data_Ge5S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61
_cell_length_b   5.61
_cell_length_c   8.23
_cell_angle_alpha   118.63
_cell_angle_beta   118.63
_cell_angle_gamma   33.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge5S
_chemical_formula_sum   'Ge5 S1'
_cell_volume   124.42
_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
  Ge  Ge0  1  0.14  0.0  0.19  1.0
  Ge  Ge1  1  0.09  0.0  0.73  1.0
  Ge  Ge2  1  0.69  0.0  0.55  1.0
  Ge  Ge3  1  0.01  0.0  0.73  1.0
  Ge  Ge4  1  0.31  0.0  0.7  1.0
  S  S5  1  0.97  0.0  0.53  1.0

data_Ge5S
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   5.61
_cell_length_c   7.41
_cell_angle_alpha   77.05
_cell_angle_beta   77.32
_cell_angle_gamma   73.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge5S
_chemical_formula_sum   'Ge5 S1'
_cell_volume   124.42
_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
  Ge  Ge0  1  0.0  0.13  0.55  1.0
  Ge  Ge1  1  0.0  0.28  0.73  1.0
  Ge  Ge2  1  0.0  0.36  0.73  1.0
  Ge  Ge3  1  0.0  0.6  0.7  1.0
  Ge  Ge4  1  0.0  0.94  0.19  1.0
  S  S5  1  0.0  0.44  0.53  1.0

Ge Ge Ge Ge Ge S