# generated using pymatgen
data_Li4MgNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77422375
_cell_length_b   5.80901103
_cell_length_c   8.28205996
_cell_angle_alpha   89.35716384
_cell_angle_beta   90.01175485
_cell_angle_gamma   90.00840408
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MgNi3O8
_chemical_formula_sum   'Li8 Mg2 Ni6 O16'
_cell_volume   277.78374685
_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  1  0.25021700  0.24949400  0.25057400  1
  Li  Li1  1  0.74979200  0.75049600  0.74942800  1
  Li  Li2  1  0.25248500  0.74981100  0.75007100  1
  Li  Li3  1  0.74748300  0.25017000  0.24993600  1
  Li  Li4  1  0.99984200  0.00015900  0.50001800  1
  Li  Li5  1  0.50001000  0.49995200  0.99998500  1
  Li  Li6  1  0.99979800  0.49978900  0.99998700  1
  Li  Li7  1  0.50001600  0.00006200  0.50000500  1
  Mg  Mg8  1  0.24917600  0.24968100  0.74974100  1
  Mg  Mg9  1  0.75082200  0.75030900  0.25025600  1
  Ni  Ni10  1  0.25171500  0.75000200  0.25013900  1
  Ni  Ni11  1  0.74831500  0.24998100  0.74987700  1
  Ni  Ni12  1  0.50004600  0.99998800  0.99999500  1
  Ni  Ni13  1  0.00004200  0.99995400  0.99999300  1
  Ni  Ni14  1  0.49997300  0.50007900  0.49998700  1
  Ni  Ni15  1  0.00000600  0.50005200  0.49999200  1
  O  O16  1  0.27295700  0.76105000  0.99549500  1
  O  O17  1  0.72744100  0.26161600  0.49518300  1
  O  O18  1  0.27260200  0.73841800  0.50482600  1
  O  O19  1  0.72715800  0.23892000  0.00449900  1
  O  O20  1  0.25285300  0.21954900  0.99757000  1
  O  O21  1  0.74639700  0.72041200  0.49784500  1
  O  O22  1  0.25359100  0.27965800  0.50216000  1
  O  O23  1  0.74720300  0.78038500  0.00242500  1
  O  O24  1  0.01360400  0.51659700  0.26350200  1
  O  O25  1  0.51172200  0.01525600  0.77074600  1
  O  O26  1  0.48833300  0.98476700  0.22923300  1
  O  O27  1  0.98637600  0.48339400  0.73650200  1
  O  O28  1  0.01429500  0.98305600  0.23707100  1
  O  O29  1  0.51211300  0.48404200  0.72929800  1
  O  O30  1  0.48787400  0.51598400  0.27072300  1
  O  O31  1  0.98574100  0.01691800  0.76293600  1
