# generated using pymatgen
data_Ca11Y(SiIr)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78004786
_cell_length_b   7.68166701
_cell_length_c   13.24914910
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.02485371
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca11Y(SiIr)8
_chemical_formula_sum   'Ca11 Y1 Si8 Ir8'
_cell_volume   588.26750421
_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
  Ca  Ca0  1  0.13296817  0.61096296  0.10033272  1.0
  Ca  Ca1  1  0.13194666  0.89126012  0.90066961  1.0
  Ca  Ca2  1  0.86756340  0.11081955  0.39870906  1.0
  Ca  Ca3  1  0.87037101  0.38496302  0.60040053  1.0
  Ca  Ca4  1  0.87037101  0.38496302  0.89959947  1.0
  Ca  Ca5  1  0.86756340  0.11081955  0.10129094  1.0
  Ca  Ca6  1  0.13194666  0.89126012  0.59933039  1.0
  Ca  Ca7  1  0.13296817  0.61096296  0.39966728  1.0
  Ca  Ca8  1  0.36633277  0.27485601  0.25000000  1.0
  Ca  Ca9  1  0.36726694  0.23030209  0.75000000  1.0
  Ca  Ca10  1  0.63424394  0.77410278  0.25000000  1.0
  Y  Y11  1  0.62309002  0.72622805  0.75000000  1.0
  Si  Si12  1  0.83257729  0.42610986  0.25000000  1.0
  Si  Si13  1  0.83274012  0.07227674  0.75000000  1.0
  Si  Si14  1  0.16832784  0.92647552  0.25000000  1.0
  Si  Si15  1  0.15525222  0.58105217  0.75000000  1.0
  Si  Si16  1  0.41983191  0.24955701  0.99834570  1.0
  Si  Si17  1  0.58082636  0.74924581  0.50046157  1.0
  Si  Si18  1  0.58082636  0.74924581  0.99953843  1.0
  Si  Si19  1  0.41983191  0.24955701  0.50165430  1.0
  Ir  Ir20  1  0.63884091  0.47655522  0.08950215  1.0
  Ir  Ir21  1  0.63845873  0.01876833  0.90830293  1.0
  Ir  Ir22  1  0.36405822  0.97674651  0.40941303  1.0
  Ir  Ir23  1  0.36521855  0.52542136  0.59268108  1.0
  Ir  Ir24  1  0.36521855  0.52542136  0.90731892  1.0
  Ir  Ir25  1  0.36405822  0.97674651  0.09058697  1.0
  Ir  Ir26  1  0.63845873  0.01876833  0.59169707  1.0
  Ir  Ir27  1  0.63884091  0.47655522  0.41049785  1.0