# generated using pymatgen
data_Li3MgNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78692900
_cell_length_b   4.91879900
_cell_length_c   5.09564012
_cell_angle_alpha   71.81791133
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MgNi3O8
_chemical_formula_sum   'Li3 Mg1 Ni3 O8'
_cell_volume   137.80387213
_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  0.50000000  0.00000000  0.50000000  1
  Li  Li1  1  0.75921000  0.50000000  0.50000000  1
  Li  Li2  1  0.24079000  0.50000000  0.50000000  1
  Mg  Mg3  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni4  1  0.75268700  0.00000000  0.00000000  1
  Ni  Ni5  1  0.00000000  0.50000000  0.00000000  1
  Ni  Ni6  1  0.24731300  0.00000000  0.00000000  1
  O  O7  1  0.50000000  0.21760700  0.77398000  1
  O  O8  1  0.50000000  0.78239300  0.22602000  1
  O  O9  1  0.76255800  0.25575200  0.20944500  1
  O  O10  1  0.76255800  0.74424800  0.79055500  1
  O  O11  1  0.00000000  0.75041900  0.20832800  1
  O  O12  1  0.00000000  0.24958100  0.79167200  1
  O  O13  1  0.23744200  0.25575200  0.20944500  1
  O  O14  1  0.23744200  0.74424800  0.79055500  1
