# generated using pymatgen
data_Ba5PN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.83386198
_cell_length_b   7.83386227
_cell_length_c   9.38444703
_cell_angle_alpha   76.53866813
_cell_angle_beta   76.53866164
_cell_angle_gamma   95.26616130
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba5PN5
_chemical_formula_sum   'Ba10 P2 N10'
_cell_volume   538.18186339
_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  0.40000785  0.40000785  0.36500887  1.0
  Ba  Ba1  1  0.59999215  0.59999215  0.63499113  1.0
  Ba  Ba2  1  0.67127959  0.67127959  0.00289099  1.0
  Ba  Ba3  1  0.32872041  0.32872041  0.99710901  1.0
  Ba  Ba4  1  0.92683103  0.92683103  0.20415061  1.0
  Ba  Ba5  1  0.07316897  0.07316897  0.79584939  1.0
  Ba  Ba6  1  0.55950570  0.08724584  0.75891590  1.0
  Ba  Ba7  1  0.91275416  0.44049430  0.24108410  1.0
  Ba  Ba8  1  0.44049430  0.91275416  0.24108410  1.0
  Ba  Ba9  1  0.08724584  0.55950570  0.75891590  1.0
  P  P10  1  0.75792399  0.24207601  1.00000000  1.0
  P  P11  1  0.24207601  0.75792399  0.00000000  1.0
  N  N12  1  0.65443850  0.65443850  0.31947581  1.0
  N  N13  1  0.34556150  0.34556150  0.68052419  1.0
  N  N14  1  0.72343225  0.03047033  0.99430783  1.0
  N  N15  1  0.96952967  0.27656775  0.00569217  1.0
  N  N16  1  0.27656775  0.96952967  0.00569217  1.0
  N  N17  1  0.03047033  0.72343225  0.99430783  1.0
  N  N18  1  0.37841353  0.72717420  0.84589266  1.0
  N  N19  1  0.27282580  0.62158647  0.15410634  1.0
  N  N20  1  0.62158647  0.27282580  0.15410634  1.0
  N  N21  1  0.72717420  0.37841353  0.84589266  1.0