# generated using pymatgen
data_Nd4Fe4As4O3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.96763858
_cell_length_b   9.96763858
_cell_length_c   9.96763858
_cell_angle_alpha   146.60281824
_cell_angle_beta   146.60281824
_cell_angle_gamma   47.95223678
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4Fe4As4O3F
_chemical_formula_sum   'Nd4 Fe4 As4 O3 F1'
_cell_volume   298.83437004
_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  0.69031100  0.69031100  0.52032700  1.0
  Nd  Nd1  1  0.16998500  0.16998500  0.47967300  1.0
  Nd  Nd2  1  0.30968900  0.83001500  0.00000000  1.0
  Nd  Nd3  1  0.83001500  0.30968900  0.00000000  1.0
  Fe  Fe4  1  0.24977200  0.24977200  0.00000000  1.0
  Fe  Fe5  1  0.75022800  0.75022800  0.00000000  1.0
  Fe  Fe6  1  0.75000000  0.25000000  0.50000000  1.0
  Fe  Fe7  1  0.25000000  0.75000000  0.50000000  1.0
  As  As8  1  0.40984000  0.40984000  0.50235700  1.0
  As  As9  1  0.90748200  0.90748200  0.49764300  1.0
  As  As10  1  0.59016000  0.09251800  0.00000000  1.0
  As  As11  1  0.09251800  0.59016000  0.00000000  1.0
  O  O12  1  0.00000000  0.00000000  0.00000000  1.0
  O  O13  1  0.00000000  0.50000000  0.50000000  1.0
  O  O14  1  0.50000000  0.00000000  0.50000000  1.0
  F  F15  1  0.50000000  0.50000000  0.00000000  1.0