data_Si7P9Pt5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.62
_cell_length_b   10.62
_cell_length_c   3.65
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si7P9Pt5
_chemical_formula_sum   'Si7 P9 Pt5'
_cell_volume   356.44
_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
  Si  Si14  1  0.0  0.0  0.0  1.0
  Si  Si15  1  0.08  0.54  0.0  1.0
  Si  Si16  1  0.47  0.77  0.0  1.0
  Si  Si17  1  0.45  0.09  0.0  1.0
  Si  Si18  1  0.05  0.86  0.82  1.0
  Si  Si19  1  0.98  0.58  0.82  1.0
  Si  Si20  1  0.9  0.76  0.82  1.0
  P  P0  1  0.77  0.32  0.0  1.0
  P  P1  1  0.59  0.88  0.0  1.0
  P  P2  1  0.56  0.0  0.0  1.0
  P  P3  1  0.14  0.84  0.0  1.0
  P  P4  1  0.45  0.67  0.0  1.0
  P  P5  1  0.41  0.89  0.0  1.0
  P  P6  1  0.71  0.84  0.82  1.0
  P  P7  1  0.93  0.43  0.82  1.0
  P  P8  1  0.28  0.93  0.82  1.0
  Pt  Pt9  1  0.3  0.14  0.82  1.0
  Pt  Pt10  1  0.74  0.29  0.82  1.0
  Pt  Pt11  1  0.95  0.96  0.82  1.0
  Pt  Pt12  1  0.0  0.13  0.82  1.0
  Pt  Pt13  1  0.31  0.07  0.0  1.0

data_Si7P9Pt5
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   10.62
_cell_length_c   10.62
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si7P9Pt5
_chemical_formula_sum   'Si7 P9 Pt5'
_cell_volume   356.44
_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
  Si  Si0  1  0.0  0.0  0.0  1.0
  Si  Si1  1  0.0  0.08  0.54  1.0
  Si  Si2  1  0.0  0.45  0.09  1.0
  Si  Si3  1  0.0  0.47  0.77  1.0
  Si  Si4  1  0.82  0.05  0.86  1.0
  Si  Si5  1  0.82  0.9  0.76  1.0
  Si  Si6  1  0.82  0.98  0.58  1.0
  P  P7  1  0.0  0.56  0.0  1.0
  P  P8  1  0.0  0.59  0.88  1.0
  P  P9  1  0.0  0.14  0.84  1.0
  P  P10  1  0.0  0.77  0.32  1.0
  P  P11  1  0.0  0.45  0.67  1.0
  P  P12  1  0.0  0.41  0.89  1.0
  P  P13  1  0.82  0.28  0.93  1.0
  P  P14  1  0.82  0.71  0.84  1.0
  P  P15  1  0.82  0.93  0.43  1.0
  Pt  Pt16  1  0.0  0.31  0.07  1.0
  Pt  Pt17  1  0.82  -0.0  0.13  1.0
  Pt  Pt18  1  0.82  0.3  0.14  1.0
  Pt  Pt19  1  0.82  0.74  0.29  1.0
  Pt  Pt20  1  0.82  0.95  0.96  1.0

Si Si Si Si Si Si Si P P P P P P P P P Pt Pt Pt Pt Pt
Si Si Si Si Si Si Si P P P P P P P P P Pt Pt Pt Pt Pt 0 18 - - - 0 19 o o - 1 14 - o - 1 5 - o - 2 11 o o o 2 8 o o o 2 12 o o o 3 20 o o o 4 6 - o o 4 10 o o + 5 14 o o o 7 17 o o - 7 14 o o - 8 9 o + o 8 13 o o - 9 12 o - o 10 15 o o - 12 15 o o - 14 17 o o o 15 20 o + + 16 20 o o + 18 19 + + o 