data_[Li4Zn4Ni10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5166]
_cell_length_b [4.0630]
_cell_length_c [4.9236]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6844]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Zn2Ni5]
_chemical_formula_sum '[Li4 Zn4 Ni10]'
_cell_volume [224.7648]
_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  0.1741  0.0000  0.5044  1.0
  Zn  Zn1  4  0.0875  0.5000  0.7008  1.0
  Ni  Ni2  4  0.1099  0.5000  0.1901  1.0
  Ni  Ni3  4  0.2049  0.0000  0.0283  1.0
  Ni  Ni4  2  0.0000  0.0000  0.0000  1.0
]