# generated using pymatgen
data_FeCo5S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39300000
_cell_length_b   4.85100000
_cell_length_c   6.78200000
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.94100000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo5S2
_chemical_formula_sum   'Fe2 Co10 S4'
_cell_volume   177.42681236
_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  0.85940000  0.00804000  0.75123000  1
  S  S1  1  0.14060000  0.50804000  0.24877000  1
  S  S2  1  0.37621000  0.43888000  0.74135000  1
  S  S3  1  0.62379000  0.93888000  0.25865000  1
  Co  Co4  1  0.06900000  0.28718000  0.56116000  1
  Co  Co5  1  0.93100000  0.78718000  0.43884000  1
  Co  Co6  1  0.43173000  0.63324000  0.44044000  1
  Co  Co7  1  0.56827000  0.13324000  0.55956000  1
  Co  Co8  1  0.43968000  0.64501000  0.05551000  1
  Co  Co9  1  0.56032000  0.14501000  0.94449000  1
  Co  Co10  1  0.22666000  0.84758000  0.75149000  1
  Co  Co11  1  0.77334000  0.34758000  0.24851000  1
  Co  Co12  1  0.24798000  0.08223000  0.24770000  1
  Co  Co13  1  0.75202000  0.58223000  0.75230000  1
  Fe  Fe14  1  0.07343000  0.30813000  0.94105000  1
  Fe  Fe15  1  0.92657000  0.80813000  0.05895000  1
