# generated using pymatgen
data_FeCo5S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88400000
_cell_length_b   6.80600000
_cell_length_c   5.39000000
_cell_angle_alpha   90.20800000
_cell_angle_beta   89.40500000
_cell_angle_gamma   92.41700000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo5S2
_chemical_formula_sum   'Fe2 Co10 S4'
_cell_volume   178.99635731
_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  0.03726000  0.74963000  0.87945000  1
  S  S1  1  0.96274000  0.25037000  0.12055000  1
  S  S2  1  0.54546000  0.24293000  0.62251000  1
  S  S3  1  0.45454000  0.75707000  0.37749000  1
  Co  Co4  1  0.83572000  0.06337000  0.81469000  1
  Co  Co5  1  0.16428000  0.93663000  0.18531000  1
  Co  Co6  1  0.32750000  0.94061000  0.68208000  1
  Co  Co7  1  0.67250000  0.05939000  0.31792000  1
  Co  Co8  1  0.16441000  0.55760000  0.18242000  1
  Co  Co9  1  0.83559000  0.44240000  0.81758000  1
  Co  Co10  1  0.37827000  0.25096000  0.99091000  1
  Co  Co11  1  0.62173000  0.74904000  0.00909000  1
  Co  Co12  1  0.86710000  0.74916000  0.51518000  1
  Co  Co13  1  0.13290000  0.25084000  0.48482000  1
  Fe  Fe14  1  0.65403000  0.44344000  0.30674000  1
  Fe  Fe15  1  0.34597000  0.55656000  0.69326000  1
