# generated using pymatgen
data_FeCo3S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.76009827
_cell_length_b   7.76009827
_cell_length_c   9.50512897
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo3S8
_chemical_formula_sum   'Fe3 Co9 S24'
_cell_volume   495.70475814
_cell_formula_units_Z   3
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  0.00000000  0.00000000  0.00000000  1
  Fe  Fe1  1  0.66666700  0.33333300  0.33333300  1
  Fe  Fe2  1  0.33333300  0.66666700  0.66666700  1
  Co  Co3  1  0.16666700  0.33333300  0.33333300  1
  Co  Co4  1  0.16666700  0.83333300  0.33333300  1
  Co  Co5  1  0.66666700  0.83333300  0.33333300  1
  Co  Co6  1  0.83333300  0.66666700  0.66666700  1
  Co  Co7  1  0.83333300  0.16666700  0.66666700  1
  Co  Co8  1  0.33333300  0.16666700  0.66666700  1
  Co  Co9  1  0.50000000  0.00000000  0.00000000  1
  Co  Co10  1  0.50000000  0.50000000  0.00000000  1
  Co  Co11  1  0.00000000  0.50000000  0.00000000  1
  S  S12  1  0.65152800  0.07911800  0.46073300  1
  S  S13  1  0.42759000  0.34847200  0.46073300  1
  S  S14  1  0.92088200  0.57241000  0.46073300  1
  S  S15  1  0.00000000  0.00000000  0.61077500  1
  S  S16  1  0.34847200  0.92088200  0.53926700  1
  S  S17  1  0.57241000  0.65152800  0.53926700  1
  S  S18  1  0.07911800  0.42759000  0.53926700  1
  S  S19  1  0.00000000  0.00000000  0.38922500  1
  S  S20  1  0.31819400  0.41245100  0.79406600  1
  S  S21  1  0.09425700  0.68180600  0.79406600  1
  S  S22  1  0.58754900  0.90574300  0.79406600  1
  S  S23  1  0.66666700  0.33333300  0.94410800  1
  S  S24  1  0.01513900  0.25421600  0.87260100  1
  S  S25  1  0.23907700  0.98486100  0.87260100  1
  S  S26  1  0.74578400  0.76092300  0.87260100  1
  S  S27  1  0.66666700  0.33333300  0.72255800  1
  S  S28  1  0.98486100  0.74578400  0.12739900  1
  S  S29  1  0.76092300  0.01513900  0.12739900  1
  S  S30  1  0.25421600  0.23907700  0.12739900  1
  S  S31  1  0.33333300  0.66666700  0.27744200  1
  S  S32  1  0.68180600  0.58754900  0.20593400  1
  S  S33  1  0.90574300  0.31819400  0.20593400  1
  S  S34  1  0.41245100  0.09425700  0.20593400  1
  S  S35  1  0.33333300  0.66666700  0.05589200  1
