# generated using pymatgen
data_ReNiN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78075200
_cell_length_b   2.90030359
_cell_length_c   11.00754600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   118.64553492
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReNiN2
_chemical_formula_sum   'Re2 Ni2 N4'
_cell_volume   77.91013608
_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
  Re  Re0  1  0.86030100  0.72060200  0.25000000  1.0
  Re  Re1  1  0.13969900  0.27939800  0.75000000  1.0
  Ni  Ni2  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni3  1  0.00000000  0.00000000  0.50000000  1.0
  N  N4  1  0.46327000  0.92654000  0.63406000  1.0
  N  N5  1  0.53673000  0.07346000  0.36594000  1.0
  N  N6  1  0.53673000  0.07346000  0.13406000  1.0
  N  N7  1  0.46327000  0.92654000  0.86594000  1.0