# generated using pymatgen
data_Fe(CoS)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.90424435
_cell_length_b   6.90424435
_cell_length_c   6.90424435
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe(CoS)8
_chemical_formula_sum   'Fe1 Co8 S8'
_cell_volume   232.71986811
_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
  Fe  Fe0  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co1  1  0.62183900  0.12605400  0.12605400  1.0
  Co  Co2  1  0.12605400  0.62183900  0.12605400  1.0
  Co  Co3  1  0.12605400  0.12605400  0.62183900  1.0
  Co  Co4  1  0.12605400  0.12605400  0.12605400  1.0
  Co  Co5  1  0.37816100  0.87394600  0.87394600  1.0
  Co  Co6  1  0.87394600  0.37816100  0.87394600  1.0
  Co  Co7  1  0.87394600  0.87394600  0.37816100  1.0
  Co  Co8  1  0.87394600  0.87394600  0.87394600  1.0
  S  S9  1  0.25000000  0.25000000  0.25000000  1.0
  S  S10  1  0.75000000  0.75000000  0.75000000  1.0
  S  S11  1  0.73512200  0.26487800  0.26487800  1.0
  S  S12  1  0.73512200  0.26487800  0.73512200  1.0
  S  S13  1  0.73512200  0.73512200  0.26487800  1.0
  S  S14  1  0.26487800  0.73512200  0.73512200  1.0
  S  S15  1  0.26487800  0.73512200  0.26487800  1.0
  S  S16  1  0.26487800  0.26487800  0.73512200  1.0