# generated using pymatgen
data_Ba(CrN)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.36001504
_cell_length_b   3.35936379
_cell_length_c   6.96090917
_cell_angle_alpha   90.01313563
_cell_angle_beta   89.98001994
_cell_angle_gamma   119.99653462
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba(CrN)2
_chemical_formula_sum   'Ba1 Cr2 N2'
_cell_volume   68.04715844
_cell_formula_units_Z   1
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  0.00000000  0.00000000  0.50000000  1.0
  Cr  Cr1  1  0.66654500  0.33326800  0.10744000  1.0
  Cr  Cr2  1  0.33345500  0.66673200  0.89256000  1.0
  N  N3  1  0.66687200  0.33347000  0.82374500  1.0
  N  N4  1  0.33312800  0.66653000  0.17625500  1.0