data_[Sm1Cd2Mo1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Cd  1.6900  1.5500  1.0900
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6750]
_cell_length_b [5.7066]
_cell_length_c [5.9410]
_cell_angle_alpha [61.3497]
_cell_angle_beta [62.4725]
_cell_angle_gamma [60.5546]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [SmCd2MoO6]
_chemical_formula_sum '[Sm1 Cd2 Mo1 O6]'
_cell_volume [140.4274]
_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  0.8195  0.8089  0.5664  1.0
  Cd  Cd1  1  0.0431  0.0269  0.8909  1.0
  Cd  Cd2  1  0.5394  0.5435  0.3913  1.0
  Mo  Mo3  1  0.3208  0.3197  0.0486  1.0
  O  O4  1  0.1220  0.4184  0.7892  1.0
  O  O5  1  0.2001  0.9701  0.2584  1.0
  O  O6  1  0.4284  0.6718  0.7790  1.0
  O  O7  1  0.5482  0.2123  0.2602  1.0
  O  O8  1  0.6713  0.1127  0.7862  1.0
  O  O9  1  0.9689  0.5774  0.2450  1.0
]