# generated using pymatgen
data_Sm2Fe17B3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56729185
_cell_length_b   6.56729185
_cell_length_c   6.56729201
_cell_angle_alpha   84.00218713
_cell_angle_beta   84.00218713
_cell_angle_gamma   84.00218414
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2Fe17B3
_chemical_formula_sum   'Sm2 Fe17 B3'
_cell_volume   278.89382220
_cell_formula_units_Z   1
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  0.65724400  0.65724400  0.65724400  1.0
  Sm  Sm1  1  0.34275600  0.34275600  0.34275600  1.0
  Fe  Fe2  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe3  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe4  1  0.50000000  0.00000000  0.00000000  1.0
  Fe  Fe5  1  0.27954600  0.72045400  0.00000000  1.0
  Fe  Fe6  1  0.72045400  0.00000000  0.27954600  1.0
  Fe  Fe7  1  0.00000000  0.27954600  0.72045400  1.0
  Fe  Fe8  1  0.27954600  0.00000000  0.72045400  1.0
  Fe  Fe9  1  0.00000000  0.72045400  0.27954600  1.0
  Fe  Fe10  1  0.72045400  0.27954600  0.00000000  1.0
  Fe  Fe11  1  0.33830400  0.33830400  0.85045200  1.0
  Fe  Fe12  1  0.33830400  0.85045200  0.33830400  1.0
  Fe  Fe13  1  0.85045200  0.33830400  0.33830400  1.0
  Fe  Fe14  1  0.66169600  0.66169600  0.14954800  1.0
  Fe  Fe15  1  0.66169600  0.14954800  0.66169600  1.0
  Fe  Fe16  1  0.14954800  0.66169600  0.66169600  1.0
  Fe  Fe17  1  0.90501500  0.90501500  0.90501500  1.0
  Fe  Fe18  1  0.09498500  0.09498500  0.09498500  1.0
  B  B19  1  0.50000000  0.50000000  0.00000000  1.0
  B  B20  1  0.50000000  0.00000000  0.50000000  1.0
  B  B21  1  0.00000000  0.50000000  0.50000000  1.0