# generated using pymatgen
data_FeCo5S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.77800000
_cell_length_b   4.74900000
_cell_length_c   5.52700000
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.92400000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo5S2
_chemical_formula_sum   'Fe2 Co10 S4'
_cell_volume   177.90690998
_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  0.00460000  0.79802000  0.00793000  1
  S  S1  1  0.00460000  0.20198000  0.50793000  1
  S  S2  1  0.49385000  0.70821000  0.76025000  1
  S  S3  1  0.49385000  0.29179000  0.26025000  1
  Co  Co4  1  0.31140000  0.58923000  0.06324000  1
  Co  Co5  1  0.31140000  0.41077000  0.56324000  1
  Co  Co6  1  0.18773000  0.90895000  0.70468000  1
  Co  Co7  1  0.18773000  0.09105000  0.20468000  1
  Co  Co8  1  0.80970000  0.90045000  0.70102000  1
  Co  Co9  1  0.80970000  0.09955000  0.20102000  1
  Co  Co10  1  0.50302000  0.12866000  0.89953000  1
  Co  Co11  1  0.50302000  0.87134000  0.39953000  1
  Co  Co12  1  0.99713000  0.37621000  0.86546000  1
  Co  Co13  1  0.99713000  0.62379000  0.36546000  1
  Fe  Fe14  1  0.69249000  0.59865000  0.07189000  1
  Fe  Fe15  1  0.69249000  0.40135000  0.57189000  1
