# generated using pymatgen
data_Ba4MnN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46777998
_cell_length_b   7.41625942
_cell_length_c   9.42405534
_cell_angle_alpha   75.03857060
_cell_angle_beta   93.71830004
_cell_angle_gamma   83.57168020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4MnN4
_chemical_formula_sum   'Ba8 Mn2 N8'
_cell_volume   431.89668879
_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  0.75968900  0.52095800  0.10688300  1.0
  Ba  Ba1  1  0.24031100  0.47904200  0.89311700  1.0
  Ba  Ba2  1  0.75731600  0.10287000  0.90938700  1.0
  Ba  Ba3  1  0.24268400  0.89713000  0.09061300  1.0
  Ba  Ba4  1  0.76625400  0.42926000  0.57075700  1.0
  Ba  Ba5  1  0.23374600  0.57074000  0.42924300  1.0
  Ba  Ba6  1  0.26505400  0.97166700  0.62805300  1.0
  Ba  Ba7  1  0.73494600  0.02833300  0.37194700  1.0
  Mn  Mn8  1  0.79813800  0.77461800  0.73864100  1.0
  Mn  Mn9  1  0.20186200  0.22538200  0.26135900  1.0
  N  N10  1  0.96590900  0.69922800  0.61852500  1.0
  N  N11  1  0.03409100  0.30077200  0.38147500  1.0
  N  N12  1  0.95091100  0.77194300  0.90235000  1.0
  N  N13  1  0.04908900  0.22805700  0.09765000  1.0
  N  N14  1  0.60470100  0.62621300  0.77938200  1.0
  N  N15  1  0.39529900  0.37378700  0.22061800  1.0
  N  N16  1  0.31269900  0.99127600  0.34153700  1.0
  N  N17  1  0.68730100  0.00872400  0.65846300  1.0