# generated using pymatgen
data_MgFeCu2SnS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78157604
_cell_length_b   5.84511104
_cell_length_c   5.78580300
_cell_angle_alpha   90.00281776
_cell_angle_beta   90.00044596
_cell_angle_gamma   89.98655581
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgFeCu2SnS4
_chemical_formula_sum   'Mg1 Fe1 Cu2 Sn1 S4'
_cell_volume   195.52515458
_cell_formula_units_Z   1
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
  Mg  Mg0  1  0.50002400  0.49996200  0.49998500  1.0
  Fe  Fe1  1  0.49998100  0.49999800  0.00005900  1.0
  Cu  Cu2  1  0.00000100  0.50003700  0.50002000  1.0
  Cu  Cu3  1  0.50000000  0.00002000  0.49995200  1.0
  Sn  Sn4  1  0.99999600  0.99997900  0.00005600  1.0
  S  S5  1  0.27019500  0.27039800  0.25944200  1.0
  S  S6  1  0.27017500  0.72968200  0.74050700  1.0
  S  S7  1  0.72980900  0.27035200  0.74054500  1.0
  S  S8  1  0.72981800  0.72957100  0.25943400  1.0