# generated using pymatgen
data_CsVI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.23111885
_cell_length_b   8.23111858
_cell_length_c   6.95105790
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.98621892
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsVI3
_chemical_formula_sum   'Cs2 V2 I6'
_cell_volume   407.90549991
_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  0.66664750  0.33331480  0.75000000  1.0
  Cs  Cs1  1  0.33331480  0.66664750  0.25000000  1.0
  V  V2  1  -0.00001727  -0.00001727  0.50000000  1.0
  V  V3  1  -0.00001727  -0.00001727  -0.00000000  1.0
  I  I4  1  0.67985268  0.83999435  0.74999800  1.0
  I  I5  1  0.83983486  0.16007285  0.25000200  1.0
  I  I6  1  0.16007285  0.83983486  0.74999800  1.0
  I  I7  1  0.32017067  0.16014683  0.25000200  1.0
  I  I8  1  0.83999435  0.67985268  0.25000200  1.0
  I  I9  1  0.16014583  0.32017067  0.74999800  1.0