data_[Li4Mn6Cr2N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [4.8173]
_cell_length_b [8.4781]
_cell_length_c [5.0622]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.8172]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Mn3CrN6]
_chemical_formula_sum '[Li4 Mn6 Cr2 N12]'
_cell_volume [196.8302]
_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
[
  Li  Li0  4  0.0000  0.3382  0.0000  1.0
  Mn  Mn1  4  0.0000  0.1920  0.5000  1.0
  Mn  Mn2  2  0.0000  0.5000  0.5000  1.0
  Cr  Cr3  2  0.0000  0.0000  0.0000  1.0
  N  N4  8  0.2449  0.8401  0.2589  1.0
  N  N5  4  0.2202  0.0000  0.7140  1.0
]