[CIF]
data_BaLi4As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82354091
_cell_length_b   5.82354091
_cell_length_c   5.82354091
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLi4As
_chemical_formula_sum   'Ba1 Li4 As1'
_cell_volume   139.65175407
_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
  As  As0  1  0.00000000  0.00000000  0.00000000  1
  Ba  Ba1  1  2.05893264  2.05893263  2.05893264  1
  Li  Li2  1  3.08792073  3.08792073  5.14780981  1
  Li  Li3  1  3.08792073  5.14780981  3.08792073  1
  Li  Li4  1  5.14780981  3.08792073  3.08792073  1
  Li  Li5  1  5.14780981  5.14780981  5.14780981  1
[/CIF]
