# generated using pymatgen
data_LiMg6BO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.10086884
_cell_length_b   4.27447633
_cell_length_c   4.27447633
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMg6BO8
_chemical_formula_sum   'Li1 Mg6 B1 O8'
_cell_volume   148.01217266
_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  0.00000000  0.00000000  1
  Mg  Mg1  1  0.00000000  0.50000000  0.50000000  1
  Mg  Mg2  1  0.50000000  0.50000000  0.50000000  1
  Mg  Mg3  1  0.25397694  -0.00000000  0.50000000  1
  Mg  Mg4  1  0.74602306  0.00000000  0.50000000  1
  Mg  Mg5  1  0.25397694  0.50000000  0.00000000  1
  Mg  Mg6  1  0.74602306  0.50000000  -0.00000000  1
  B  B7  1  0.50000000  0.00000000  0.00000000  1
  O  O8  1  0.32173548  -0.00000000  0.00000000  1
  O  O9  1  0.67826452  0.00000000  -0.00000000  1
  O  O10  1  0.25001968  0.50000000  0.50000000  1
  O  O11  1  0.74998032  0.50000000  0.50000000  1
  O  O12  1  -0.00000000  0.00000000  0.50000000  1
  O  O13  1  0.50000000  0.00000000  0.50000000  1
  O  O14  1  0.00000000  0.50000000  0.00000000  1
  O  O15  1  0.50000000  0.50000000  0.00000000  1
