data_[Mn2Fe1Sb1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Fe  1.8300  1.4000  0.8525
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2330]
_cell_length_b [5.2815]
_cell_length_c [5.6571]
_cell_angle_alpha [116.8635]
_cell_angle_beta [90.6969]
_cell_angle_gamma [118.0065]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Mn2FeSbO6]
_chemical_formula_sum '[Mn2 Fe1 Sb1 O6]'
_cell_volume [118.0431]
_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
[
  Mn  Mn0  1  0.0157  0.0282  0.0398  1.0
  Mn  Mn1  1  0.5295  0.0573  0.5847  1.0
  Fe  Fe2  1  0.8071  0.6089  0.4218  1.0
  Sb  Sb3  1  0.3257  0.6400  0.9642  1.0
  O  O4  1  0.1160  0.8374  0.2298  1.0
  O  O5  1  0.1999  0.8127  0.7589  1.0
  O  O6  1  0.4167  0.5340  0.2422  1.0
  O  O7  1  0.5839  0.5286  0.7417  1.0
  O  O8  1  0.7152  0.1058  0.2225  1.0
  O  O9  1  0.9519  0.1704  0.7791  1.0
]