# generated using pymatgen
data_LiMg6Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88675900
_cell_length_b   6.22973200
_cell_length_c   10.53860800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMg6Cu
_chemical_formula_sum   'Li2 Mg12 Cu2'
_cell_volume   320.82893967
_cell_formula_units_Z   2
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  0.83323700  1
  Li  Li1  1  0.50000000  0.00000000  0.33323700  1
  Mg  Mg2  1  0.50000000  0.24893100  0.08422000  1
  Mg  Mg3  1  0.50000000  0.75106900  0.08422000  1
  Mg  Mg4  1  0.00000000  0.24477700  0.91224000  1
  Mg  Mg5  1  0.00000000  0.75522300  0.91224000  1
  Mg  Mg6  1  0.00000000  0.50000000  0.17141100  1
  Mg  Mg7  1  0.00000000  0.50000000  0.66856700  1
  Mg  Mg8  1  0.50000000  0.74893100  0.58422000  1
  Mg  Mg9  1  0.50000000  0.25106900  0.58422000  1
  Mg  Mg10  1  0.00000000  0.74477700  0.41224000  1
  Mg  Mg11  1  0.00000000  0.25522300  0.41224000  1
  Mg  Mg12  1  0.00000000  0.00000000  0.67141100  1
  Mg  Mg13  1  0.00000000  0.00000000  0.16856700  1
  Cu  Cu14  1  0.50000000  0.50000000  0.33386800  1
  Cu  Cu15  1  0.50000000  0.00000000  0.83386800  1
