# generated using pymatgen
data_NaAl6Fe3Si6B3O31
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56266217
_cell_length_b   9.56266217
_cell_length_c   9.56266215
_cell_angle_alpha   113.72685597
_cell_angle_beta   113.72685597
_cell_angle_gamma   113.72685344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAl6Fe3Si6B3O31
_chemical_formula_sum   'Na1 Al6 Fe3 Si6 B3 O31'
_cell_volume   541.86669486
_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  0.21955200  0.21955200  0.21955200  1.0
  Al  Al1  1  0.90486400  0.56639100  0.34893200  1.0
  Al  Al2  1  0.34893200  0.90486400  0.56639100  1.0
  Al  Al3  1  0.56639100  0.34893200  0.90486400  1.0
  Al  Al4  1  0.34893200  0.56639100  0.90486400  1.0
  Al  Al5  1  0.90486400  0.34893200  0.56639100  1.0
  Al  Al6  1  0.56639100  0.90486400  0.34893200  1.0
  Fe  Fe7  1  0.76023500  0.56598700  0.56598700  1.0
  Fe  Fe8  1  0.56598700  0.76023500  0.56598700  1.0
  Fe  Fe9  1  0.56598700  0.56598700  0.76023500  1.0
  Si  Si10  1  0.19329100  0.00036100  0.80974400  1.0
  Si  Si11  1  0.80974400  0.19329100  0.00036100  1.0
  Si  Si12  1  0.00036100  0.80974400  0.19329100  1.0
  Si  Si13  1  0.80974400  0.00036100  0.19329100  1.0
  Si  Si14  1  0.19329100  0.80974400  0.00036100  1.0
  Si  Si15  1  0.00036100  0.19329100  0.80974400  1.0
  B  B16  1  0.56537900  0.56537900  0.23144300  1.0
  B  B17  1  0.23144300  0.56537900  0.56537900  1.0
  B  B18  1  0.56537900  0.23144300  0.56537900  1.0
  O  O19  1  0.75613000  0.75613000  0.75613000  1.0
  O  O20  1  0.54428800  0.54428800  0.35907000  1.0
  O  O21  1  0.35907000  0.54428800  0.54428800  1.0
  O  O22  1  0.54428800  0.35907000  0.54428800  1.0
  O  O23  1  0.79056900  0.39875000  0.39875000  1.0
  O  O24  1  0.39875000  0.79056900  0.39875000  1.0
  O  O25  1  0.39875000  0.39875000  0.79056900  1.0
  O  O26  1  0.16978700  0.16978700  0.88988400  1.0
  O  O27  1  0.88988400  0.16978800  0.16978800  1.0
  O  O28  1  0.16978700  0.88988400  0.16978700  1.0
  O  O29  1  0.26676000  0.99113400  0.99113400  1.0
  O  O30  1  0.99113400  0.26676000  0.99113400  1.0
  O  O31  1  0.99113400  0.99113400  0.26676000  1.0
  O  O32  1  0.97267900  0.77410900  0.58864200  1.0
  O  O33  1  0.58864200  0.97267900  0.77410900  1.0
  O  O34  1  0.77410900  0.58864200  0.97267900  1.0
  O  O35  1  0.58864200  0.77410900  0.97267900  1.0
  O  O36  1  0.97267900  0.58864200  0.77410900  1.0
  O  O37  1  0.77410900  0.97267900  0.58864200  1.0
  O  O38  1  0.36409100  0.07925300  0.79117400  1.0
  O  O39  1  0.79117400  0.36409100  0.07925300  1.0
  O  O40  1  0.07925300  0.79117400  0.36409100  1.0
  O  O41  1  0.79117400  0.07925300  0.36409100  1.0
  O  O42  1  0.36409100  0.79117400  0.07925300  1.0
  O  O43  1  0.07925300  0.36409100  0.79117400  1.0
  O  O44  1  0.65273400  0.50336700  0.17115800  1.0
  O  O45  1  0.17115800  0.65273400  0.50336700  1.0
  O  O46  1  0.50336700  0.17115800  0.65273400  1.0
  O  O47  1  0.17115800  0.50336700  0.65273400  1.0
  O  O48  1  0.65273400  0.17115800  0.50336700  1.0
  O  O49  1  0.50336700  0.65273400  0.17115800  1.0