# generated using pymatgen
data_Fe6ClO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.56614391
_cell_length_b   8.56614391
_cell_length_c   8.56614391
_cell_angle_alpha   105.21680204
_cell_angle_beta   105.21680204
_cell_angle_gamma   118.36297550
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe6ClO12
_chemical_formula_sum   'Fe12 Cl2 O24'
_cell_volume   475.01370037
_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  0.16829300  0.35254100  0.52083500  1.0
  Fe  Fe1  1  0.83275700  0.01784000  0.51555100  1.0
  Fe  Fe2  1  0.49771100  0.68279300  0.51555100  1.0
  Fe  Fe3  1  0.16724300  0.98216000  0.48445000  1.0
  Fe  Fe4  1  0.83170700  0.64745900  0.47916500  1.0
  Fe  Fe5  1  0.50228900  0.31720700  0.48445000  1.0
  Fe  Fe6  1  0.35254100  0.83170700  0.18424800  1.0
  Fe  Fe7  1  0.68279300  0.16724300  0.18508200  1.0
  Fe  Fe8  1  0.01784000  0.50228900  0.18508200  1.0
  Fe  Fe9  1  0.64745900  0.16829300  0.81575200  1.0
  Fe  Fe10  1  0.98216000  0.49771100  0.81491800  1.0
  Fe  Fe11  1  0.31720700  0.83275700  0.81491800  1.0
  Cl  Cl12  1  0.88812000  0.88812000  0.00000000  1.0
  Cl  Cl13  1  0.11188000  0.11188000  0.00000000  1.0
  O  O14  1  0.48275000  0.11741600  0.93574600  1.0
  O  O15  1  0.15396300  0.78167500  0.93563800  1.0
  O  O16  1  0.81833000  0.45299600  0.93574600  1.0
  O  O17  1  0.84603700  0.21832500  0.06436200  1.0
  O  O18  1  0.51725000  0.88258400  0.06425400  1.0
  O  O19  1  0.18167000  0.54700400  0.06425400  1.0
  O  O20  1  0.49676500  0.88004500  0.70747700  1.0
  O  O21  1  0.16550600  0.54480600  0.71031200  1.0
  O  O22  1  0.82743200  0.21071100  0.70747700  1.0
  O  O23  1  0.83449400  0.45519400  0.28968800  1.0
  O  O24  1  0.50323500  0.11995500  0.29252300  1.0
  O  O25  1  0.17256800  0.78928900  0.29252300  1.0
  O  O26  1  0.88258400  0.81833000  0.36533400  1.0
  O  O27  1  0.54700400  0.48275000  0.36533400  1.0
  O  O28  1  0.21832500  0.15396300  0.37228700  1.0
  O  O29  1  0.45299600  0.51725000  0.63466600  1.0
  O  O30  1  0.11741600  0.18167000  0.63466600  1.0
  O  O31  1  0.78167500  0.84603700  0.62771300  1.0
  O  O32  1  0.11995500  0.82743200  0.61672000  1.0
  O  O33  1  0.78928900  0.49676500  0.61672000  1.0
  O  O34  1  0.45519400  0.16550600  0.62070000  1.0
  O  O35  1  0.21071100  0.50323500  0.38328000  1.0
  O  O36  1  0.88004500  0.17256800  0.38328000  1.0
  O  O37  1  0.54480600  0.83449400  0.37930000  1.0