data_[P4Rh2Se2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.9145]
_cell_length_b [3.4249]
_cell_length_c [6.1990]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0105]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [P2RhSe]
_chemical_formula_sum '[P4 Rh2 Se2]'
_cell_volume [144.5646]
_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
[
  P  P0  2  0.2908  0.5000  0.3000  1
  P  P1  2  0.4287  0.5000  0.0087  1
  Rh  Rh2  2  0.4963  0.0000  0.4464  1
  Se  Se3  2  0.2842  0.0000  0.7449  1
]