# generated using pymatgen
data_Cu11S16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94236571
_cell_length_b   5.94236571
_cell_length_c   23.34192003
_cell_angle_alpha   81.04027067
_cell_angle_beta   81.04027067
_cell_angle_gamma   36.97118070
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu11S16
_chemical_formula_sum   'Cu11 S16'
_cell_volume   488.98139811
_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
  Cu  Cu0  1  0.07491100  0.07491100  0.07091500  1.0
  Cu  Cu1  1  0.79495400  0.79495400  0.26155700  1.0
  Cu  Cu2  1  0.56459400  0.56459400  0.20373200  1.0
  Cu  Cu3  1  0.03764500  0.03764500  0.34147500  1.0
  Cu  Cu4  1  0.57587300  0.57587300  0.44399500  1.0
  Cu  Cu5  1  0.29550300  0.29550300  0.63321400  1.0
  Cu  Cu6  1  0.06645800  0.06645800  0.57655700  1.0
  Cu  Cu7  1  0.53937700  0.53937700  0.71334000  1.0
  Cu  Cu8  1  0.30204800  0.30204800  0.89644200  1.0
  Cu  Cu9  1  0.06531800  0.06531800  0.82274300  1.0
  Cu  Cu10  1  0.53985100  0.53985100  0.96996100  1.0
  S  S11  1  0.94154800  0.94154800  0.00646400  1.0
  S  S12  1  0.51076300  0.51076300  0.11521600  1.0
  S  S13  1  0.26219100  0.26219100  0.10603400  1.0
  S  S14  1  0.99914300  0.99914300  0.24811200  1.0
  S  S15  1  0.76033100  0.76033100  0.15556900  1.0
  S  S16  1  0.44661400  0.44661400  0.37872100  1.0
  S  S17  1  0.23661500  0.23661500  0.30885000  1.0
  S  S18  1  0.01056200  0.01056200  0.48855200  1.0
  S  S19  1  0.76258900  0.76258900  0.47861700  1.0
  S  S20  1  0.49890100  0.49890100  0.62122600  1.0
  S  S21  1  0.26084000  0.26084000  0.52870500  1.0
  S  S22  1  0.94085800  0.94085800  0.75650100  1.0
  S  S23  1  0.73661000  0.73661000  0.67967000  1.0
  S  S24  1  0.51171700  0.51171700  0.87603500  1.0
  S  S25  1  0.26389600  0.26389600  0.80740600  1.0
  S  S26  1  0.74279500  0.74279500  0.94851200  1.0