data_[Sm2H14C16S2O18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2781]
_cell_length_b [8.6328]
_cell_length_c [10.5762]
_cell_angle_alpha [91.4553]
_cell_angle_beta [99.5071]
_cell_angle_gamma [107.8616]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SmH7C8SO9]
_chemical_formula_sum '[Sm2 H14 C16 S2 O18]'
_cell_volume [536.3094]
_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  2  0.1499  0.2385  0.6107  1
  H  H1  2  0.1798  0.1513  0.0547  1
  H  H2  2  0.3208  0.9508  0.6126  1
  H  H3  2  0.3408  0.6475  0.2851  1
  H  H4  2  0.3516  0.6438  0.0823  1
  H  H5  2  0.3876  0.5883  0.8564  1
  H  H6  2  0.4125  0.4983  0.3453  1
  H  H7  2  0.4556  0.9085  0.3178  1
  C  C8  2  0.0194  0.2259  0.1997  1
  C  C9  2  0.0230  0.7656  0.1564  1
  C  C10  2  0.0488  0.2021  0.0743  1
  C  C11  2  0.0826  0.7503  0.0275  1
  C  C12  2  0.1357  0.6952  0.7737  1
  C  C13  2  0.1599  0.6512  0.6398  1
  C  C14  2  0.2464  0.6798  0.0035  1
  C  C15  2  0.2676  0.6495  0.8772  1
  S  S16  2  0.2153  0.1739  0.3192  1
  O  O17  2  0.0919  0.0417  0.3928  1
  O  O18  2  0.1512  0.7476  0.2598  1
  O  O19  2  0.1607  0.7543  0.5553  1
  O  O20  2  0.1632  0.2071  0.8373  1
  O  O21  2  0.1790  0.5126  0.6186  1
  O  O22  2  0.3174  0.3205  0.4128  1
  O  O23  2  0.3732  0.1295  0.2522  1
  O  O24  2  0.3885  0.0702  0.6358  1
  O  O25  2  0.4655  0.5970  0.2984  1
]