# generated using pymatgen
data_Ca3Si2HgRh6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59032979
_cell_length_b   5.59033002
_cell_length_c   15.88124686
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999291
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Si2HgRh6
_chemical_formula_sum   'Ca6 Si4 Hg2 Rh12'
_cell_volume   429.82347912
_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
  Ca  Ca0  1  0.66666700  0.33333300  0.95672503  1.0
  Ca  Ca1  1  0.66666700  0.33333300  0.54327497  1.0
  Ca  Ca2  1  0.33333300  0.66666700  0.04327497  1.0
  Ca  Ca3  1  0.66666700  0.33333300  0.75000000  1.0
  Ca  Ca4  1  0.33333300  0.66666700  0.45672503  1.0
  Ca  Ca5  1  0.33333300  0.66666700  0.25000000  1.0
  Si  Si6  1  0.66666700  0.33333300  0.25000000  1.0
  Si  Si7  1  0.00000000  0.00000000  0.25000000  1.0
  Si  Si8  1  0.00000000  0.00000000  0.75000000  1.0
  Si  Si9  1  0.33333300  0.66666700  0.75000000  1.0
  Hg  Hg10  1  0.00000000  0.00000000  0.50000000  1.0
  Hg  Hg11  1  0.00000000  0.00000000  0.00000000  1.0
  Rh  Rh12  1  0.16695443  0.33390686  0.85722057  1.0
  Rh  Rh13  1  0.16695443  0.33390686  0.64277943  1.0
  Rh  Rh14  1  0.66609314  0.83304557  0.85722057  1.0
  Rh  Rh15  1  0.33390686  0.16695443  0.35722057  1.0
  Rh  Rh16  1  0.83304557  0.66609314  0.35722057  1.0
  Rh  Rh17  1  0.83304557  0.16695443  0.35722057  1.0
  Rh  Rh18  1  0.83304557  0.16695443  0.14277943  1.0
  Rh  Rh19  1  0.33390686  0.16695443  0.14277943  1.0
  Rh  Rh20  1  0.66609314  0.83304557  0.64277943  1.0
  Rh  Rh21  1  0.16695443  0.83304557  0.64277943  1.0
  Rh  Rh22  1  0.83304557  0.66609314  0.14277943  1.0
  Rh  Rh23  1  0.16695443  0.83304557  0.85722057  1.0