# generated using pymatgen
data_SmB3W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17347541
_cell_length_b   5.53749109
_cell_length_c   6.92017601
_cell_angle_alpha   76.46292335
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmB3W
_chemical_formula_sum   'Sm2 B6 W2'
_cell_volume   118.23042936
_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  0.25000000  0.33200761  0.70472247  1.0
  Sm  Sm1  1  0.75000000  0.66799239  0.29527753  1.0
  B  B2  1  0.25000000  0.92026074  0.52815475  1.0
  B  B3  1  0.75000000  0.07973926  0.47184525  1.0
  B  B4  1  0.25000000  0.91294416  0.00445617  1.0
  B  B5  1  0.75000000  0.08705584  0.99554383  1.0
  B  B6  1  0.25000000  0.58258373  0.00606650  1.0
  B  B7  1  0.75000000  0.41741627  0.99393350  1.0
  W  W8  1  0.25000000  0.18385659  0.21661907  1.0
  W  W9  1  0.75000000  0.81614341  0.78338093  1.0