# generated using pymatgen
data_Ca3Yb3(PrSn2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.97476575
_cell_length_b   8.51111809
_cell_length_c   16.00532176
_cell_angle_alpha   89.98616132
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Yb3(PrSn2)4
_chemical_formula_sum   'Ca6 Yb6 Pr8 Sn16'
_cell_volume   1086.34794739
_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  0.32794061  0.82762255  0.87766075  1.0
  Ca  Ca1  1  0.82794061  0.67237745  0.62233925  1.0
  Ca  Ca2  1  0.15585171  0.50418597  0.75003514  1.0
  Ca  Ca3  1  0.65585171  0.99581403  0.74996486  1.0
  Ca  Ca4  1  0.84394090  0.49567789  0.24984035  1.0
  Ca  Ca5  1  0.34394090  0.00432211  0.25015965  1.0
  Yb  Yb6  1  0.67152082  0.17229461  0.37595682  1.0
  Yb  Yb7  1  0.17152082  0.32770539  0.12404318  1.0
  Yb  Yb8  1  0.67224605  0.17293331  0.12392952  1.0
  Yb  Yb9  1  0.17224605  0.32706669  0.37607048  1.0
  Yb  Yb10  1  0.32757183  0.82782684  0.62345057  1.0
  Yb  Yb11  1  0.82757183  0.67217316  0.87654943  1.0
  Pr  Pr12  1  0.48907597  0.31339831  0.90423734  1.0
  Pr  Pr13  1  0.98907597  0.18660169  0.59576266  1.0
  Pr  Pr14  1  0.51060972  0.68584116  0.40389278  1.0
  Pr  Pr15  1  0.01060972  0.81415884  0.09610722  1.0
  Pr  Pr16  1  0.51078075  0.68584266  0.09651878  1.0
  Pr  Pr17  1  0.01078075  0.81415734  0.40348122  1.0
  Pr  Pr18  1  0.48936259  0.31370722  0.59591264  1.0
  Pr  Pr19  1  0.98936259  0.18629278  0.90408736  1.0
  Sn  Sn20  1  0.33582526  0.03734607  0.04117019  1.0
  Sn  Sn21  1  0.83582526  0.46265393  0.45882981  1.0
  Sn  Sn22  1  0.66433140  0.96671840  0.53886019  1.0
  Sn  Sn23  1  0.16433140  0.53328160  0.96113981  1.0
  Sn  Sn24  1  0.66755283  0.96459124  0.96160682  1.0
  Sn  Sn25  1  0.16755283  0.53540876  0.53839318  1.0
  Sn  Sn26  1  0.33381740  0.03613524  0.46016710  1.0
  Sn  Sn27  1  0.83381740  0.46386476  0.03983290  1.0
  Sn  Sn28  1  0.52930575  0.60253130  0.74961100  1.0
  Sn  Sn29  1  0.02930575  0.89746870  0.75038900  1.0
  Sn  Sn30  1  0.47035950  0.39573048  0.25009818  1.0
  Sn  Sn31  1  0.97035950  0.10426952  0.24990182  1.0
  Sn  Sn32  1  0.28092521  0.14011037  0.74933989  1.0
  Sn  Sn33  1  0.78092521  0.35988963  0.75066011  1.0
  Sn  Sn34  1  0.71898070  0.86162878  0.25001903  1.0
  Sn  Sn35  1  0.21898070  0.63837122  0.24998097  1.0