data_[Ce6Y2Zr4As12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Y  1.2200  1.8000  1.0400
  Zr  1.3300  1.5500  0.8600
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0412]
_cell_length_b [12.1999]
_cell_length_c [7.0533]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4744]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3Y(ZrAs3)2]
_chemical_formula_sum '[Ce6 Y2 Zr4 As12]'
_cell_volume [571.2290]
_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
[
  Ce  Ce0  4  0.0000  0.1639  0.5000  1.0
  Ce  Ce1  2  0.0000  0.5000  0.5000  1.0
  Y  Y2  2  0.0000  0.0000  0.0000  1.0
  Zr  Zr3  4  0.0000  0.3325  0.0000  1.0
  As  As4  8  0.2494  0.8296  0.2365  1.0
  As  As5  4  0.2365  0.5000  0.2332  1.0
]