# generated using pymatgen
data_Fe3Co3S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.50200000
_cell_length_b   9.99800000
_cell_length_c   6.77200000
_cell_angle_alpha   77.65000000
_cell_angle_beta   104.95800000
_cell_angle_gamma   89.55800000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co3S2
_chemical_formula_sum   'Fe6 Co6 S4'
_cell_volume   223.27488054
_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
  Fe  Fe0  1  0.99080000  0.22338000  0.96920000  1
  Fe  Fe1  1  0.00920000  0.77662000  0.03080000  1
  Fe  Fe2  1  0.35969000  0.33326000  0.71205000  1
  Fe  Fe3  1  0.64031000  0.66674000  0.28795000  1
  Fe  Fe4  1  0.82335000  0.73885000  0.65734000  1
  Fe  Fe5  1  0.17665000  0.26115000  0.34266000  1
  Co  Co6  1  0.46009000  0.62258000  0.92561000  1
  Co  Co7  1  0.53991000  0.37742000  0.07439000  1
  Co  Co8  1  0.72443000  0.42629000  0.44574000  1
  Co  Co9  1  0.27557000  0.57371000  0.55426000  1
  Co  Co10  1  0.90849000  0.48347000  0.81627000  1
  Co  Co11  1  0.09151000  0.51653000  0.18373000  1
  S  S12  1  0.82407000  0.20311000  0.63492000  1
  S  S13  1  0.17593000  0.79689000  0.36508000  1
  S  S14  1  0.40465000  0.85960000  0.82477000  1
  S  S15  1  0.59535000  0.14040000  0.17523000  1
