# generated using pymatgen
data_LiLuSn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.27944466
_cell_length_b   9.27944466
_cell_length_c   7.13141800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000471
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLuSn
_chemical_formula_sum   'Li8 Lu8 Sn8'
_cell_volume   531.80262442
_cell_formula_units_Z   8
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  0.16525200  0.33050500  0.28825600  1
  Li  Li1  1  0.16525200  0.83474800  0.28825600  1
  Li  Li2  1  0.66949500  0.83474800  0.28825600  1
  Li  Li3  1  0.83474800  0.66949500  0.78825600  1
  Li  Li4  1  0.83474800  0.16525200  0.78825600  1
  Li  Li5  1  0.33050500  0.16525200  0.78825600  1
  Li  Li6  1  0.33333300  0.66666700  0.65942800  1
  Li  Li7  1  0.66666700  0.33333300  0.15942800  1
  Lu  Lu8  1  0.51346600  0.02693200  0.49477900  1
  Lu  Lu9  1  0.51346600  0.48653400  0.49477900  1
  Lu  Lu10  1  0.97306800  0.48653400  0.49477900  1
  Lu  Lu11  1  0.48653400  0.97306800  0.99477900  1
  Lu  Lu12  1  0.48653400  0.51346600  0.99477900  1
  Lu  Lu13  1  0.02693200  0.51346600  0.99477900  1
  Lu  Lu14  1  0.00000000  0.00000000  0.50204800  1
  Lu  Lu15  1  0.00000000  0.00000000  0.00204800  1
  Sn  Sn16  1  0.16661600  0.33323200  0.73185800  1
  Sn  Sn17  1  0.16661600  0.83338400  0.73185800  1
  Sn  Sn18  1  0.66676800  0.83338400  0.73185800  1
  Sn  Sn19  1  0.83338400  0.66676800  0.23185800  1
  Sn  Sn20  1  0.83338400  0.16661600  0.23185800  1
  Sn  Sn21  1  0.33323200  0.16661600  0.23185800  1
  Sn  Sn22  1  0.33333300  0.66666700  0.26484400  1
  Sn  Sn23  1  0.66666700  0.33333300  0.76484400  1
