# generated using pymatgen
data_La2Cu2I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28744375
_cell_length_b   4.28744375
_cell_length_c   8.67641051
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999767
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2Cu2I
_chemical_formula_sum   'La2 Cu2 I1'
_cell_volume   138.12350931
_cell_formula_units_Z   1
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
  La  La0  1  0.33333300  0.66666700  0.20546032  1.0
  La  La1  1  0.33333300  0.66666700  0.79453968  1.0
  Cu  Cu2  1  0.66666700  0.33333300  -0.00000000  1.0
  Cu  Cu3  1  0.00000000  -0.00000000  -0.00000000  1.0
  I  I4  1  0.00000000  -0.00000000  0.50000000  1.0