# generated using pymatgen
data_Li2MgNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68251736
_cell_length_b   5.68251736
_cell_length_c   5.85715916
_cell_angle_alpha   61.01913736
_cell_angle_beta   61.01913736
_cell_angle_gamma   59.95067214
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MgNi3O8
_chemical_formula_sum   'Li2 Mg1 Ni3 O8'
_cell_volume   135.70867048
_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  0.50000000  0.50000000  1
  Li  Li1  1  0.00000000  0.00000000  0.50000000  1
  Mg  Mg2  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni3  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni4  1  0.00000000  0.50000000  0.00000000  1
  Ni  Ni5  1  0.50000000  0.50000000  0.00000000  1
  O  O6  1  0.24328500  0.71502500  0.78967300  1
  O  O7  1  0.75671500  0.28497500  0.21032700  1
  O  O8  1  0.28497500  0.75671500  0.21032700  1
  O  O9  1  0.71502500  0.24328500  0.78967300  1
  O  O10  1  0.26658000  0.26658000  0.19540700  1
  O  O11  1  0.73342000  0.73342000  0.80459300  1
  O  O12  1  0.24717200  0.24717200  0.79410900  1
  O  O13  1  0.75282800  0.75282800  0.20589100  1
