_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
  Ge  Ge0  1  0.05  0.76  0.86  1.0
  Ge  Ge1  1  0.05  0.4  0.2  1.0
  Ge  Ge2  1  0.14  0.54  0.38  1.0
  Ge  Ge3  1  0.42  0.22  0.82  1.0
  Ge  Ge4  1  0.42  0.94  0.99  1.0
  Ge  Ge5  1  0.52  0.08  0.0  1.0
  S  S6  1  0.18  0.34  0.32  1.0
  S  S7  1  0.18  0.82  0.01  1.0
  S  S8  1  0.8  0.28  0.7  1.0
  S  S9  1  0.8  0.88  0.87  1.0

Ge Ge Ge Ge Ge Ge S S S S