# generated using pymatgen
data_Er8Hg3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.98798446
_cell_length_b   9.98798477
_cell_length_c   7.16949639
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000219
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er8Hg3Ir
_chemical_formula_sum   'Er16 Hg6 Ir2'
_cell_volume   619.40542088
_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
  Er  Er0  1  0.00000000  0.00000000  0.26082858  1.0
  Er  Er1  1  0.00000000  0.00000000  0.76082858  1.0
  Er  Er2  1  0.17204571  0.82795429  0.98246579  1.0
  Er  Er3  1  0.82795429  0.17204571  0.48246579  1.0
  Er  Er4  1  0.17204571  0.34409042  0.98246579  1.0
  Er  Er5  1  0.65590958  0.82795429  0.98246579  1.0
  Er  Er6  1  0.34409042  0.17204571  0.48246579  1.0
  Er  Er7  1  0.82795429  0.65590958  0.48246579  1.0
  Er  Er8  1  0.33333300  0.66666700  0.67828688  1.0
  Er  Er9  1  0.66666700  0.33333300  0.17828688  1.0
  Er  Er10  1  0.46211451  0.53788549  0.29356559  1.0
  Er  Er11  1  0.53788549  0.46211451  0.79356559  1.0
  Er  Er12  1  0.46211451  0.92423002  0.29356559  1.0
  Er  Er13  1  0.07576998  0.53788549  0.29356559  1.0
  Er  Er14  1  0.92423002  0.46211451  0.79356559  1.0
  Er  Er15  1  0.53788549  0.07576998  0.79356559  1.0
  Hg  Hg16  1  0.16734434  0.83265566  0.54997492  1.0
  Hg  Hg17  1  0.83265566  0.16734434  0.04997492  1.0
  Hg  Hg18  1  0.16734434  0.33468869  0.54997492  1.0
  Hg  Hg19  1  0.66531131  0.83265566  0.54997492  1.0
  Hg  Hg20  1  0.33468869  0.16734434  0.04997492  1.0
  Hg  Hg21  1  0.83265566  0.66531131  0.04997492  1.0
  Ir  Ir22  1  0.33333300  0.66666700  0.05592564  1.0
  Ir  Ir23  1  0.66666700  0.33333300  0.55592564  1.0