data_[Li4Mn8Ni4O24]
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
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.7785]
_cell_length_b [4.9909]
_cell_length_c [10.4236]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.2165]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiMn2NiO6]
_chemical_formula_sum '[Li4 Mn8 Ni4 O24]'
_cell_volume [455.4453]
_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
[
  Li  Li0  4  0.0000  0.1566  0.7500  1.0
  Mn  Mn1  8  0.0829  0.2476  0.4948  1.0
  Ni  Ni2  4  0.2500  0.2500  0.0000  1.0
  O  O3  8  0.0725  0.4073  0.9052  1.0
  O  O4  8  0.0786  0.0627  0.1024  1.0
  O  O5  8  0.2440  0.0806  0.4076  1.0
]