data_[Mn1Fe2Sb1O6]
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 [5.2841]
_cell_length_b [5.2951]
_cell_length_c [5.6988]
_cell_angle_alpha [91.1399]
_cell_angle_beta [116.6336]
_cell_angle_gamma [119.7370]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [MnFe2SbO6]
_chemical_formula_sum '[Mn1 Fe2 Sb1 O6]'
_cell_volume [117.5806]
_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  0.6124  0.8118  0.4174  1.0
  Fe  Fe1  1  0.0298  0.0153  0.0449  1.0
  Fe  Fe2  1  0.0508  0.5238  0.5801  1.0
  Sb  Sb3  1  0.6399  0.3202  0.9607  1.0
  O  O4  1  0.1048  0.3921  0.2373  1.0
  O  O5  1  0.1614  0.2138  0.7632  1.0
  O  O6  1  0.5080  0.1219  0.2274  1.0
  O  O7  1  0.5531  0.9427  0.7629  1.0
  O  O8  1  0.8216  0.5984  0.7614  1.0
  O  O9  1  0.8413  0.7215  0.2296  1.0
]