# generated using pymatgen
data_Ba4Mn(N2Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03007080
_cell_length_b   8.37982655
_cell_length_c   10.65986575
_cell_angle_alpha   81.74812147
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Mn(N2Cl)2
_chemical_formula_sum   'Ba8 Mn2 N8 Cl4'
_cell_volume   533.07626811
_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  0.75000000  0.28464324  0.28765239  1.0
  Ba  Ba1  1  0.75000000  0.00612760  0.62352521  1.0
  Ba  Ba2  1  0.75000000  0.44882219  0.61614170  1.0
  Ba  Ba3  1  0.75000000  0.80584997  0.10770666  1.0
  Ba  Ba4  1  0.25000000  0.99387240  0.37647479  1.0
  Ba  Ba5  1  0.25000000  0.55117781  0.38385830  1.0
  Ba  Ba6  1  0.25000000  0.19415003  0.89229334  1.0
  Ba  Ba7  1  0.25000000  0.71535676  0.71234761  1.0
  Mn  Mn8  1  0.75000000  0.76786369  0.41136266  1.0
  Mn  Mn9  1  0.25000000  0.23213631  0.58863734  1.0
  N  N10  1  0.25000000  0.05049521  0.68846732  1.0
  N  N11  1  0.01826817  0.24682821  0.49189972  1.0
  N  N12  1  0.51826817  0.75317179  0.50810028  1.0
  N  N13  1  0.98173183  0.75317179  0.50810028  1.0
  N  N14  1  0.75000000  0.61053923  0.32052422  1.0
  N  N15  1  0.75000000  0.94950479  0.31153268  1.0
  N  N16  1  0.48173183  0.24682821  0.49189972  1.0
  N  N17  1  0.25000000  0.38946077  0.67947578  1.0
  Cl  Cl18  1  0.25000000  0.32887743  0.15800381  1.0
  Cl  Cl19  1  0.75000000  0.67112257  0.84199619  1.0
  Cl  Cl20  1  0.25000000  0.84958484  0.08777638  1.0
  Cl  Cl21  1  0.75000000  0.15041516  0.91222362  1.0