# generated using pymatgen
data_Ti8Cu3Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.94250030
_cell_length_b   2.94250030
_cell_length_c   21.06113635
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti8Cu3Ni
_chemical_formula_sum   'Ti8 Cu3 Ni1'
_cell_volume   182.35380567
_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
  Ti  Ti0  1  0.50000000  0.50000000  0.07659400  1
  Ti  Ti1  1  0.00000000  0.00000000  0.33101100  1
  Ti  Ti2  1  0.50000000  0.50000000  0.58109000  1
  Ti  Ti3  1  0.00000000  0.00000000  0.83349600  1
  Ti  Ti4  1  0.00000000  0.00000000  0.16650400  1
  Ti  Ti5  1  0.50000000  0.50000000  0.41891000  1
  Ti  Ti6  1  0.00000000  0.00000000  0.66898900  1
  Ti  Ti7  1  0.50000000  0.50000000  0.92340600  1
  Cu  Cu8  1  0.50000000  0.50000000  0.24972200  1
  Cu  Cu9  1  0.00000000  0.00000000  0.50000000  1
  Cu  Cu10  1  0.50000000  0.50000000  0.75027800  1
  Ni  Ni11  1  0.00000000  0.00000000  0.00000000  1
