# generated using pymatgen
data_Fe2SnS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.00039312
_cell_length_b   7.00039312
_cell_length_c   7.00039312
_cell_angle_alpha   120.46177104
_cell_angle_beta   119.07313008
_cell_angle_gamma   90.40743900
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2SnS4
_chemical_formula_sum   'Fe4 Sn2 S8'
_cell_volume   243.38018844
_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  0.61747200  0.86747200  0.75000000  1.0
  Fe  Fe1  1  0.38252800  0.13252800  0.25000000  1.0
  Fe  Fe2  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe3  1  0.00000000  0.50000000  0.00000000  1.0
  Sn  Sn4  1  0.00000000  0.50000000  0.50000000  1.0
  Sn  Sn5  1  0.50000000  0.50000000  0.00000000  1.0
  S  S6  1  0.23661600  0.75815500  0.02153900  1.0
  S  S7  1  0.23661600  0.21507700  0.47846100  1.0
  S  S8  1  0.76378600  0.23852100  0.52526400  1.0
  S  S9  1  0.78674300  0.76147900  0.02526400  1.0
  S  S10  1  0.76338400  0.78492300  0.52153900  1.0
  S  S11  1  0.76338400  0.24184500  0.97846100  1.0
  S  S12  1  0.21325700  0.23852100  0.97473600  1.0
  S  S13  1  0.23621400  0.76147900  0.47473600  1.0