# generated using pymatgen
data_Ba4Mn(IN2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87889938
_cell_length_b   8.53809960
_cell_length_c   12.13448356
_cell_angle_alpha   90.76917419
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Mn(IN2)2
_chemical_formula_sum   'Ba8 Mn2 I4 N8'
_cell_volume   609.03101009
_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  0.24045088  0.30881067  1.0
  Ba  Ba1  1  0.75000000  0.03451810  0.60198857  1.0
  Ba  Ba2  1  0.75000000  0.46677825  0.59208237  1.0
  Ba  Ba3  1  0.75000000  0.72128022  0.15768253  1.0
  Ba  Ba4  1  0.25000000  0.96548190  0.39801143  1.0
  Ba  Ba5  1  0.25000000  0.53322175  0.40791763  1.0
  Ba  Ba6  1  0.25000000  0.27871978  0.84231747  1.0
  Ba  Ba7  1  0.25000000  0.75954912  0.69118933  1.0
  Mn  Mn8  1  0.75000000  0.75099595  0.42619460  1.0
  Mn  Mn9  1  0.25000000  0.24900405  0.57380540  1.0
  I  I10  1  0.25000000  0.41293455  0.13294286  1.0
  I  I11  1  0.75000000  0.58706545  0.86705714  1.0
  I  I12  1  0.25000000  0.92541991  0.10757364  1.0
  I  I13  1  0.75000000  0.07458009  0.89242636  1.0
  N  N14  1  0.25000000  0.09039321  0.65949118  1.0
  N  N15  1  0.01582247  0.24270424  0.48680435  1.0
  N  N16  1  0.51582247  0.75729576  0.51319565  1.0
  N  N17  1  0.98417753  0.75729576  0.51319565  1.0
  N  N18  1  0.75000000  0.57622277  0.35137226  1.0
  N  N19  1  0.75000000  0.90960679  0.34050882  1.0
  N  N20  1  0.48417753  0.24270424  0.48680435  1.0
  N  N21  1  0.25000000  0.42377723  0.64862774  1.0