# generated using pymatgen
data_Ti2Be16Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58755845
_cell_length_b   5.58755865
_cell_length_c   5.58755822
_cell_angle_alpha   82.88792160
_cell_angle_beta   82.88791488
_cell_angle_gamma   82.88792998
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2Be16Cu
_chemical_formula_sum   'Ti2 Be16 Cu1'
_cell_volume   170.72833099
_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  0.15961124  0.15961124  0.15961124  1.0
  Ti  Ti1  1  0.83727744  0.83727744  0.83727744  1.0
  Be  Be2  1  0.60410321  0.60410321  0.60410321  1.0
  Be  Be3  1  0.50221346  0.50221346  0.99660461  1.0
  Be  Be4  1  0.50221346  0.99660461  0.50221346  1.0
  Be  Be5  1  0.99660461  0.50221346  0.50221346  1.0
  Be  Be6  1  0.49875818  0.79538540  0.20410580  1.0
  Be  Be7  1  0.79538540  0.20410580  0.49875818  1.0
  Be  Be8  1  0.20410580  0.49875818  0.79538540  1.0
  Be  Be9  1  0.49875818  0.20410580  0.79538540  1.0
  Be  Be10  1  0.20410580  0.79538540  0.49875818  1.0
  Be  Be11  1  0.79538540  0.49875818  0.20410580  1.0
  Be  Be12  1  0.66025636  0.15259112  0.15259112  1.0
  Be  Be13  1  0.15259112  0.15259112  0.66025636  1.0
  Be  Be14  1  0.15259112  0.66025636  0.15259112  1.0
  Be  Be15  1  0.84680805  0.33981774  0.84680805  1.0
  Be  Be16  1  0.33981774  0.84680805  0.84680805  1.0
  Be  Be17  1  0.84680805  0.84680805  0.33981774  1.0
  Cu  Cu18  1  0.40260737  0.40260737  0.40260737  1.0