# generated using pymatgen
data_CaAl7Cu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02922307
_cell_length_b   6.65271842
_cell_length_c   6.65271937
_cell_angle_alpha   97.78367047
_cell_angle_beta   112.20877746
_cell_angle_gamma   67.79121899
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAl7Cu5
_chemical_formula_sum   'Ca1 Al7 Cu5'
_cell_volume   190.77837343
_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  0.00169957  0.99830043  0.00169957  1.0
  Al  Al1  1  0.64874496  0.35125504  0.64874496  1.0
  Al  Al2  1  0.34540808  0.65459192  0.34540808  1.0
  Al  Al3  1  0.99151128  0.35703708  0.34005963  1.0
  Al  Al4  1  0.99151128  0.65994037  0.64296292  1.0
  Al  Al5  1  0.27191172  0.22808828  0.77191172  1.0
  Al  Al6  1  0.50689299  0.78242957  0.79621655  1.0
  Al  Al7  1  0.50689299  0.20378345  0.21757043  1.0
  Cu  Cu8  1  0.50063333  0.00118199  0.50435322  1.0
  Cu  Cu9  1  0.00253790  0.00118199  0.50435322  1.0
  Cu  Cu10  1  0.50063333  0.49564678  0.99881801  1.0
  Cu  Cu11  1  0.00253790  0.49564678  0.99881801  1.0
  Cu  Cu12  1  0.72908269  0.77091731  0.22908269  1.0