# generated using pymatgen
data_LiGaI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.46892782
_cell_length_b   7.20519827
_cell_length_c   8.49154513
_cell_angle_alpha   87.90341096
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGaI3
_chemical_formula_sum   'Li4 Ga4 I12'
_cell_volume   701.23672351
_cell_formula_units_Z   4
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
  Li  Li0  1  0.50000000  0.00000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  -0.00000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Li  Li3  1  0.00000000  0.50000000  -0.00000000  1
  Ga  Ga4  1  0.25000000  0.03249051  0.96936717  1
  Ga  Ga5  1  0.75000000  0.86790360  0.75986173  1
  Ga  Ga6  1  0.75000000  0.96750949  0.03063283  1
  Ga  Ga7  1  0.25000000  0.13209640  0.24013827  1
  I  I8  1  0.75000000  0.32663962  0.06483306  1
  I  I9  1  0.57033794  0.66456083  0.68365767  1
  I  I10  1  0.07033794  0.33543917  0.31634233  1
  I  I11  1  0.42966206  0.33543917  0.31634233  1
  I  I12  1  0.07092418  0.17718678  0.81378073  1
  I  I13  1  0.57092418  0.82281322  0.18621927  1
  I  I14  1  0.92907582  0.82281322  0.18621927  1
  I  I15  1  0.42907582  0.17718678  0.81378073  1
  I  I16  1  0.25000000  0.67336038  0.93516694  1
  I  I17  1  0.75000000  0.13924318  0.54705522  1
  I  I18  1  0.25000000  0.86075682  0.45294478  1
  I  I19  1  0.92966206  0.66456083  0.68365767  1
