# generated using pymatgen
data_Li3Mn3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77509600
_cell_length_b   5.88517144
_cell_length_c   5.93330744
_cell_angle_alpha   119.46143793
_cell_angle_beta   118.86433459
_cell_angle_gamma   90.25534663
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn3NiO8
_chemical_formula_sum   'Li3 Mn3 Ni1 O8'
_cell_volume   145.82586895
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn3  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn4  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn5  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1
  O  O7  1  0.71660300  0.74196600  0.95690900  1
  O  O8  1  0.23613200  0.74118500  0.94768200  1
  O  O9  1  0.24371200  0.27660300  0.49527400  1
  O  O10  1  0.76295300  0.29095800  0.52149100  1
  O  O11  1  0.23704700  0.70904200  0.47850900  1
  O  O12  1  0.75628800  0.72339700  0.50472600  1
  O  O13  1  0.76386800  0.25881500  0.05231800  1
  O  O14  1  0.28339700  0.25803400  0.04309100  1
