data_[Y2Sb4P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8583]
_cell_length_b [4.1061]
_cell_length_c [4.2707]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.6535]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YSb2P]
_chemical_formula_sum '[Y2 Sb4 P2]'
_cell_volume [207.2619]
_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
[
  Y  Y0  2  0.0000  0.5000  0.5000  1
  Sb  Sb1  4  0.2266  0.0000  0.2615  1
  P  P2  2  0.0000  0.0000  0.0000  1
]