# generated using pymatgen
data_LiYb(ScHg2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11520125
_cell_length_b   7.11449594
_cell_length_c   6.77242497
_cell_angle_alpha   89.99992640
_cell_angle_beta   89.99946591
_cell_angle_gamma   90.00001307
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiYb(ScHg2)2
_chemical_formula_sum   'Li2 Yb2 Sc4 Hg8'
_cell_volume   342.82740102
_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  0.74995796  0.24999599  0.49998705  1.0
  Li  Li1  1  0.25004204  0.75000501  0.50001295  1.0
  Yb  Yb2  1  0.75003715  0.25000389  0.00001424  1.0
  Yb  Yb3  1  0.24996385  0.74999611  0.99998576  1.0
  Sc  Sc4  1  0.24997674  0.24999081  0.99998351  1.0
  Sc  Sc5  1  0.75002226  0.75000919  0.00001649  1.0
  Sc  Sc6  1  0.74996204  0.74999514  0.49999350  1.0
  Sc  Sc7  1  0.25003796  0.25000486  0.50000750  1.0
  Hg  Hg8  1  0.49997119  0.99999601  0.26209099  1.0
  Hg  Hg9  1  0.49997933  0.50000966  0.26208528  1.0
  Hg  Hg10  1  0.00001014  0.99999853  0.26217185  1.0
  Hg  Hg11  1  0.00001390  0.49999781  0.26216569  1.0
  Hg  Hg12  1  0.99998986  0.00000147  0.73782815  1.0
  Hg  Hg13  1  0.99998610  0.50000219  0.73783431  1.0
  Hg  Hg14  1  0.50002067  0.49999034  0.73791372  1.0
  Hg  Hg15  1  0.50002781  0.00000399  0.73790901  1.0