# generated using pymatgen
data_ErTh2(GeIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.23898576
_cell_length_b   7.26831358
_cell_length_c   3.93711749
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.13410672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTh2(GeIr)3
_chemical_formula_sum   'Er1 Th2 Ge3 Ir3'
_cell_volume   179.15622999
_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  1.00000000  0.59504661  0.50000000  1.0
  Th  Th1  1  0.41335106  0.41433595  0.50000000  1.0
  Th  Th2  1  0.58664894  0.00098489  0.50000000  1.0
  Ge  Ge3  1  0.76232638  0.75093230  0.00000000  1.0
  Ge  Ge4  1  0.23767362  0.98860592  0.00000000  1.0
  Ge  Ge5  1  1.00000000  0.25689432  0.00000000  1.0
  Ir  Ir6  1  0.66295226  0.32871640  0.00000000  1.0
  Ir  Ir7  1  0.33704774  0.66576514  0.00000000  1.0
  Ir  Ir8  1  0.00000000  0.99871648  0.50000000  1.0