# generated using pymatgen
data_Nd6GaGeBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.40782388
_cell_length_b   10.40782385
_cell_length_c   10.41607944
_cell_angle_alpha   109.46257870
_cell_angle_beta   109.46257769
_cell_angle_gamma   109.45638838
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd6GaGeBr6
_chemical_formula_sum   'Nd12 Ga2 Ge2 Br12'
_cell_volume   868.90897028
_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
  Nd  Nd0  1  0.25956454  0.00956454  0.01912908  1.0
  Nd  Nd1  1  0.01808215  0.25923833  0.00842807  1.0
  Nd  Nd2  1  0.49034592  0.74918973  0.00842807  1.0
  Nd  Nd3  1  0.75087435  0.24107043  0.25911325  1.0
  Nd  Nd4  1  0.00823890  0.01804382  0.25911325  1.0
  Nd  Nd5  1  0.00842032  0.49157968  0.75000000  1.0
  Nd  Nd6  1  0.24157968  0.25842032  0.75000000  1.0
  Nd  Nd7  1  0.25892957  0.74912565  0.24088675  1.0
  Nd  Nd8  1  0.24076167  0.48191785  0.49157193  1.0
  Nd  Nd9  1  0.48195618  0.49176110  0.24088675  1.0
  Nd  Nd10  1  0.75081027  0.00965408  0.49157193  1.0
  Nd  Nd11  1  0.49043546  0.24043546  0.48087092  1.0
  Ga  Ga12  1  0.00018159  0.25018159  0.50036317  1.0
  Ga  Ga13  1  0.24981841  0.49981841  0.99963683  1.0
  Ge  Ge14  1  0.50019003  0.99980997  0.25000000  1.0
  Ge  Ge15  1  0.24980997  0.25019003  0.25000000  1.0
  Br  Br16  1  0.75554193  0.74445807  0.25000000  1.0
  Br  Br17  1  0.50538246  0.24967398  0.99529662  1.0
  Br  Br18  1  0.25032602  0.99461754  0.50470338  1.0
  Br  Br19  1  0.51196620  0.50571996  0.75535673  1.0
  Br  Br20  1  0.99428004  0.98803380  0.74464327  1.0
  Br  Br21  1  0.74421272  0.99421272  0.98842645  1.0
  Br  Br22  1  0.50578728  0.75578728  0.51157355  1.0
  Br  Br23  1  0.75437635  0.51008484  0.50470338  1.0
  Br  Br24  1  0.99445807  0.50554193  0.25000000  1.0
  Br  Br25  1  0.98991516  0.74562365  0.99529662  1.0
  Br  Br26  1  0.25036223  0.75661047  0.74464327  1.0
  Br  Br27  1  0.74338953  0.24963777  0.75535673  1.0