# generated using pymatgen
data_Fe3Co3S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93600000
_cell_length_b   7.02100000
_cell_length_c   5.29200000
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.48600000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co3S2
_chemical_formula_sum   'Fe6 Co6 S4'
_cell_volume   183.39035180
_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  0.03602000  0.00000000  0.04593000  1
  S  S1  1  0.73939000  0.50000000  0.89122000  1
  S  S2  1  0.53242000  0.00000000  0.38118000  1
  S  S3  1  0.22857000  0.50000000  0.55409000  1
  Co  Co4  1  0.11949000  0.30657000  0.87042000  1
  Co  Co5  1  0.11949000  0.69343000  0.87042000  1
  Co  Co6  1  0.65313000  0.19427000  0.06747000  1
  Co  Co7  1  0.65313000  0.80573000  0.06747000  1
  Co  Co8  1  0.91006000  0.50000000  0.26678000  1
  Co  Co9  1  0.35663000  0.00000000  0.76336000  1
  Fe  Fe10  1  0.14913000  0.19798000  0.36856000  1
  Fe  Fe11  1  0.14913000  0.80202000  0.36856000  1
  Fe  Fe12  1  0.61616000  0.30135000  0.57118000  1
  Fe  Fe13  1  0.61616000  0.69865000  0.57118000  1
  Fe  Fe14  1  0.85638000  0.00000000  0.66963000  1
  Fe  Fe15  1  0.41272000  0.50000000  0.17291000  1
