# generated using pymatgen
data_La4MgNiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13231700
_cell_length_b   8.74949870
_cell_length_c   8.74949903
_cell_angle_alpha   35.59335446
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La4MgNiO8
_chemical_formula_sum   'La4 Mg1 Ni1 O8'
_cell_volume   228.67790224
_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
  La  La0  1  0.00000000  0.17690400  0.17690400  1.0
  La  La1  1  0.00000000  0.82309600  0.82309600  1.0
  La  La2  1  0.50000000  0.40265400  0.40265400  1.0
  La  La3  1  0.50000000  0.59734600  0.59734600  1.0
  Mg  Mg4  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni5  1  0.50000000  0.00000000  0.00000000  1.0
  O  O6  1  0.00000000  0.30787100  0.30787100  1.0
  O  O7  1  0.00000000  0.69212900  0.69212900  1.0
  O  O8  1  0.25172400  0.26664600  0.73335400  1.0
  O  O9  1  0.25172400  0.73335400  0.26664600  1.0
  O  O10  1  0.50000000  0.84625400  0.84625400  1.0
  O  O11  1  0.50000000  0.15374600  0.15374600  1.0
  O  O12  1  0.74827600  0.73335400  0.26664600  1.0
  O  O13  1  0.74827600  0.26664600  0.73335400  1.0