# generated using pymatgen
data_Fe3Co3S2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94300000
_cell_length_b   6.99800000
_cell_length_c   5.30000000
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.07500000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co3S2
_chemical_formula_sum   'Fe6 Co6 S4'
_cell_volume   183.30901293
_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  0.84819000  0.25000000  0.08571000  1
  S  S1  1  0.15181000  0.75000000  0.91429000  1
  S  S2  1  0.34944000  0.25000000  0.42213000  1
  S  S3  1  0.65056000  0.75000000  0.57787000  1
  Co  Co4  1  0.73237000  0.05717000  0.40123000  1
  Co  Co5  1  0.26763000  0.94283000  0.59877000  1
  Co  Co6  1  0.26763000  0.55717000  0.59877000  1
  Co  Co7  1  0.73237000  0.44283000  0.40123000  1
  Co  Co8  1  0.02807000  0.25000000  0.70549000  1
  Co  Co9  1  0.97193000  0.75000000  0.29451000  1
  Fe  Fe10  1  0.76967000  0.94793000  0.89769000  1
  Fe  Fe11  1  0.23033000  0.05207000  0.10231000  1
  Fe  Fe12  1  0.23033000  0.44793000  0.10231000  1
  Fe  Fe13  1  0.76967000  0.55207000  0.89769000  1
  Fe  Fe14  1  0.52835000  0.25000000  0.79795000  1
  Fe  Fe15  1  0.47165000  0.75000000  0.20205000  1
