# generated using pymatgen
data_GaCuI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.36998733
_cell_length_b   6.36998755
_cell_length_c   7.19958277
_cell_angle_alpha   116.25621990
_cell_angle_beta   116.25620727
_cell_angle_gamma   89.99999462
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaCuI4
_chemical_formula_sum   'Ga1 Cu1 I4'
_cell_volume   227.90122774
_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
  Ga  Ga0  1  0.25000000  0.75000000  0.50000000  1.0
  Cu  Cu1  1  0.50000000  0.50000000  0.00000000  1.0
  I  I2  1  0.61151939  0.63475255  0.75511314  1.0
  I  I3  1  0.87964041  0.38848061  0.24488686  1.0
  I  I4  1  0.36524745  0.85640724  0.24488686  1.0
  I  I5  1  0.14359276  0.12035959  0.75511314  1.0