# generated using pymatgen
data_CaY4Zn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58441960
_cell_length_b   3.58441960
_cell_length_c   17.87986361
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaY4Zn5
_chemical_formula_sum   'Ca1 Y4 Zn5'
_cell_volume   229.72162994
_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
  Y  Y1  1  0.00000000  0.00000000  0.20195632  1.0
  Y  Y2  1  0.00000000  0.00000000  0.40072551  1.0
  Y  Y3  1  0.00000000  0.00000000  0.59927449  1.0
  Y  Y4  1  0.00000000  0.00000000  0.79804368  1.0
  Zn  Zn5  1  0.50000000  0.50000000  0.10879790  1.0
  Zn  Zn6  1  0.50000000  0.50000000  0.30082252  1.0
  Zn  Zn7  1  0.50000000  0.50000000  0.50000000  1.0
  Zn  Zn8  1  0.50000000  0.50000000  0.69917748  1.0
  Zn  Zn9  1  0.50000000  0.50000000  0.89120210  1.0