# generated using pymatgen
data_ErTh(CuSi)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09531341
_cell_length_b   4.09531337
_cell_length_c   7.87904834
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000034
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTh(CuSi)2
_chemical_formula_sum   'Er1 Th1 Cu2 Si2'
_cell_volume   114.44021818
_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
  Er  Er0  1  0.00000000  0.00000000  0.00000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.50000000  1.0
  Cu  Cu2  1  0.33333300  0.66666700  0.24212512  1.0
  Cu  Cu3  1  0.66666700  0.33333300  0.75787488  1.0
  Si  Si4  1  0.66666700  0.33333300  0.23959182  1.0
  Si  Si5  1  0.33333300  0.66666700  0.76040818  1.0