data_[Ac6In8Ni4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  In  1.7800  1.5500  0.9400
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7455]
_cell_length_b [4.7196]
_cell_length_c [8.8371]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.6896]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac3(In2Ni)2]
_chemical_formula_sum '[Ac6 In8 Ni4]'
_cell_volume [489.6585]
_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
[
  Ac  Ac0  4  0.1095  0.5000  0.6970  1
  Ac  Ac1  2  0.0000  0.0000  0.0000  1
  In  In2  4  0.1073  0.0000  0.3850  1
  In  In3  4  0.2051  0.5000  0.1102  1
  Ni  Ni4  4  0.2208  0.5000  0.4138  1
]