# generated using pymatgen
data_CaZn13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.51515952
_cell_length_b   8.51515958
_cell_length_c   8.51515818
_cell_angle_alpha   59.99999759
_cell_angle_beta   59.99999737
_cell_angle_gamma   59.99999615
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaZn13
_chemical_formula_sum   'Ca2 Zn26'
_cell_volume   436.57943330
_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  0.75000000  0.75000000  0.75000000  1.0
  Ca  Ca1  1  0.25000000  0.25000000  0.25000000  1.0
  Zn  Zn2  1  0.79978542  0.55968384  0.44031616  1.0
  Zn  Zn3  1  0.94031616  0.70021458  0.05968384  1.0
  Zn  Zn4  1  0.44031616  0.79978542  0.55968384  1.0
  Zn  Zn5  1  0.55968384  0.44031616  0.79978542  1.0
  Zn  Zn6  1  0.79978542  0.44031616  0.20021458  1.0
  Zn  Zn7  1  0.05968384  0.94031616  0.70021458  1.0
  Zn  Zn8  1  0.55968384  0.20021458  0.44031616  1.0
  Zn  Zn9  1  0.94031616  0.29978542  0.70021458  1.0
  Zn  Zn10  1  0.20021458  0.79978542  0.44031616  1.0
  Zn  Zn11  1  0.70021458  0.05968384  0.94031616  1.0
  Zn  Zn12  1  0.29978542  0.94031616  0.05968384  1.0
  Zn  Zn13  1  0.29978542  0.70021458  0.94031616  1.0
  Zn  Zn14  1  0.29978542  0.05968384  0.70021458  1.0
  Zn  Zn15  1  0.44031616  0.55968384  0.20021458  1.0
  Zn  Zn16  1  0.44031616  0.20021458  0.79978542  1.0
  Zn  Zn17  1  0.70021458  0.94031616  0.29978542  1.0
  Zn  Zn18  1  0.70021458  0.29978542  0.05968384  1.0
  Zn  Zn19  1  0.79978542  0.20021458  0.55968384  1.0
  Zn  Zn20  1  0.94031616  0.05968384  0.29978542  1.0
  Zn  Zn21  1  0.55968384  0.79978542  0.20021458  1.0
  Zn  Zn22  1  0.05968384  0.70021458  0.29978542  1.0
  Zn  Zn23  1  0.20021458  0.55968384  0.79978542  1.0
  Zn  Zn24  1  0.05968384  0.29978542  0.94031616  1.0
  Zn  Zn25  1  0.20021458  0.44031616  0.55968384  1.0
  Zn  Zn26  1  -0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn27  1  0.50000000  0.50000000  0.50000000  1.0