data_Sb5P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78
_cell_length_b   6.78
_cell_length_c   6.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   143.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb5P
_chemical_formula_sum   'Sb5 P1'
_cell_volume   165.66
_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
  Sb  Sb1  1  0.13  0.86  0.03  1.0
  Sb  Sb2  1  0.13  0.01  0.0  1.0
  Sb  Sb3  1  0.13  0.14  0.03  1.0
  Sb  Sb4  1  0.13  0.99  0.0  1.0
  Sb  Sb5  1  0.0  0.0  0.03  1.0
  P  P0  1  0.0  0.0  0.0  1.0

data_Sb5P
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   6.05
_cell_length_c   6.78
_cell_angle_alpha   90.0
_cell_angle_beta   108.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb5P
_chemical_formula_sum   'Sb5 P1'
_cell_volume   165.66
_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
  Sb  Sb0  1  0.0  0.97  0.0  1.0
  Sb  Sb1  1  0.01  -0.0  0.88  1.0
  Sb  Sb2  1  0.14  0.97  0.01  1.0
  Sb  Sb3  1  0.86  0.97  0.73  1.0
  Sb  Sb4  1  0.99  0.0  0.86  1.0
  P  P5  1  0.0  0.0  0.0  1.0

Sb Sb Sb Sb Sb P
Sb Sb Sb Sb Sb P 0 1 o + o 0 3 o o o 1 3 o - o 2 5 o o o 2 4 o o o 4 5 o o o 