# generated using pymatgen
data_Ca2AlZn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71881132
_cell_length_b   5.71881252
_cell_length_c   8.11911463
_cell_angle_alpha   79.51591738
_cell_angle_beta   79.51591786
_cell_angle_gamma   61.87461312
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2AlZn2
_chemical_formula_sum   'Ca4 Al2 Zn4'
_cell_volume   228.84903092
_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  0.78480707  0.51365490  0.35066620  1.0
  Ca  Ca1  1  0.48634510  0.21519293  0.14933380  1.0
  Ca  Ca2  1  0.21519293  0.48634510  0.64933380  1.0
  Ca  Ca3  1  0.51365490  0.78480707  0.85066620  1.0
  Al  Al4  1  0.12420173  0.87579827  0.25000000  1.0
  Al  Al5  1  0.87579827  0.12420173  0.75000000  1.0
  Zn  Zn6  1  0.00216174  0.72517315  0.00011620  1.0
  Zn  Zn7  1  0.27482685  0.99783826  0.49988380  1.0
  Zn  Zn8  1  0.99783826  0.27482685  0.99988380  1.0
  Zn  Zn9  1  0.72517315  0.00216174  0.50011620  1.0