# generated using pymatgen
data_Li3Be
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50627696
_cell_length_b   5.50627696
_cell_length_c   4.52814700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001149
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Be
_chemical_formula_sum   'Li6 Be2'
_cell_volume   118.89598859
_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  0.17390100  0.34780200  0.25000000  1.0
  Li  Li1  1  0.65219800  0.82609900  0.25000000  1.0
  Li  Li2  1  0.17390100  0.82609900  0.25000000  1.0
  Li  Li3  1  0.82609900  0.65219800  0.75000000  1.0
  Li  Li4  1  0.34780200  0.17390100  0.75000000  1.0
  Li  Li5  1  0.82609900  0.17390100  0.75000000  1.0
  Be  Be6  1  0.33333300  0.66666700  0.75000000  1.0
  Be  Be7  1  0.66666700  0.33333300  0.25000000  1.0