# generated using pymatgen
data_FeCo5S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83300000
_cell_length_b   5.33100000
_cell_length_c   8.61276000
_cell_angle_alpha   90.00000000
_cell_angle_beta   34.79797000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo5S2
_chemical_formula_sum   'Fe2 Co10 S4'
_cell_volume   179.04347814
_cell_formula_units_Z   2
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
  S  S0  1  0.00874000  0.86461000  0.98824000  1
  S  S1  1  0.00874000  0.13539000  0.48824000  1
  S  S2  1  0.43637000  0.62396000  0.06828000  1
  S  S3  1  0.43637000  0.37604000  0.56828000  1
  Co  Co4  1  0.94454000  0.56536000  0.86250000  1
  Co  Co5  1  0.94454000  0.43464000  0.36250000  1
  Co  Co6  1  0.48640000  0.92996000  0.20532000  1
  Co  Co7  1  0.48640000  0.07004000  0.70532000  1
  Co  Co8  1  0.32363000  0.44250000  0.36842000  1
  Co  Co9  1  0.32363000  0.55750000  0.86842000  1
  Co  Co10  1  0.59332000  0.74816000  0.40553000  1
  Co  Co11  1  0.59332000  0.25184000  0.90553000  1
  Co  Co12  1  0.84033000  0.76819000  0.66062000  1
  Co  Co13  1  0.84033000  0.23181000  0.16062000  1
  Fe  Fe14  1  0.11699000  0.06096000  0.69081000  1
  Fe  Fe15  1  0.11699000  0.93904000  0.19081000  1
