data_Sm3SiAgS7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.2
_cell_length_b   10.2
_cell_length_c   5.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3SiAgS7
_chemical_formula_sum   'Sm6 Si2 Ag2 S14'
_cell_volume   516.52
_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
  Sm  Sm18  1  0.42  0.18  0.43  1.0
  Sm  Sm19  1  0.64  0.75  0.43  1.0
  Sm  Sm20  1  0.94  0.75  0.43  1.0
  Sm  Sm21  1  0.68  0.66  0.3  1.0
  Sm  Sm22  1  0.16  0.09  0.3  1.0
  Sm  Sm23  1  0.46  0.09  0.3  1.0
  Si  Si16  1  0.1  0.95  0.93  1.0
  Si  Si17  1  0.0  0.89  0.79  1.0
  Ag  Ag0  1  0.0  0.0  0.71  1.0
  Ag  Ag1  1  0.0  0.0  0.57  1.0
  S  S2  1  0.96  0.62  0.07  1.0
  S  S3  1  0.76  0.0  0.07  1.0
  S  S4  1  0.59  0.22  0.07  1.0
  S  S5  1  0.0  0.89  0.17  1.0
  S  S6  1  0.85  0.58  0.52  1.0
  S  S7  1  0.55  0.44  0.52  1.0
  S  S8  1  0.91  0.81  0.52  1.0
  S  S9  1  0.14  0.22  0.93  1.0
  S  S10  1  0.51  0.62  0.93  1.0
  S  S11  1  0.35  0.84  0.93  1.0
  S  S12  1  0.1  0.95  0.04  1.0
  S  S13  1  0.56  0.4  0.39  1.0
  S  S14  1  0.25  0.26  0.39  1.0
  S  S15  1  0.19  0.02  0.39  1.0

data_Sm3SiAgS7
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.73
_cell_length_b   10.2
_cell_length_c   10.2
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3SiAgS7
_chemical_formula_sum   'Sm6 Si2 Ag2 S14'
_cell_volume   516.52
_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
  Sm  Sm0  1  0.3  0.16  0.09  1.0
  Sm  Sm1  1  0.3  0.46  0.09  1.0
  Sm  Sm2  1  0.3  0.68  0.66  1.0
  Sm  Sm3  1  0.43  0.42  0.18  1.0
  Sm  Sm4  1  0.43  0.64  0.75  1.0
  Sm  Sm5  1  0.43  0.94  0.75  1.0
  Si  Si6  1  0.79  0.0  0.89  1.0
  Si  Si7  1  0.93  0.1  0.95  1.0
  Ag  Ag8  1  0.57  0.0  0.0  1.0
  Ag  Ag9  1  0.71  0.0  0.0  1.0
  S  S10  1  0.04  0.1  0.95  1.0
  S  S11  1  0.07  0.59  0.22  1.0
  S  S12  1  0.07  0.76  0.0  1.0
  S  S13  1  0.07  0.96  0.62  1.0
  S  S14  1  0.17  0.0  0.89  1.0
  S  S15  1  0.39  0.19  0.02  1.0
  S  S16  1  0.39  0.25  0.26  1.0
  S  S17  1  0.39  0.56  0.4  1.0
  S  S18  1  0.52  0.55  0.44  1.0
  S  S19  1  0.52  0.85  0.58  1.0
  S  S20  1  0.52  0.91  0.81  1.0
  S  S21  1  0.93  0.14  0.22  1.0
  S  S22  1  0.93  0.35  0.84  1.0
  S  S23  1  0.93  0.51  0.62  1.0

Sm Sm Sm Sm Sm Sm Si Si Ag Ag S S S S S S S S S S S S S S
Sm Sm Sm Sm Sm Sm Si Si Ag Ag S S S S S S S S S S S S S S 0 5 o o o 1 3 o o o 1 11 o + o 1 18 o o o 1 18 o o - 2 16 o o o 2 10 o o o 2 14 o o o 3 11 o + o 3 18 o o - 4 23 o o o 4 11 - o o 4 17 o o - 4 22 o o o 5 11 o o o 5 12 o o o 5 19 o - - 6 20 o o + 6 7 o o o 6 10 - o + 6 11 - + + 6 17 o + o 6 19 o o o 7 8 o + o 7 10 - o + 7 11 - + + 7 17 o + o 7 19 o o o 8 9 o o o 8 11 - o + 8 17 o o o 9 11 - o + 9 11 - o o 9 17 o o o 10 14 o o - 10 14 o o o 10 20 + o o 10 13 + o o 10 19 + o - 11 19 o - - 11 18 o - - 11 12 o o o 11 20 + - o 11 16 o - o 11 13 + - o 11 17 + o - 12 19 o - - 13 20 o o o 15 21 o o o 15 18 o o o 17 20 o - + 17 22 o o + 18 19 o o o 19 20 o o + 