# generated using pymatgen
data_Zr6Zn12Cu11S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.47707551
_cell_length_b   8.47677624
_cell_length_c   8.46907756
_cell_angle_alpha   60.03003872
_cell_angle_beta   60.03120515
_cell_angle_gamma   59.96660059
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Zn12Cu11S
_chemical_formula_sum   'Zr6 Zn12 Cu11 S1'
_cell_volume   430.41648598
_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
  Zr  Zr0  1  0.71526392  0.28495189  0.29286422  1.0
  Zr  Zr1  1  0.28064480  0.71505421  0.71462778  1.0
  Zr  Zr2  1  0.28064480  0.71505421  0.28967322  1.0
  Zr  Zr3  1  0.71526392  0.28495189  0.70692197  1.0
  Zr  Zr4  1  0.29006919  0.28954076  0.71019453  1.0
  Zr  Zr5  1  0.71931490  0.70977614  0.28545498  1.0
  Zn  Zn6  1  0.88209683  0.36067444  0.87861387  1.0
  Zn  Zn7  1  0.63538787  0.12027728  0.12216742  1.0
  Zn  Zn8  1  0.36546015  0.87901225  0.87776280  1.0
  Zn  Zn9  1  0.32800330  0.33308347  0.33196541  1.0
  Zn  Zn10  1  0.66929642  0.66999382  0.66499912  1.0
  Zn  Zn11  1  0.32800330  0.33308347  0.00694982  1.0
  Zn  Zn12  1  0.32752431  0.00778729  0.33234470  1.0
  Zn  Zn13  1  0.66929642  0.66999382  0.99570864  1.0
  Zn  Zn14  1  0.67328186  0.98896516  0.66887599  1.0
  Zn  Zn15  1  0.01424401  0.32873518  0.32851041  1.0
  Zn  Zn16  1  0.98815654  0.67407407  0.66888419  1.0
  Zn  Zn17  1  0.00250808  0.99059556  0.00344818  1.0
  Cu  Cu18  1  0.11926354  0.12059766  0.11965328  1.0
  Cu  Cu19  1  0.87883259  0.88005308  0.87899133  1.0
  Cu  Cu20  1  0.11926354  0.12059766  0.64048552  1.0
  Cu  Cu21  1  0.12160961  0.63395738  0.12221701  1.0
  Cu  Cu22  1  0.87883259  0.88005308  0.36212200  1.0
  Cu  Cu23  1  0.49909392  0.00129501  0.99999329  1.0
  Cu  Cu24  1  0.99944035  0.50027142  0.50092150  1.0
  Cu  Cu25  1  0.99944035  0.50027142  0.99936774  1.0
  Cu  Cu26  1  0.49909392  0.00129501  0.49961978  1.0
  Cu  Cu27  1  0.00000100  0.00128252  0.49935774  1.0
  Cu  Cu28  1  0.50203472  0.49957367  0.99919530  1.0
  S  S29  1  0.49862726  0.50515219  0.49811028  1.0