# generated using pymatgen
data_CsFe2Se3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80175112
_cell_length_b   7.80175112
_cell_length_c   6.08571887
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   103.79076698
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsFe2Se3
_chemical_formula_sum   'Cs2 Fe4 Se6'
_cell_volume   359.74315432
_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
  Cs  Cs0  1  0.33799796  0.66200204  0.75000000  1.0
  Cs  Cs1  1  0.66200204  0.33799796  0.25000000  1.0
  Fe  Fe2  1  0.13639349  0.13639349  -0.00000000  1.0
  Fe  Fe3  1  0.13639349  0.13639349  0.50000000  1.0
  Fe  Fe4  1  0.86360651  0.86360651  0.00000000  1.0
  Fe  Fe5  1  0.86360651  0.86360651  0.50000000  1.0
  Se  Se6  1  0.87809975  0.12190025  0.75000000  1.0
  Se  Se7  1  0.12190025  0.87809975  0.25000000  1.0
  Se  Se8  1  0.37645274  0.15810290  0.75000000  1.0
  Se  Se9  1  0.15810290  0.37645274  0.25000000  1.0
  Se  Se10  1  0.62354726  0.84189710  0.25000000  1.0
  Se  Se11  1  0.84189710  0.62354726  0.75000000  1.0