# generated using pymatgen
data_ErTh3(ZnRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93197967
_cell_length_b   7.01818496
_cell_length_c   8.40097035
_cell_angle_alpha   90.38057200
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTh3(ZnRu)4
_chemical_formula_sum   'Er1 Th3 Zn4 Ru4'
_cell_volume   231.82269211
_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  0.25000000  0.04168327  0.31306013  1.0
  Th  Th1  1  0.25000000  0.53897091  0.19135900  1.0
  Th  Th2  1  0.75000000  0.46621837  0.81479470  1.0
  Th  Th3  1  0.75000000  0.96106233  0.67783640  1.0
  Zn  Zn4  1  0.25000000  0.62596923  0.55310245  1.0
  Zn  Zn5  1  0.75000000  0.35814448  0.44391688  1.0
  Zn  Zn6  1  0.75000000  0.88417749  0.06301854  1.0
  Zn  Zn7  1  0.25000000  0.12404432  0.95061986  1.0
  Ru  Ru8  1  0.25000000  0.74811663  0.86536602  1.0
  Ru  Ru9  1  0.75000000  0.26530893  0.12721843  1.0
  Ru  Ru10  1  0.75000000  0.74417160  0.36437612  1.0
  Ru  Ru11  1  0.25000000  0.24213246  0.63533249  1.0