data_[Mn20As16H40O80]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  As  2.1800  1.1500  0.6600
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [18.3308]
_cell_length_b [9.4261]
_cell_length_c [9.9721]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.3335]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Mn5As4(HO2)10]
_chemical_formula_sum '[Mn20 As16 H40 O80]'
_cell_volume [1712.5378]
_cell_formula_units_Z [4]
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  8  0.1739  0.0299  0.3618  1
  Mn  Mn1  8  0.1853  0.4144  0.3137  1
  Mn  Mn2  4  0.0000  0.1016  0.7500  1
  As  As3  8  0.0840  0.1843  0.0853  1
  As  As4  8  0.1594  0.2619  0.6250  1
  H  H5  8  0.0200  0.2941  0.5204  1
  H  H6  8  0.0383  0.4461  0.3543  1
  H  H7  8  0.0657  0.4167  0.7709  1
  H  H8  8  0.2081  0.3719  0.0251  1
  H  H9  8  0.2320  0.1487  0.0805  1
  O  O10  8  0.0115  0.3076  0.0713  1
  O  O11  8  0.0680  0.2730  0.6573  1
  O  O12  8  0.0758  0.0668  0.2127  1
  O  O13  8  0.0804  0.4942  0.8362  1
  O  O14  8  0.0836  0.1021  0.9317  1
  O  O15  8  0.1639  0.2383  0.4534  1
  O  O16  8  0.1644  0.2744  0.1316  1
  O  O17  8  0.2014  0.1205  0.7105  1
  O  O18  8  0.2069  0.4120  0.6777  1
  O  O19  8  0.2439  0.4236  0.9727  1
]