# generated using pymatgen
data_Mn2NiN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66930614
_cell_length_b   6.07593939
_cell_length_c   5.42037726
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2NiN2
_chemical_formula_sum   'Mn8 Ni4 N8'
_cell_volume   219.64615279
_cell_formula_units_Z   4
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
  Mn  Mn0  1  0.15032700  0.18009000  0.16834300  1
  Mn  Mn1  1  0.15032700  0.81991000  0.16834300  1
  Mn  Mn2  1  0.84967300  0.81991000  0.66834300  1
  Mn  Mn3  1  0.84967300  0.18009000  0.66834300  1
  Mn  Mn4  1  0.65032700  0.68009000  0.16834300  1
  Mn  Mn5  1  0.65032700  0.31991000  0.16834300  1
  Mn  Mn6  1  0.34967300  0.31991000  0.66834300  1
  Mn  Mn7  1  0.34967300  0.68009000  0.66834300  1
  Ni  Ni8  1  0.97289500  0.50000000  0.38963000  1
  Ni  Ni9  1  0.02710500  0.50000000  0.88963000  1
  Ni  Ni10  1  0.47289500  0.00000000  0.38963000  1
  Ni  Ni11  1  0.52710500  0.00000000  0.88963000  1
  N  N12  1  0.10621400  0.22968000  0.84004200  1
  N  N13  1  0.10621400  0.77032000  0.84004200  1
  N  N14  1  0.89378600  0.77032000  0.34004200  1
  N  N15  1  0.89378600  0.22968000  0.34004200  1
  N  N16  1  0.60621400  0.72968000  0.84004200  1
  N  N17  1  0.60621400  0.27032000  0.84004200  1
  N  N18  1  0.39378600  0.27032000  0.34004200  1
  N  N19  1  0.39378600  0.72968000  0.34004200  1
