data_[Zr24Mn32Si48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Mn  1.5500  1.4000  0.6483
  Si  1.9000  1.1000  0.5400
]
_symmetry_space_group_name_H-M [P4_2/mbc]
_cell_length_a [17.1253]
_cell_length_b [17.1253]
_cell_length_c [5.0922]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [135]
_chemical_formula_structural [Zr3(Mn2Si3)2]
_chemical_formula_sum '[Zr24 Mn32 Si48]'
_cell_volume [1493.4352]
_cell_formula_units_Z [8]
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
[
  Zr  Zr0  8  0.0260  0.7098  0.0000  1
  Zr  Zr1  8  0.1017  0.7958  0.5000  1
  Zr  Zr2  8  0.2011  0.2176  0.5000  1
  Mn  Mn3  16  0.0520  0.1538  0.2508  1
  Mn  Mn4  8  0.0438  0.6149  0.5000  1
  Mn  Mn5  8  0.1262  0.3738  0.2500  1
  Si  Si6  8  0.0236  0.4350  0.0000  1
  Si  Si7  8  0.0309  0.9379  0.5000  1
  Si  Si8  8  0.0480  0.2754  0.5000  1
  Si  Si9  8  0.0681  0.8638  0.0000  1
  Si  Si10  8  0.1299  0.2479  0.0000  1
  Si  Si11  8  0.1617  0.6617  0.2500  1
]