data_[La4Mn2Ru2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Mn  1.5500  1.4000  0.6483
  Ru  2.2000  1.3000  0.6610
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.6515]
_cell_length_b [5.8053]
_cell_length_c [9.7674]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.7510]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La2MnRuO6]
_chemical_formula_sum '[La4 Mn2 Ru2 O12]'
_cell_volume [263.2980]
_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
[
  La  La0  4  0.2671  0.0607  0.2521  1.0
  Mn  Mn1  2  0.0000  0.0000  0.5000  1.0
  Ru  Ru2  2  0.5000  0.0000  0.0000  1.0
  O  O3  4  0.1554  0.0281  0.7577  1.0
  O  O4  4  0.2592  0.6948  0.5519  1.0
  O  O5  4  0.3640  0.2101  0.5557  1.0
]