# generated using pymatgen
data_Nd3Er2Pb3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.42071155
_cell_length_b   9.42071235
_cell_length_c   6.76056128
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000066
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Er2Pb3Br
_chemical_formula_sum   'Nd6 Er4 Pb6 Br2'
_cell_volume   519.61398634
_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  0.26775546  0.00000000  0.25000000  1.0
  Nd  Nd1  1  0.73224454  1.00000000  0.75000000  1.0
  Nd  Nd2  1  1.00000000  0.26775546  0.25000000  1.0
  Nd  Nd3  1  0.00000000  0.73224454  0.75000000  1.0
  Nd  Nd4  1  0.73224454  0.73224454  0.25000000  1.0
  Nd  Nd5  1  0.26775546  0.26775546  0.75000000  1.0
  Er  Er6  1  0.33333300  0.66666700  0.00000000  1.0
  Er  Er7  1  0.66666700  0.33333300  0.00000000  1.0
  Er  Er8  1  0.66666700  0.33333300  0.50000000  1.0
  Er  Er9  1  0.33333300  0.66666700  0.50000000  1.0
  Pb  Pb10  1  0.61039098  1.00000000  0.25000000  1.0
  Pb  Pb11  1  0.38960902  0.00000000  0.75000000  1.0
  Pb  Pb12  1  0.00000000  0.61039098  0.25000000  1.0
  Pb  Pb13  1  1.00000000  0.38960902  0.75000000  1.0
  Pb  Pb14  1  0.38960902  0.38960902  0.25000000  1.0
  Pb  Pb15  1  0.61039098  0.61039098  0.75000000  1.0
  Br  Br16  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br17  1  0.00000000  0.00000000  0.50000000  1.0