data_Sr2PPb4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.88
_cell_length_b   10.67
_cell_length_c   4.44
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2PPb4
_chemical_formula_sum   'Sr4 P2 Pb8'
_cell_volume   468.04
_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
  Sr  Sr10  1  0.39  0.53  0.22  1.0
  Sr  Sr11  1  0.5  0.14  0.22  1.0
  Sr  Sr12  1  0.45  0.48  0.22  1.0
  Sr  Sr13  1  0.44  0.19  0.22  1.0
  P  P0  1  0.0  0.0  0.0  1.0
  P  P1  1  0.94  0.34  0.0  1.0
  Pb  Pb2  1  0.61  0.47  0.0  1.0
  Pb  Pb3  1  0.27  0.2  0.0  1.0
  Pb  Pb4  1  0.67  0.86  0.0  1.0
  Pb  Pb5  1  0.22  0.81  0.0  1.0
  Pb  Pb6  1  0.83  0.31  0.22  1.0
  Pb  Pb7  1  0.05  0.36  0.22  1.0
  Pb  Pb8  1  0.89  0.69  0.22  1.0
  Pb  Pb9  1  0.99  0.98  0.22  1.0

data_Sr2PPb4
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.44
_cell_length_b   9.88
_cell_length_c   10.67
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2PPb4
_chemical_formula_sum   'Sr4 P2 Pb8'
_cell_volume   468.04
_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
  Sr  Sr0  1  0.22  0.39  0.53  1.0
  Sr  Sr1  1  0.22  0.44  0.19  1.0
  Sr  Sr2  1  0.22  0.45  0.48  1.0
  Sr  Sr3  1  0.22  0.5  0.14  1.0
  P  P4  1  -0.0  0.94  0.34  1.0
  P  P5  1  0.0  0.0  0.0  1.0
  Pb  Pb6  1  -0.0  0.61  0.47  1.0
  Pb  Pb7  1  -0.0  0.67  0.86  1.0
  Pb  Pb8  1  -0.0  0.22  0.81  1.0
  Pb  Pb9  1  -0.0  0.27  0.2  1.0
  Pb  Pb10  1  0.22  0.05  0.36  1.0
  Pb  Pb11  1  0.22  0.83  0.31  1.0
  Pb  Pb12  1  0.22  0.89  0.69  1.0
  Pb  Pb13  1  0.22  0.99  0.98  1.0

Sr Sr Sr Sr P P Pb Pb Pb Pb Pb Pb Pb Pb
Sr Sr Sr Sr P P Pb Pb Pb Pb Pb Pb Pb Pb 0 2 o o o 0 9 o o o 1 3 o o o 1 8 o - o 2 6 o o o 3 7 o o o 4 13 - - o 4 8 - - o 4 9 o - o 4 12 - - o 5 10 o o o 5 11 + o o 6 12 o o o 8 12 o o o 8 13 o o o 9 12 - o o 9 13 - o o 11 12 - o o 12 13 o o o 