# generated using pymatgen
data_Ac4Al5Br2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.23177367
_cell_length_b   12.23177268
_cell_length_c   4.48485105
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.21246786
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ac4Al5Br2
_chemical_formula_sum   'Ac8 Al10 Br4'
_cell_volume   669.95228428
_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
  Ac  Ac0  1  0.73456322  0.73456322  0.00000000  1.0
  Ac  Ac1  1  0.03911832  0.67662658  0.50000000  1.0
  Ac  Ac2  1  0.36567009  0.63432991  0.00000000  1.0
  Ac  Ac3  1  0.96088168  0.32337342  0.50000000  1.0
  Ac  Ac4  1  0.26543678  0.26543678  0.00000000  1.0
  Ac  Ac5  1  0.63432991  0.36567009  0.00000000  1.0
  Ac  Ac6  1  0.67662658  0.03911832  0.50000000  1.0
  Ac  Ac7  1  0.32337342  0.96088168  0.50000000  1.0
  Al  Al8  1  0.57934863  0.57934863  0.50000000  1.0
  Al  Al9  1  0.42065137  0.42065137  0.50000000  1.0
  Al  Al10  1  0.21491155  0.47789259  0.50000000  1.0
  Al  Al11  1  0.78508845  0.52210741  0.50000000  1.0
  Al  Al12  1  0.52841587  0.89810482  0.00000000  1.0
  Al  Al13  1  0.52210741  0.78508845  0.50000000  1.0
  Al  Al14  1  0.47158413  0.10189518  0.00000000  1.0
  Al  Al15  1  0.10189518  0.47158413  0.00000000  1.0
  Al  Al16  1  0.47789259  0.21491155  0.50000000  1.0
  Al  Al17  1  0.89810482  0.52841587  0.00000000  1.0
  Br  Br18  1  0.88023880  0.88023880  0.50000000  1.0
  Br  Br19  1  0.17074590  0.82925410  0.00000000  1.0
  Br  Br20  1  0.11976120  0.11976120  0.50000000  1.0
  Br  Br21  1  0.82925410  0.17074590  0.00000000  1.0