# generated using pymatgen
data_Nd7GaI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.96368260
_cell_length_b   9.96368287
_cell_length_c   9.96368284
_cell_angle_alpha   107.76798706
_cell_angle_beta   107.76798981
_cell_angle_gamma   107.76797957
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd7GaI12
_chemical_formula_sum   'Nd7 Ga1 I12'
_cell_volume   805.88848640
_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  0.81771372  0.53599864  0.60716357  1.0
  Nd  Nd1  1  0.53599864  0.60716357  0.81771372  1.0
  Nd  Nd2  1  0.18228628  0.46400136  0.39283643  1.0
  Nd  Nd3  1  0.46400136  0.39283643  0.18228628  1.0
  Nd  Nd4  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd5  1  0.60716357  0.81771372  0.53599864  1.0
  Nd  Nd6  1  0.39283643  0.18228628  0.46400136  1.0
  Ga  Ga7  1  0.50000000  0.50000000  0.50000000  1.0
  I  I8  1  0.73159323  0.18798728  0.57883933  1.0
  I  I9  1  0.97433244  0.89306339  0.65541824  1.0
  I  I10  1  0.57883933  0.73159323  0.18798728  1.0
  I  I11  1  0.10693661  0.34458176  0.02566756  1.0
  I  I12  1  0.65541824  0.97433244  0.89306339  1.0
  I  I13  1  0.89306339  0.65541824  0.97433244  1.0
  I  I14  1  0.02566756  0.10693661  0.34458176  1.0
  I  I15  1  0.81201272  0.42116067  0.26840677  1.0
  I  I16  1  0.34458176  0.02566756  0.10693661  1.0
  I  I17  1  0.26840677  0.81201272  0.42116067  1.0
  I  I18  1  0.18798728  0.57883933  0.73159323  1.0
  I  I19  1  0.42116067  0.26840677  0.81201272  1.0