# generated using pymatgen
data_GeS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60314037
_cell_length_b   4.52312513
_cell_length_c   10.78075161
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeS
_chemical_formula_sum   'Ge4 S4'
_cell_volume   175.69881158
_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
  Ge  Ge0  1  0.25000000  0.36689105  0.87224634  1.0
  Ge  Ge1  1  0.75000000  0.63310895  0.12775366  1.0
  Ge  Ge2  1  0.75000000  0.86689105  0.62775366  1.0
  Ge  Ge3  1  0.25000000  0.13310895  0.37224634  1.0
  S  S4  1  0.25000000  0.51478817  0.65483072  1.0
  S  S5  1  0.75000000  0.48521183  0.34516928  1.0
  S  S6  1  0.75000000  0.01478817  0.84516928  1.0
  S  S7  1  0.25000000  -0.01478817  0.15483072  1.0