# generated using pymatgen
data_Ba6In5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.59032381
_cell_length_b   15.59032381
_cell_length_c   15.59032426
_cell_angle_alpha   30.86662048
_cell_angle_beta   30.86662048
_cell_angle_gamma   30.86661555
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba6In5N
_chemical_formula_sum   'Ba12 In10 N2'
_cell_volume   884.63126087
_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
  Ba  Ba0  1  0.63436693  0.21777237  0.75287314  1.0
  Ba  Ba1  1  0.28222763  0.86563307  0.74712686  1.0
  Ba  Ba2  1  0.86563307  0.74712686  0.28222763  1.0
  Ba  Ba3  1  0.71777237  0.13436693  0.25287314  1.0
  Ba  Ba4  1  0.13436693  0.25287314  0.71777237  1.0
  Ba  Ba5  1  0.25287314  0.71777237  0.13436693  1.0
  Ba  Ba6  1  0.78222763  0.24712686  0.36563307  1.0
  Ba  Ba7  1  0.75287314  0.63436693  0.21777237  1.0
  Ba  Ba8  1  0.36563307  0.78222763  0.24712686  1.0
  Ba  Ba9  1  0.21777237  0.75287314  0.63436693  1.0
  Ba  Ba10  1  0.24712686  0.36563307  0.78222763  1.0
  Ba  Ba11  1  0.74712686  0.28222763  0.86563307  1.0
  In  In12  1  0.53657189  0.96342811  0.75000000  1.0
  In  In13  1  0.19370028  0.19370028  0.19370028  1.0
  In  In14  1  0.80629972  0.80629972  0.80629972  1.0
  In  In15  1  0.75000000  0.53657189  0.96342811  1.0
  In  In16  1  0.96342811  0.75000000  0.53657189  1.0
  In  In17  1  0.69370028  0.69370028  0.69370028  1.0
  In  In18  1  0.46342811  0.03657189  0.25000000  1.0
  In  In19  1  0.03657189  0.25000000  0.46342811  1.0
  In  In20  1  0.25000000  0.46342811  0.03657189  1.0
  In  In21  1  0.30629972  0.30629972  0.30629972  1.0
  N  N22  1  0.00000000  -0.00000000  0.00000000  1.0
  N  N23  1  0.50000000  0.50000000  0.50000000  1.0