# generated using pymatgen
data_CaEr7(Sn11Ru3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.77629223
_cell_length_b   9.77629250
_cell_length_c   10.02495375
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000576
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaEr7(Sn11Ru3)2
_chemical_formula_sum   'Ca1 Er7 Sn22 Ru6'
_cell_volume   829.77691030
_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  0.00000000  0.00000000  0.50000000  1.0
  Er  Er1  1  0.48317729  0.51682271  0.30810785  1.0
  Er  Er2  1  0.51682271  0.48317729  0.69189215  1.0
  Er  Er3  1  0.48317729  0.96635658  0.30810785  1.0
  Er  Er4  1  0.51682271  0.03364342  0.69189215  1.0
  Er  Er5  1  0.03364342  0.51682271  0.30810785  1.0
  Er  Er6  1  0.96635658  0.48317729  0.69189215  1.0
  Er  Er7  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn8  1  0.12904014  0.87095986  0.25780326  1.0
  Sn  Sn9  1  0.87095986  0.12904014  0.74219674  1.0
  Sn  Sn10  1  0.12904014  0.25808129  0.25780326  1.0
  Sn  Sn11  1  0.87095986  0.74191871  0.74219674  1.0
  Sn  Sn12  1  0.74191871  0.87095986  0.25780326  1.0
  Sn  Sn13  1  0.25808129  0.12904014  0.74219674  1.0
  Sn  Sn14  1  0.77782919  0.22217081  0.46060348  1.0
  Sn  Sn15  1  0.22217081  0.77782919  0.53939652  1.0
  Sn  Sn16  1  0.77782919  0.55565838  0.46060348  1.0
  Sn  Sn17  1  0.22217081  0.44434162  0.53939652  1.0
  Sn  Sn18  1  0.44434162  0.22217081  0.46060348  1.0
  Sn  Sn19  1  0.55565838  0.77782919  0.53939652  1.0
  Sn  Sn20  1  0.34892933  0.00000000  0.00000000  1.0
  Sn  Sn21  1  0.65107067  1.00000000  0.00000000  1.0
  Sn  Sn22  1  0.00000000  0.34892933  0.00000000  1.0
  Sn  Sn23  1  1.00000000  0.65107067  0.00000000  1.0
  Sn  Sn24  1  0.65107067  0.65107067  0.00000000  1.0
  Sn  Sn25  1  0.34892933  0.34892933  0.00000000  1.0
  Sn  Sn26  1  0.33333300  0.66666700  0.12701848  1.0
  Sn  Sn27  1  0.66666700  0.33333300  0.87298152  1.0
  Sn  Sn28  1  0.33333300  0.66666700  0.82244756  1.0
  Sn  Sn29  1  0.66666700  0.33333300  0.17755244  1.0
  Ru  Ru30  1  0.83233238  0.16766762  0.20535567  1.0
  Ru  Ru31  1  0.16766762  0.83233238  0.79464433  1.0
  Ru  Ru32  1  0.83233238  0.66466575  0.20535567  1.0
  Ru  Ru33  1  0.16766762  0.33533425  0.79464433  1.0
  Ru  Ru34  1  0.33533425  0.16766762  0.20535567  1.0
  Ru  Ru35  1  0.66466575  0.83233238  0.79464433  1.0