# generated using pymatgen
data_Ba2PdN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.15727600
_cell_length_b   4.15395600
_cell_length_c   7.29877376
_cell_angle_alpha   106.53286834
_cell_angle_beta   106.54646189
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2PdN2
_chemical_formula_sum   'Ba2 Pd1 N2'
_cell_volume   115.37741445
_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  0.85410500  0.85410500  0.20821000  1.0
  Ba  Ba1  1  0.14589500  0.14589500  0.79179000  1.0
  Pd  Pd2  1  0.50000000  0.50000000  0.50000000  1.0
  N  N3  1  0.35480300  0.35480300  0.20960800  1.0
  N  N4  1  0.64519700  0.64519700  0.79039200  1.0