data_[Mn2Ni2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ni  1.9100  1.3500  0.7400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4569]
_cell_length_b [6.5194]
_cell_length_c [9.2160]
_cell_angle_alpha [110.0627]
_cell_angle_beta [108.1751]
_cell_angle_gamma [93.3711]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [MnNiCl5]
_chemical_formula_sum '[Mn2 Ni2 Cl10]'
_cell_volume [340.1976]
_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
[
  Mn  Mn0  1  0.0000  0.5000  0.0000  1
  Mn  Mn1  1  0.5000  0.0000  0.5000  1
  Ni  Ni2  2  0.3986  0.6312  0.7447  1
  Cl  Cl3  2  0.0970  0.6364  0.8196  1
  Cl  Cl4  2  0.2018  0.8261  0.2177  1
  Cl  Cl5  2  0.2779  0.8624  0.6163  1
  Cl  Cl6  2  0.3063  0.3221  0.0352  1
  Cl  Cl7  2  0.3264  0.3032  0.5309  1
]