data_[Zr1As3Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  As  2.1800  1.1500  0.6600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.6774]
_cell_length_b [3.8169]
_cell_length_c [6.1332]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8392]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [ZrAs3Rh4]
_chemical_formula_sum '[Zr1 As3 Rh4]'
_cell_volume [132.8938]
_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  0.3244  0.0000  0.4039  1
  As  As1  1  0.1919  0.5000  0.9064  1
  As  As2  1  0.6813  0.5000  0.5902  1
  As  As3  1  0.8163  0.0000  0.0950  1
  Rh  Rh4  1  0.4894  0.0000  0.8078  1
  Rh  Rh5  1  0.5142  0.5000  0.1788  1
  Rh  Rh6  1  0.9853  0.0000  0.7052  1
  Rh  Rh7  1  0.9971  0.5000  0.3127  1
]