# generated using pymatgen
data_Nd2NiGeI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.20351478
_cell_length_b   4.20351575
_cell_length_c   16.92152890
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2NiGeI
_chemical_formula_sum   'Nd4 Ni2 Ge2 I2'
_cell_volume   258.93782065
_cell_formula_units_Z   2
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  0.00000000  0.00000000  0.60863825  1.0
  Nd  Nd1  1  0.00000000  0.00000000  0.39536116  1.0
  Nd  Nd2  1  0.00000000  0.00000000  0.10863825  1.0
  Nd  Nd3  1  0.00000000  0.00000000  0.89536116  1.0
  Ni  Ni4  1  0.66666700  0.33333300  0.98883219  1.0
  Ni  Ni5  1  0.33333300  0.66666700  0.48883219  1.0
  Ge  Ge6  1  0.66666700  0.33333300  0.50818196  1.0
  Ge  Ge7  1  0.33333300  0.66666700  0.00818196  1.0
  I  I8  1  0.66666700  0.33333300  0.24898645  1.0
  I  I9  1  0.33333300  0.66666700  0.74898645  1.0