# generated using pymatgen
data_Sr4Si6HgIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.86472509
_cell_length_b   10.28484664
_cell_length_c   8.36974364
_cell_angle_alpha   78.24564059
_cell_angle_beta   58.06698825
_cell_angle_gamma   43.68127636
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr4Si6HgIr
_chemical_formula_sum   'Sr8 Si12 Hg2 Ir2'
_cell_volume   570.09929715
_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
  Sr  Sr0  1  0.13356888  0.11630033  0.87075450  1.0
  Sr  Sr1  1  0.87076973  0.87936600  0.13356211  1.0
  Sr  Sr2  1  0.13367479  0.11645761  0.37062638  1.0
  Sr  Sr3  1  0.37063821  0.37924050  0.13369308  1.0
  Sr  Sr4  1  0.61822650  0.63503710  0.37787281  1.0
  Sr  Sr5  1  0.37788224  0.36885215  0.61820842  1.0
  Sr  Sr6  1  0.61489584  0.63182227  0.88118763  1.0
  Sr  Sr7  1  0.88115823  0.87210890  0.61493140  1.0
  Si  Si8  1  0.90428306  0.59151664  0.43953280  1.0
  Si  Si9  1  0.09298211  0.40327969  0.57960497  1.0
  Si  Si10  1  0.43953772  0.06468309  0.90427224  1.0
  Si  Si11  1  0.57959994  0.92411951  0.09298261  1.0
  Si  Si12  1  0.32588204  0.67037312  0.84672602  1.0
  Si  Si13  1  0.65846208  0.34571452  0.18532305  1.0
  Si  Si14  1  0.84670920  0.15698995  0.32588471  1.0
  Si  Si15  1  0.18535856  0.81050424  0.65847127  1.0
  Si  Si16  1  0.90634828  0.59362612  0.90633978  1.0
  Si  Si17  1  0.57739340  0.92260395  0.57741663  1.0
  Si  Si18  1  0.32738391  0.67263481  0.32743085  1.0
  Si  Si19  1  0.65636929  0.34362945  0.65633707  1.0
  Hg  Hg20  1  0.08308589  0.41693339  0.08305816  1.0
  Hg  Hg21  1  0.83307155  0.16693026  0.83306967  1.0
  Ir  Ir22  1  0.16636306  0.83364496  0.16636292  1.0
  Ir  Ir23  1  0.41635950  0.08363745  0.41634691  1.0