# generated using pymatgen
data_Sm3GeBr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.24958101
_cell_length_b   10.24958126
_cell_length_c   10.24958074
_cell_angle_alpha   109.47122156
_cell_angle_beta   109.47122207
_cell_angle_gamma   109.47121870
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3GeBr3
_chemical_formula_sum   'Sm12 Ge4 Br12'
_cell_volume   828.88912772
_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  0.47935522  0.48967861  0.23967861  1.0
  Sm  Sm1  1  0.75000000  0.23967861  0.26032139  1.0
  Sm  Sm2  1  0.75000000  0.01032139  0.48967861  1.0
  Sm  Sm3  1  0.23967861  0.47935522  0.48967861  1.0
  Sm  Sm4  1  0.26032139  0.75000000  0.23967861  1.0
  Sm  Sm5  1  0.02064478  0.26032139  0.01032139  1.0
  Sm  Sm6  1  0.01032139  0.02064478  0.26032139  1.0
  Sm  Sm7  1  0.48967861  0.75000000  0.01032139  1.0
  Sm  Sm8  1  0.48967861  0.23967861  0.47935522  1.0
  Sm  Sm9  1  0.01032139  0.48967861  0.75000000  1.0
  Sm  Sm10  1  0.26032139  0.01032139  0.02064478  1.0
  Sm  Sm11  1  0.23967861  0.26032139  0.75000000  1.0
  Ge  Ge12  1  0.25000000  0.25000000  0.25000000  1.0
  Ge  Ge13  1  0.50000000  0.00000000  0.25000000  1.0
  Ge  Ge14  1  0.00000000  0.25000000  0.50000000  1.0
  Ge  Ge15  1  0.25000000  0.50000000  0.00000000  1.0
  Br  Br16  1  0.25000000  0.75556321  0.74443679  1.0
  Br  Br17  1  0.51112442  0.50556321  0.75556321  1.0
  Br  Br18  1  0.98887558  0.74443679  0.99443679  1.0
  Br  Br19  1  0.74443679  0.25000000  0.75556321  1.0
  Br  Br20  1  0.99443679  0.98887558  0.74443679  1.0
  Br  Br21  1  0.25000000  0.99443679  0.50556321  1.0
  Br  Br22  1  0.75556321  0.51112442  0.50556321  1.0
  Br  Br23  1  0.50556321  0.25000000  0.99443679  1.0
  Br  Br24  1  0.75556321  0.74443679  0.25000000  1.0
  Br  Br25  1  0.74443679  0.99443679  0.98887558  1.0
  Br  Br26  1  0.99443679  0.50556321  0.25000000  1.0
  Br  Br27  1  0.50556321  0.75556321  0.51112442  1.0