# generated using pymatgen
data_Mg(NiN)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.48286364
_cell_length_b   3.48373057
_cell_length_c   5.17033511
_cell_angle_alpha   90.00963794
_cell_angle_beta   89.97778377
_cell_angle_gamma   90.10871060
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(NiN)2
_chemical_formula_sum   'Mg1 Ni2 N2'
_cell_volume   62.73341123
_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
  Mg  Mg0  1  0.99997500  0.00004100  0.25002900  1.0
  Ni  Ni1  1  0.50018800  0.50000700  0.97948700  1.0
  Ni  Ni2  1  0.49979500  0.49996700  0.52050100  1.0
  N  N3  1  0.49984600  0.99998600  0.49849100  1.0
  N  N4  1  0.00019500  0.50000000  0.00149300  1.0