# generated using pymatgen
data_Li4Cr3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10989200
_cell_length_b   5.89050263
_cell_length_c   10.20608167
_cell_angle_alpha   89.83011874
_cell_angle_beta   99.60828176
_cell_angle_gamma   106.99762711
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Cr3NiO8
_chemical_formula_sum   'Li8 Cr6 Ni2 O16'
_cell_volume   289.31829504
_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  0.00074400  0.24537400  0.25380600  1
  Li  Li1  1  0.99621200  0.24302000  0.74967100  1
  Li  Li2  1  0.00000000  0.00000000  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.50000000  1
  Li  Li4  1  0.00378800  0.75698000  0.25032900  1
  Li  Li5  1  0.99925600  0.75462600  0.74619400  1
  Li  Li6  1  0.00000000  0.50000000  0.00000000  1
  Li  Li7  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr8  1  0.49953400  0.12392500  0.87333000  1
  Cr  Cr9  1  0.50046600  0.87607500  0.12667000  1
  Cr  Cr10  1  0.50081300  0.62585200  0.87365400  1
  Cr  Cr11  1  0.50049800  0.62866300  0.37769700  1
  Cr  Cr12  1  0.49918700  0.37414800  0.12634600  1
  Cr  Cr13  1  0.49950200  0.37133700  0.62230300  1
  Ni  Ni14  1  0.49897400  0.12485300  0.37473000  1
  Ni  Ni15  1  0.50102600  0.87514700  0.62527000  1
  O  O16  1  0.26957700  0.06503300  0.18520700  1
  O  O17  1  0.26689800  0.07475600  0.69143500  1
  O  O18  1  0.72557900  0.18245100  0.06068300  1
  O  O19  1  0.72299900  0.18585900  0.56381100  1
  O  O20  1  0.27442100  0.81754900  0.93931700  1
  O  O21  1  0.73042300  0.93496700  0.81479300  1
  O  O22  1  0.27700100  0.81414100  0.43618900  1
  O  O23  1  0.73310200  0.92524400  0.30856500  1
  O  O24  1  0.27399600  0.56857200  0.19127100  1
  O  O25  1  0.72357700  0.68123600  0.06025900  1
  O  O26  1  0.27893000  0.56486800  0.68871100  1
  O  O27  1  0.73317700  0.67456000  0.55672800  1
  O  O28  1  0.27642300  0.31876400  0.93974100  1
  O  O29  1  0.72600400  0.43142800  0.80872900  1
  O  O30  1  0.26682300  0.32544000  0.44327200  1
  O  O31  1  0.72107000  0.43513200  0.31128900  1
