# generated using pymatgen
data_MgIrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71435224
_cell_length_b   4.71265640
_cell_length_c   9.28423410
_cell_angle_alpha   90.00000070
_cell_angle_beta   144.32726176
_cell_angle_gamma   114.35271152
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgIrN2
_chemical_formula_sum   'Mg2 Ir2 N4'
_cell_volume   103.09739414
_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
  Mg  Mg0  1  0.00000000  0.50000000  0.25000000  1.0
  Mg  Mg1  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir2  1  0.00000000  0.50000000  0.75000000  1.0
  Ir  Ir3  1  0.00000000  0.00000000  0.50000000  1.0
  N  N4  1  0.50000000  0.97795500  0.12500000  1.0
  N  N5  1  0.50000000  0.02204500  0.62500000  1.0
  N  N6  1  0.54409000  0.52204500  0.39704500  1.0
  N  N7  1  0.45591000  0.47795500  0.85295500  1.0