# generated using pymatgen
data_NaFe3NiAs12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.16563297
_cell_length_b   7.16563263
_cell_length_c   7.16563362
_cell_angle_alpha   109.37985773
_cell_angle_beta   109.37985299
_cell_angle_gamma   109.37984645
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaFe3NiAs12
_chemical_formula_sum   'Na1 Fe3 Ni1 As12'
_cell_volume   284.18574917
_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
  Na  Na0  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe1  1  0.50000000  0.00000000  0.00000000  1.0
  Fe  Fe2  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe3  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni4  1  0.50000000  0.50000000  0.50000000  1.0
  As  As5  1  0.85297902  0.65828875  0.50379875  1.0
  As  As6  1  0.14702098  0.34171125  0.49620125  1.0
  As  As7  1  0.15403453  0.65932422  0.81195950  1.0
  As  As8  1  0.84596547  0.34067578  0.18804050  1.0
  As  As9  1  0.65828875  0.50379875  0.85297902  1.0
  As  As10  1  0.34171125  0.49620125  0.14702098  1.0
  As  As11  1  0.65932422  0.81195950  0.15403453  1.0
  As  As12  1  0.34067578  0.18804050  0.84596547  1.0
  As  As13  1  0.50379875  0.85297902  0.65828875  1.0
  As  As14  1  0.49620125  0.14702098  0.34171125  1.0
  As  As15  1  0.18804050  0.84596547  0.34067578  1.0
  As  As16  1  0.81195950  0.15403453  0.65932422  1.0