# generated using pymatgen
data_SrHfN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02121058
_cell_length_b   4.02121058
_cell_length_c   8.22138958
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrHfN2
_chemical_formula_sum   'Sr2 Hf2 N4'
_cell_volume   132.94097552
_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
  Sr  Sr0  1  0.75000000  0.75000000  0.14300832  1.0
  Sr  Sr1  1  0.25000000  0.25000000  0.85699168  1.0
  Hf  Hf2  1  0.75000000  0.75000000  0.59237743  1.0
  Hf  Hf3  1  0.25000000  0.25000000  0.40762257  1.0
  N  N4  1  0.75000000  0.25000000  0.50000000  1.0
  N  N5  1  0.25000000  0.75000000  0.50000000  1.0
  N  N6  1  0.75000000  0.75000000  0.83427863  1.0
  N  N7  1  0.25000000  0.25000000  0.16572137  1.0