# generated using pymatgen
data_Sm3Er2Sn3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22907197
_cell_length_b   9.22907239
_cell_length_c   6.69861935
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999849
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Er2Sn3Br
_chemical_formula_sum   'Sm6 Er4 Sn6 Br2'
_cell_volume   494.11953417
_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
  Sm  Sm0  1  0.73031098  0.00000000  0.75000000  1.0
  Sm  Sm1  1  0.73031098  0.73031098  0.25000000  1.0
  Sm  Sm2  1  0.00000000  0.26968902  0.25000000  1.0
  Sm  Sm3  1  1.00000000  0.73031098  0.75000000  1.0
  Sm  Sm4  1  0.26968902  0.26968902  0.75000000  1.0
  Sm  Sm5  1  0.26968902  0.00000000  0.25000000  1.0
  Er  Er6  1  0.66666700  0.33333300  0.00000000  1.0
  Er  Er7  1  0.33333300  0.66666700  0.50000000  1.0
  Er  Er8  1  0.66666700  0.33333300  0.50000000  1.0
  Er  Er9  1  0.33333300  0.66666700  0.00000000  1.0
  Sn  Sn10  1  0.60933298  0.60933298  0.75000000  1.0
  Sn  Sn11  1  0.00000000  0.60933298  0.25000000  1.0
  Sn  Sn12  1  0.60933298  0.00000000  0.25000000  1.0
  Sn  Sn13  1  0.39066702  0.00000000  0.75000000  1.0
  Sn  Sn14  1  1.00000000  0.39066702  0.75000000  1.0
  Sn  Sn15  1  0.39066702  0.39066702  0.25000000  1.0
  Br  Br16  1  0.00000000  0.00000000  0.50000000  1.0
  Br  Br17  1  0.00000000  0.00000000  0.00000000  1.0