# generated using pymatgen
data_Ca11Yb(TmSi2)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.35759363
_cell_length_b   7.78583827
_cell_length_c   14.99817145
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00913939
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca11Yb(TmSi2)8
_chemical_formula_sum   'Ca11 Yb1 Tm8 Si16'
_cell_volume   859.17075245
_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  0.97492241  0.81755465  0.40458416  1.0
  Ca  Ca1  1  0.47577538  0.68323741  0.09550842  1.0
  Ca  Ca2  1  0.52442930  0.31724512  0.59501120  1.0
  Ca  Ca3  1  0.02447741  0.18264193  0.90500817  1.0
  Ca  Ca4  1  0.02447741  0.18264193  0.59499183  1.0
  Ca  Ca5  1  0.52442930  0.31724512  0.90498880  1.0
  Ca  Ca6  1  0.47577538  0.68323741  0.40449158  1.0
  Ca  Ca7  1  0.97492241  0.81755465  0.09541584  1.0
  Ca  Ca8  1  0.35165977  0.01922653  0.75000000  1.0
  Ca  Ca9  1  0.85169497  0.48073442  0.75000000  1.0
  Ca  Ca10  1  0.14838410  0.51937859  0.25000000  1.0
  Yb  Yb11  1  0.64823694  0.98079986  0.25000000  1.0
  Tm  Tm12  1  0.31592128  0.17623858  0.12195997  1.0
  Tm  Tm13  1  0.81515972  0.32324590  0.37804600  1.0
  Tm  Tm14  1  0.18466451  0.67625069  0.87843373  1.0
  Tm  Tm15  1  0.68466028  0.82369680  0.62158514  1.0
  Tm  Tm16  1  0.31592128  0.17623858  0.37804003  1.0
  Tm  Tm17  1  0.81515972  0.32324590  0.12195400  1.0
  Tm  Tm18  1  0.18466451  0.67625069  0.62156627  1.0
  Tm  Tm19  1  0.68466028  0.82369680  0.87841486  1.0
  Si  Si20  1  0.85751572  0.53496839  0.53762017  1.0
  Si  Si21  1  0.35750388  0.96499832  0.96228706  1.0
  Si  Si22  1  0.64239805  0.03452300  0.46167573  1.0
  Si  Si23  1  0.14260231  0.46486837  0.03803685  1.0
  Si  Si24  1  0.14260231  0.46486837  0.46196315  1.0
  Si  Si25  1  0.64239805  0.03452300  0.03832427  1.0
  Si  Si26  1  0.35750388  0.96499832  0.53771294  1.0
  Si  Si27  1  0.85751572  0.53496839  0.96237983  1.0
  Si  Si28  1  0.97562772  0.87867605  0.75000000  1.0
  Si  Si29  1  0.47565633  0.62129294  0.75000000  1.0
  Si  Si30  1  0.52470170  0.37860328  0.25000000  1.0
  Si  Si31  1  0.02370592  0.12084573  0.25000000  1.0
  Si  Si32  1  0.24871244  0.39835159  0.75000000  1.0
  Si  Si33  1  0.74872053  0.10162550  0.75000000  1.0
  Si  Si34  1  0.25184184  0.89899799  0.25000000  1.0
  Si  Si35  1  0.75099921  0.60253321  0.25000000  1.0