# generated using pymatgen
data_Fe4S5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.85387303
_cell_length_b   7.85835612
_cell_length_c   10.20474771
_cell_angle_alpha   89.26431358
_cell_angle_beta   91.28775421
_cell_angle_gamma   90.00550235
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4S5
_chemical_formula_sum   'Fe8 S10'
_cell_volume   629.61105203
_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  0.29209700  0.09649600  0.99627200  1.0
  Fe  Fe1  1  0.59497900  0.20501300  0.99520200  1.0
  Fe  Fe2  1  0.90088500  0.29382700  0.00451100  1.0
  Fe  Fe3  1  0.20443500  0.40195200  0.00575700  1.0
  Fe  Fe4  1  0.70781000  0.90342100  0.99634200  1.0
  Fe  Fe5  1  0.40480200  0.79454900  0.99485600  1.0
  Fe  Fe6  1  0.09923500  0.70610000  0.00424500  1.0
  Fe  Fe7  1  0.79566200  0.59775300  0.00558000  1.0
  S  S8  1  0.79002000  0.11029700  0.87540400  1.0
  S  S9  1  0.10846500  0.20097100  0.12440300  1.0
  S  S10  1  0.38606900  0.29779500  0.87685100  1.0
  S  S11  1  0.70497100  0.39046900  0.12227200  1.0
  S  S12  1  0.99647900  0.50178900  0.88393400  1.0
  S  S13  1  0.20320100  0.89357400  0.87498200  1.0
  S  S14  1  0.89873700  0.79451200  0.12417400  1.0
  S  S15  1  0.60701400  0.70622000  0.87624900  1.0
  S  S16  1  0.30187100  0.60554600  0.12229100  1.0
  S  S17  1  0.50326800  0.99771700  0.11667500  1.0