data_[Mn6Cr4N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Cr  1.6600  1.4000  0.9400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6311]
_cell_length_b [2.5656]
_cell_length_c [6.4876]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.8337]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn3(CrN)2]
_chemical_formula_sum '[Mn6 Cr4 N4]'
_cell_volume [128.1924]
_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
[
  Mn  Mn0  4  0.0994  0.5000  0.4206  1
  Mn  Mn1  2  0.0000  0.5000  0.0000  1
  Cr  Cr2  4  0.1706  0.0000  0.8025  1
  N  N3  4  0.1668  0.0000  0.2424  1
]