data_[Zr3Fe2As4Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Fe  1.8300  1.4000  0.8525
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [6.5776]
_cell_length_b [3.8940]
_cell_length_c [7.5110]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.3876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Zr3Fe2(As2Pd)2]
_chemical_formula_sum '[Zr3 Fe2 As4 Pd2]'
_cell_volume [192.3752]
_cell_formula_units_Z [1]
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  1  0.0246  0.5000  0.1765  1
  Zr  Zr1  1  0.4671  0.0000  0.6906  1
  Zr  Zr2  1  0.5367  0.5000  0.3193  1
  Fe  Fe3  1  0.3748  0.0000  0.0535  1
  Fe  Fe4  1  0.6118  0.5000  0.9567  1
  As  As5  1  0.2461  0.0000  0.3590  1
  As  As6  1  0.2510  0.5000  0.8858  1
  As  As7  1  0.7459  0.0000  0.0881  1
  As  As8  1  0.7610  0.5000  0.6604  1
  Pd  Pd9  1  0.1428  0.5000  0.5659  1
  Pd  Pd10  1  0.8403  0.0000  0.4416  1
]