data_ScSbP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.61
_cell_length_b   3.99
_cell_length_c   5.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScSbP2
_chemical_formula_sum   'Sc1 Sb1 P2'
_cell_volume   79.36
_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
  Sc  Sc3  1  0.8  0.0  0.76  1.0
  Sb  Sb2  1  0.8  0.99  0.0  1.0
  P  P0  1  0.0  0.0  0.0  1.0
  P  P1  1  0.0  0.99  0.76  1.0

data_ScSbP2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.61
_cell_length_b   3.99
_cell_length_c   5.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   ScSbP2
_chemical_formula_sum   'Sc1 Sb1 P2'
_cell_volume   79.36
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Sc  Sc0  1  0.8  0.0  0.76  1.0
  Sb  Sb1  1  0.8  0.0  -0.0  1.0
  P  P2  1  -0.0  0.0  0.76  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Sc Sb P P
Sc Sb P P 0 3 + - o 1 2 + + o 