# generated using pymatgen
data_Sm6B2(CI)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71438279
_cell_length_b   3.86108263
_cell_length_c   10.41233248
_cell_angle_alpha   90.00000000
_cell_angle_beta   113.49378378
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm6B2(CI)3
_chemical_formula_sum   'Sm6 B2 C3 I3'
_cell_volume   321.30096305
_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  0.36986107  0.50000100  0.23321884  1.0
  Sm  Sm1  1  0.63013793  0.50000100  0.76678016  1.0
  Sm  Sm2  1  0.95827323  0.50000100  0.15786866  1.0
  Sm  Sm3  1  0.04172677  0.50000100  0.84213134  1.0
  Sm  Sm4  1  0.29472359  0.00000000  0.47643784  1.0
  Sm  Sm5  1  0.70527641  0.00000000  0.52356216  1.0
  B  B6  1  0.09267784  0.00000000  0.06625793  1.0
  B  B7  1  0.90732416  0.00000000  0.93374307  1.0
  C  C8  1  0.17182911  0.00000000  0.22538175  1.0
  C  C9  1  0.82817089  0.00000000  0.77461725  1.0
  C  C10  1  0.50000000  0.50000100  0.50000000  1.0
  I  I11  1  0.64998825  0.00000000  0.18764887  1.0
  I  I12  1  0.35001275  0.00000000  0.81235213  1.0
  I  I13  1  0.00000000  0.50000100  0.50000000  1.0