# generated using pymatgen
data_YbCuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.88382164
_cell_length_b   6.19212772
_cell_length_c   13.15281495
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbCuS2
_chemical_formula_sum   'Yb4 Cu4 S8'
_cell_volume   316.31362003
_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
  Yb  Yb0  1  0.25000000  0.00055095  0.63413834  1.0
  Yb  Yb1  1  0.75000000  0.50055095  0.86586166  1.0
  Yb  Yb2  1  0.75000000  0.99944905  0.36586166  1.0
  Yb  Yb3  1  0.25000000  0.49944905  0.13413834  1.0
  Cu  Cu4  1  0.25000000  0.11767811  0.95322308  1.0
  Cu  Cu5  1  0.25000000  0.38232189  0.45322308  1.0
  Cu  Cu6  1  0.75000000  0.88232189  0.04677692  1.0
  Cu  Cu7  1  0.75000000  0.61767811  0.54677692  1.0
  S  S8  1  0.25000000  0.75839110  0.46042728  1.0
  S  S9  1  0.75000000  0.24160890  0.53957272  1.0
  S  S10  1  0.75000000  0.73620814  0.20614833  1.0
  S  S11  1  0.25000000  0.74160890  0.96042728  1.0
  S  S12  1  0.25000000  0.23620814  0.29385167  1.0
  S  S13  1  0.75000000  0.25839110  0.03957272  1.0
  S  S14  1  0.75000000  0.76379186  0.70614833  1.0
  S  S15  1  0.25000000  0.26379186  0.79385167  1.0