# generated using pymatgen
data_SmBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97962433
_cell_length_b   6.79900415
_cell_length_c   14.29591839
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmBr2
_chemical_formula_sum   'Sm4 Br8'
_cell_volume   386.81155930
_cell_formula_units_Z   4
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  0.25000000  0.74808678  0.00063878  1.0
  Sm  Sm1  1  0.75000000  0.25191322  0.99936122  1.0
  Sm  Sm2  1  0.75000000  0.75191322  0.50063878  1.0
  Sm  Sm3  1  0.25000000  0.24808678  0.49936122  1.0
  Br  Br4  1  0.25000000  0.58381573  0.62890449  1.0
  Br  Br5  1  0.75000000  0.41618427  0.37109551  1.0
  Br  Br6  1  0.75000000  0.91618427  0.12890449  1.0
  Br  Br7  1  0.25000000  0.08381573  0.87109551  1.0
  Br  Br8  1  0.25000000  0.41264387  0.12958528  1.0
  Br  Br9  1  0.75000000  0.58735613  0.87041472  1.0
  Br  Br10  1  0.75000000  0.08735613  0.62958528  1.0
  Br  Br11  1  0.25000000  0.91264387  0.37041472  1.0