data_[Sm1Mn1Bi2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Mn  1.5500  1.4000  0.6483
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6485]
_cell_length_b [5.9304]
_cell_length_c [6.1313]
_cell_angle_alpha [61.8086]
_cell_angle_beta [62.7952]
_cell_angle_gamma [89.9575]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [SmMn(BiO3)2]
_chemical_formula_sum '[Sm1 Mn1 Bi2 O6]'
_cell_volume [154.8092]
_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  0.2907  0.9164  0.4026  1
  Mn  Mn1  1  0.8329  0.4609  0.3466  1
  Bi  Bi2  1  0.5213  0.5666  0.9706  1
  Bi  Bi3  1  0.9973  0.0828  0.9577  1
  O  O4  1  0.0752  0.2473  0.2356  1
  O  O5  1  0.1588  0.6907  0.2486  1
  O  O6  1  0.5120  0.2853  0.3778  1
  O  O7  1  0.6585  0.7460  0.3843  1
  O  O8  1  0.6589  0.2306  0.8873  1
  O  O9  1  0.9559  0.7583  0.8657  1
]