# generated using pymatgen
data_CaYb3(BeSi3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.03907054
_cell_length_b   7.84020220
_cell_length_c   5.82183845
_cell_angle_alpha   70.32473227
_cell_angle_beta   66.68207446
_cell_angle_gamma   42.99320171
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYb3(BeSi3)2
_chemical_formula_sum   'Ca1 Yb3 Be2 Si6'
_cell_volume   229.12968645
_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  0.25000000  0.25000000  0.25000100  1.0
  Yb  Yb1  1  0.24279910  0.75720090  0.24280010  1.0
  Yb  Yb2  1  0.75720090  0.24280010  0.75720190  1.0
  Yb  Yb3  1  0.75000100  0.74999900  0.75000000  1.0
  Be  Be4  1  0.66660920  0.66661020  0.33339080  1.0
  Be  Be5  1  0.33338980  0.33339080  0.66661020  1.0
  Si  Si6  1  0.82358472  0.34810003  0.17244446  1.0
  Si  Si7  1  0.82861007  0.82861007  0.17139093  1.0
  Si  Si8  1  0.65587180  0.17244446  0.34810003  1.0
  Si  Si9  1  0.34810003  0.82358472  0.65587280  1.0
  Si  Si10  1  0.17138993  0.17139093  0.82861107  1.0
  Si  Si11  1  0.17244346  0.65587280  0.82358472  1.0