data_[Mn4H8Cl8O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.9864]
_cell_length_b [3.6783]
_cell_length_c [11.4777]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [MnH2Cl2O]
_chemical_formula_sum '[Mn4 H8 Cl8 O4]'
_cell_volume [379.3912]
_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  4  0.1834  0.2500  0.0178  1
  H  H1  4  0.0517  0.7500  0.6481  1
  H  H2  4  0.1883  0.7500  0.7384  1
  Cl  Cl3  4  0.0356  0.7500  0.1270  1
  Cl  Cl4  4  0.1866  0.2500  0.4050  1
  O  O5  4  0.1608  0.7500  0.6553  1
]