# generated using pymatgen
data_FeCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86554100
_cell_length_b   7.52402576
_cell_length_c   7.67057778
_cell_angle_alpha   77.96127585
_cell_angle_beta   78.40144753
_cell_angle_gamma   84.68770751
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCl3
_chemical_formula_sum   'Fe2 Cl6'
_cell_volume   213.43360333
_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  0.14755400  0.70208900  0.22201400  1.0
  Fe  Fe1  1  0.22558500  0.32647500  0.52975300  1.0
  Cl  Cl2  1  0.31562900  0.25982200  0.79773200  1.0
  Cl  Cl3  1  0.99892300  0.60604300  0.53172900  1.0
  Cl  Cl4  1  0.22623200  0.75079100  0.93368500  1.0
  Cl  Cl5  1  0.01250800  0.08660300  0.50712600  1.0
  Cl  Cl6  1  0.44388800  0.42396800  0.23916500  1.0
  Cl  Cl7  1  0.60742700  0.85649500  0.24069000  1.0