data_[Sb2P2C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.9777]
_cell_length_b [3.8053]
_cell_length_c [8.4155]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9346]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [SbPC]
_chemical_formula_sum '[Sb2 P2 C2]'
_cell_volume [126.1607]
_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
[
  Sb  Sb0  1  0.3955  0.5000  0.2626  1
  Sb  Sb1  1  0.8610  0.0000  0.1094  1
  P  P2  1  0.2065  0.0000  0.7843  1
  P  P3  1  0.5927  0.0000  0.6004  1
  C  C4  2  0.9001  0.3215  0.6911  1
]