# generated using pymatgen
data_Li2Cr3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91553121
_cell_length_b   5.91553121
_cell_length_c   5.91553067
_cell_angle_alpha   59.26304467
_cell_angle_beta   59.26304467
_cell_angle_gamma   59.26304710
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr3NiO8
_chemical_formula_sum   'Li2 Cr3 Ni1 O8'
_cell_volume   143.91797968
_cell_formula_units_Z   1
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  0.12323200  0.12323200  0.12323200  1
  Li  Li1  1  0.50057800  0.50057800  0.50057800  1
  Cr  Cr2  1  0.00581700  0.49839200  0.49839200  1
  Cr  Cr3  1  0.49839200  0.49839200  0.00581700  1
  Cr  Cr4  1  0.49839200  0.00581700  0.49839200  1
  Ni  Ni5  1  0.87838200  0.87838200  0.87838200  1
  O  O6  1  0.26000800  0.26000800  0.26000800  1
  O  O7  1  0.24954900  0.70824500  0.24954900  1
  O  O8  1  0.24954900  0.24954900  0.70824500  1
  O  O9  1  0.70824500  0.24954900  0.24954900  1
  O  O10  1  0.28832800  0.74960300  0.74960300  1
  O  O11  1  0.74960300  0.74960300  0.28832800  1
  O  O12  1  0.74960300  0.28832800  0.74960300  1
  O  O13  1  0.74031800  0.74031800  0.74031800  1
