# generated using pymatgen
data_LiErGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97215353
_cell_length_b   6.97215303
_cell_length_c   4.19521924
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000735
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiErGe
_chemical_formula_sum   'Li3 Er3 Ge3'
_cell_volume   176.61155482
_cell_formula_units_Z   3
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  0.23306100  -0.00000000  0.50000000  1
  Li  Li1  1  0.76693900  0.76693900  0.50000000  1
  Li  Li2  1  -0.00000000  0.23306100  0.50000000  1
  Er  Er3  1  0.00000000  0.57557819  -0.00000000  1
  Er  Er4  1  0.57557819  0.00000000  0.00000000  1
  Er  Er5  1  0.42442181  0.42442181  -0.00000000  1
  Ge  Ge6  1  0.33333300  0.66666700  0.50000000  1
  Ge  Ge7  1  0.66666700  0.33333300  0.50000000  1
  Ge  Ge8  1  -0.00000000  -0.00000000  -0.00000000  1
