# generated using pymatgen
data_CaEr2Zn11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.30371690
_cell_length_b   8.06602019
_cell_length_c   8.06602062
_cell_angle_alpha   66.52038103
_cell_angle_beta   74.52720101
_cell_angle_gamma   74.52720828
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaEr2Zn11
_chemical_formula_sum   'Ca1 Er2 Zn11'
_cell_volume   243.39768870
_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  0.00000000  1.0
  Er  Er1  1  0.70377839  0.29622161  0.29622161  1.0
  Er  Er2  1  0.29622161  0.70377839  0.70377839  1.0
  Zn  Zn3  1  0.00000000  0.50000000  0.50000000  1.0
  Zn  Zn4  1  0.50000000  0.68552964  0.31447036  1.0
  Zn  Zn5  1  0.50000000  0.31447036  0.68552964  1.0
  Zn  Zn6  1  0.66464380  0.69255685  0.97815555  1.0
  Zn  Zn7  1  0.33535620  0.30744315  0.02184445  1.0
  Zn  Zn8  1  0.66464380  0.97815555  0.69255685  1.0
  Zn  Zn9  1  0.33535620  0.02184445  0.30744315  1.0
  Zn  Zn10  1  0.86469155  0.41963813  0.85097876  1.0
  Zn  Zn11  1  0.13530845  0.58036187  0.14902124  1.0
  Zn  Zn12  1  0.86469155  0.85097876  0.41963813  1.0
  Zn  Zn13  1  0.13530845  0.14902124  0.58036187  1.0