# generated using pymatgen
data_Nd2TiFe16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47623122
_cell_length_b   6.47623122
_cell_length_c   6.47623069
_cell_angle_alpha   82.91705809
_cell_angle_beta   82.91705809
_cell_angle_gamma   82.91706348
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2TiFe16
_chemical_formula_sum   'Nd2 Ti1 Fe16'
_cell_volume   265.87694977
_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  0.34191700  0.34191700  0.34191700  1.0
  Nd  Nd1  1  0.65319200  0.65319200  0.65319200  1.0
  Ti  Ti2  1  0.90675800  0.90675800  0.90675800  1.0
  Fe  Fe3  1  0.15774000  0.65860900  0.65860900  1.0
  Fe  Fe4  1  0.65860900  0.65860900  0.15774000  1.0
  Fe  Fe5  1  0.65860900  0.15774000  0.65860900  1.0
  Fe  Fe6  1  0.84493200  0.33978300  0.33978300  1.0
  Fe  Fe7  1  0.33978300  0.33978300  0.84493200  1.0
  Fe  Fe8  1  0.33978300  0.84493200  0.33978300  1.0
  Fe  Fe9  1  0.70718900  0.29342400  0.00052800  1.0
  Fe  Fe10  1  0.29342400  0.00052800  0.70718900  1.0
  Fe  Fe11  1  0.00052800  0.70718900  0.29342400  1.0
  Fe  Fe12  1  0.70718900  0.00052800  0.29342400  1.0
  Fe  Fe13  1  0.00052800  0.29342400  0.70718900  1.0
  Fe  Fe14  1  0.29342400  0.70718900  0.00052800  1.0
  Fe  Fe15  1  0.00059900  0.00059900  0.49727500  1.0
  Fe  Fe16  1  0.00059900  0.49727500  0.00059900  1.0
  Fe  Fe17  1  0.49727500  0.00059900  0.00059900  1.0
  Fe  Fe18  1  0.09791900  0.09791900  0.09791900  1.0