# generated using pymatgen
data_Li4Yb(ThSi2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.42947421
_cell_length_b   9.42947503
_cell_length_c   6.77744861
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   152.88560948
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Yb(ThSi2)3
_chemical_formula_sum   'Li4 Yb1 Th3 Si6'
_cell_volume   274.65373678
_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
  Li  Li0  1  0.80818064  0.19181936  0.56615551  1.0
  Li  Li1  1  0.18932854  0.81067146  0.44852015  1.0
  Li  Li2  1  0.18932854  0.81067146  0.05147985  1.0
  Li  Li3  1  0.80818064  0.19181936  0.93384449  1.0
  Yb  Yb4  1  0.65703510  0.34296490  0.75000000  1.0
  Th  Th5  1  0.55303269  0.44696731  0.25000000  1.0
  Th  Th6  1  0.44899749  0.55100251  0.75000000  1.0
  Th  Th7  1  0.34262912  0.65737088  0.25000000  1.0
  Si  Si8  1  0.94037748  0.05962252  0.07229372  1.0
  Si  Si9  1  0.05811475  0.94188525  0.92746095  1.0
  Si  Si10  1  0.05811475  0.94188525  0.57253905  1.0
  Si  Si11  1  0.94037748  0.05962252  0.42770628  1.0
  Si  Si12  1  0.72150395  0.27849605  0.25000000  1.0
  Si  Si13  1  0.28479983  0.71520017  0.75000000  1.0