# generated using pymatgen
data_Ba6Ga5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.75415672
_cell_length_b   14.75415672
_cell_length_c   14.75415817
_cell_angle_alpha   31.30669392
_cell_angle_beta   31.30669392
_cell_angle_gamma   31.30669479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba6Ga5N
_chemical_formula_sum   'Ba12 Ga10 N2'
_cell_volume   769.65900468
_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  0.78972876  0.23929278  0.36241607  1.0
  Ba  Ba1  1  0.23929278  0.36241607  0.78972876  1.0
  Ba  Ba2  1  0.36241607  0.78972876  0.23929278  1.0
  Ba  Ba3  1  0.71027124  0.13758393  0.26070722  1.0
  Ba  Ba4  1  0.13758393  0.26070722  0.71027124  1.0
  Ba  Ba5  1  0.26070722  0.71027124  0.13758393  1.0
  Ba  Ba6  1  0.21027124  0.76070722  0.63758393  1.0
  Ba  Ba7  1  0.76070722  0.63758393  0.21027124  1.0
  Ba  Ba8  1  0.63758393  0.21027124  0.76070722  1.0
  Ba  Ba9  1  0.28972876  0.86241607  0.73929278  1.0
  Ba  Ba10  1  0.86241607  0.73929278  0.28972876  1.0
  Ba  Ba11  1  0.73929278  0.28972876  0.86241607  1.0
  Ga  Ga12  1  0.25000000  0.44908858  0.05091142  1.0
  Ga  Ga13  1  0.19842473  0.19842473  0.19842473  1.0
  Ga  Ga14  1  0.69842473  0.69842473  0.69842473  1.0
  Ga  Ga15  1  0.30157527  0.30157527  0.30157527  1.0
  Ga  Ga16  1  0.80157527  0.80157527  0.80157527  1.0
  Ga  Ga17  1  0.44908858  0.05091142  0.25000000  1.0
  Ga  Ga18  1  0.05091142  0.25000000  0.44908858  1.0
  Ga  Ga19  1  0.75000000  0.55091142  0.94908858  1.0
  Ga  Ga20  1  0.55091142  0.94908858  0.75000000  1.0
  Ga  Ga21  1  0.94908858  0.75000000  0.55091142  1.0
  N  N22  1  0.50000000  0.50000000  0.50000000  1.0
  N  N23  1  0.00000000  -0.00000000  -0.00000000  1.0