# generated using pymatgen
data_Ba5MnN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.91290364
_cell_length_b   7.91290332
_cell_length_c   9.48561639
_cell_angle_alpha   76.13131333
_cell_angle_beta   76.13131062
_cell_angle_gamma   95.97935508
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba5MnN5
_chemical_formula_sum   'Ba10 Mn2 N10'
_cell_volume   551.51659683
_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  0.38627109  0.38627109  0.38551367  1.0
  Ba  Ba1  1  0.61372891  0.61372891  0.61448633  1.0
  Ba  Ba2  1  0.66560622  0.66560622  0.00787317  1.0
  Ba  Ba3  1  0.33439378  0.33439378  0.99212683  1.0
  Ba  Ba4  1  0.92574558  0.92574558  0.20337694  1.0
  Ba  Ba5  1  0.07425442  0.07425442  0.79662306  1.0
  Ba  Ba6  1  0.56392287  0.09253280  0.75708862  1.0
  Ba  Ba7  1  0.90746720  0.43607713  0.24291138  1.0
  Ba  Ba8  1  0.43607713  0.90746720  0.24291138  1.0
  Ba  Ba9  1  0.09253280  0.56392287  0.75708862  1.0
  Mn  Mn10  1  0.75712393  0.24287607  1.00000000  1.0
  Mn  Mn11  1  0.24287607  0.75712393  0.00000000  1.0
  N  N12  1  0.65005649  0.65005649  0.31189877  1.0
  N  N13  1  0.34994351  0.34994351  0.68810123  1.0
  N  N14  1  0.71801630  0.02484098  0.99349701  1.0
  N  N15  1  0.97515902  0.28198370  0.00650299  1.0
  N  N16  1  0.28198370  0.97515902  0.00650299  1.0
  N  N17  1  0.02484098  0.71801630  0.99349701  1.0
  N  N18  1  0.38517958  0.73190971  0.84012777  1.0
  N  N19  1  0.26809029  0.61482042  0.15987123  1.0
  N  N20  1  0.61482042  0.26809029  0.15987123  1.0
  N  N21  1  0.73190971  0.38517958  0.84012777  1.0