# generated using pymatgen
data_Co6Ni2IrS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.95742504
_cell_length_b   6.95741320
_cell_length_c   6.95071646
_cell_angle_alpha   60.03226293
_cell_angle_beta   60.03227214
_cell_angle_gamma   60.04807468
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co6Ni2IrS8
_chemical_formula_sum   'Co6 Ni2 Ir1 S8'
_cell_volume   238.11143184
_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
  Co  Co0  1  0.12594329  0.12594182  0.62372524  1.0
  Co  Co1  1  0.12593551  0.12593454  0.12439222  1.0
  Co  Co2  1  0.37671288  0.87408401  0.87460547  1.0
  Co  Co3  1  0.87408284  0.37671355  0.87460470  1.0
  Co  Co4  1  0.87322598  0.87322570  0.37942905  1.0
  Co  Co5  1  0.87321980  0.87322027  0.87412116  1.0
  Ni  Ni6  1  0.61801705  0.12815621  0.12692828  1.0
  Ni  Ni7  1  0.12815619  0.61802038  0.12692205  1.0
  Ir  Ir8  1  0.50199747  0.50199575  0.49800005  1.0
  S  S9  1  0.24404465  0.24404592  0.25594966  1.0
  S  S10  1  0.74807504  0.74807488  0.75192097  1.0
  S  S11  1  0.74822379  0.25657202  0.25685977  1.0
  S  S12  1  0.74822021  0.25657510  0.73834086  1.0
  S  S13  1  0.74363308  0.74363508  0.25636489  1.0
  S  S14  1  0.25657722  0.74822044  0.73833850  1.0
  S  S15  1  0.25657341  0.74822421  0.25685905  1.0
  S  S16  1  0.25736459  0.25736311  0.74263708  1.0