# generated using pymatgen
data_Nd4GaI5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.05545447
_cell_length_b   10.05545522
_cell_length_c   9.03805359
_cell_angle_alpha   77.60304195
_cell_angle_beta   77.60304019
_cell_angle_gamma   24.94377069
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4GaI5
_chemical_formula_sum   'Nd4 Ga1 I5'
_cell_volume   375.96852673
_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
  Nd  Nd0  1  0.85076982  0.85076982  0.07573301  1.0
  Nd  Nd1  1  0.14923018  0.14923018  0.92426699  1.0
  Nd  Nd2  1  0.50012236  0.50012236  0.21945650  1.0
  Nd  Nd3  1  0.49987764  0.49987764  0.78054350  1.0
  Ga  Ga4  1  0.00000000  0.00000000  0.00000000  1.0
  I  I5  1  0.67202854  0.67202854  0.17552265  1.0
  I  I6  1  0.32797146  0.32797146  0.82447735  1.0
  I  I7  1  0.66782985  0.66782985  0.65949918  1.0
  I  I8  1  0.33217015  0.33217015  0.34050082  1.0
  I  I9  1  0.00000000  0.00000000  0.50000000  1.0