data_Gd10S19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.72
_cell_length_b   8.72
_cell_length_c   15.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Gd10S19
_chemical_formula_sum   'Gd20 S38'
_cell_volume   1209.11
_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
  Gd  Gd0  1  0.45  0.66  0.56  1.0
  Gd  Gd1  1  0.27  0.07  0.56  1.0
  Gd  Gd2  1  0.0  0.36  0.75  1.0
  Gd  Gd3  1  0.82  0.87  0.85  1.0
  Gd  Gd4  1  0.9  0.86  0.85  1.0
  Gd  Gd5  1  0.87  0.9  0.04  1.0
  Gd  Gd6  1  0.86  0.82  0.04  1.0
  Gd  Gd7  1  0.36  0.0  0.14  1.0
  Gd  Gd8  1  0.07  0.45  0.32  1.0
  Gd  Gd9  1  0.66  0.27  0.32  1.0
  Gd  Gd10  1  0.7  0.81  0.62  1.0
  Gd  Gd11  1  0.02  0.91  0.62  1.0
  Gd  Gd12  1  0.0  0.36  0.8  1.0
  Gd  Gd13  1  0.51  0.54  0.9  1.0
  Gd  Gd14  1  0.22  0.18  0.9  1.0
  Gd  Gd15  1  0.18  0.51  0.98  1.0
  Gd  Gd16  1  0.54  0.22  0.98  1.0
  Gd  Gd17  1  0.36  0.0  0.08  1.0
  Gd  Gd18  1  0.81  0.02  0.27  1.0
  Gd  Gd19  1  0.91  0.7  0.27  1.0
  S  S20  1  0.08  0.48  0.9  1.0
  S  S21  1  0.65  0.25  0.9  1.0
  S  S22  1  0.36  0.0  0.94  1.0
  S  S23  1  0.87  0.97  0.07  1.0
  S  S24  1  0.85  0.75  0.07  1.0
  S  S25  1  0.92  0.86  0.88  1.0
  S  S26  1  0.8  0.87  0.88  1.0
  S  S27  1  0.53  0.81  0.0  1.0
  S  S28  1  0.19  0.91  0.0  1.0
  S  S29  1  0.0  0.0  0.0  1.0
  S  S30  1  0.91  0.53  0.88  1.0
  S  S31  1  0.81  0.19  0.88  1.0
  S  S32  1  0.86  0.8  0.01  1.0
  S  S33  1  0.87  0.92  0.01  1.0
  S  S34  1  0.75  0.87  0.82  1.0
  S  S35  1  0.97  0.85  0.82  1.0
  S  S36  1  0.0  0.36  0.94  1.0
  S  S37  1  0.48  0.65  0.99  1.0
  S  S38  1  0.25  0.08  0.99  1.0
  S  S39  1  0.84  0.01  0.96  1.0
  S  S40  1  0.88  0.72  0.96  1.0
  S  S41  1  0.36  0.0  0.0  1.0
  S  S42  1  0.12  0.51  0.12  1.0
  S  S43  1  0.61  0.22  0.12  1.0
  S  S44  1  0.22  0.44  0.93  1.0
  S  S45  1  0.5  0.28  0.93  1.0
  S  S46  1  0.55  0.17  0.95  1.0
  S  S47  1  0.18  0.55  0.95  1.0
  S  S48  1  0.36  0.36  0.94  1.0
  S  S49  1  0.17  0.18  0.94  1.0
  S  S50  1  0.55  0.55  0.94  1.0
  S  S51  1  0.28  0.22  0.95  1.0
  S  S52  1  0.44  0.5  0.95  1.0
  S  S53  1  0.51  0.61  0.76  1.0
  S  S54  1  0.22  0.12  0.76  1.0
  S  S55  1  0.0  0.36  0.89  1.0
  S  S56  1  0.72  0.84  0.93  1.0
  S  S57  1  0.01  0.88  0.93  1.0

data_Gd10S19
_symmetry_space_group_name_H-M   P1
_cell_length_a   8.72
_cell_length_b   8.72
_cell_length_c   15.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Gd10S19
_chemical_formula_sum   'Gd20 S38'
_cell_volume   1209.11
_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
  Gd  Gd0  1  0.0  0.36  0.75  1.0
  Gd  Gd1  1  0.0  0.36  0.8  1.0
  Gd  Gd2  1  0.02  0.91  0.62  1.0
  Gd  Gd3  1  0.07  0.45  0.32  1.0
  Gd  Gd4  1  0.18  0.51  0.98  1.0
  Gd  Gd5  1  0.22  0.18  0.9  1.0
  Gd  Gd6  1  0.27  0.07  0.56  1.0
  Gd  Gd7  1  0.36  0.0  0.08  1.0
  Gd  Gd8  1  0.36  0.0  0.14  1.0
  Gd  Gd9  1  0.45  0.66  0.56  1.0
  Gd  Gd10  1  0.51  0.54  0.9  1.0
  Gd  Gd11  1  0.54  0.22  0.98  1.0
  Gd  Gd12  1  0.66  0.27  0.32  1.0
  Gd  Gd13  1  0.7  0.81  0.62  1.0
  Gd  Gd14  1  0.81  0.02  0.27  1.0
  Gd  Gd15  1  0.82  0.87  0.85  1.0
  Gd  Gd16  1  0.86  0.82  0.04  1.0
  Gd  Gd17  1  0.87  0.9  0.04  1.0
  Gd  Gd18  1  0.9  0.86  0.85  1.0
  Gd  Gd19  1  0.91  0.7  0.27  1.0
  S  S20  1  0.0  0.0  0.0  1.0
  S  S21  1  0.0  0.36  0.89  1.0
  S  S22  1  0.0  0.36  0.94  1.0
  S  S23  1  0.01  0.88  0.93  1.0
  S  S24  1  0.08  0.48  0.9  1.0
  S  S25  1  0.12  0.51  0.12  1.0
  S  S26  1  0.17  0.18  0.94  1.0
  S  S27  1  0.18  0.55  0.95  1.0
  S  S28  1  0.19  0.91  0.0  1.0
  S  S29  1  0.22  0.12  0.76  1.0
  S  S30  1  0.22  0.44  0.93  1.0
  S  S31  1  0.25  0.08  0.99  1.0
  S  S32  1  0.28  0.22  0.95  1.0
  S  S33  1  0.36  0.0  0.0  1.0
  S  S34  1  0.36  0.0  0.94  1.0
  S  S35  1  0.36  0.36  0.94  1.0
  S  S36  1  0.44  0.5  0.95  1.0
  S  S37  1  0.48  0.65  0.99  1.0
  S  S38  1  0.5  0.28  0.93  1.0
  S  S39  1  0.51  0.61  0.76  1.0
  S  S40  1  0.53  0.81  0.0  1.0
  S  S41  1  0.55  0.17  0.95  1.0
  S  S42  1  0.55  0.55  0.94  1.0
  S  S43  1  0.61  0.22  0.12  1.0
  S  S44  1  0.65  0.25  0.9  1.0
  S  S45  1  0.72  0.84  0.93  1.0
  S  S46  1  0.75  0.87  0.82  1.0
  S  S47  1  0.8  0.87  0.88  1.0
  S  S48  1  0.81  0.19  0.88  1.0
  S  S49  1  0.84  0.01  0.96  1.0
  S  S50  1  0.85  0.75  0.07  1.0
  S  S51  1  0.86  0.8  0.01  1.0
  S  S52  1  0.87  0.92  0.01  1.0
  S  S53  1  0.87  0.97  0.07  1.0
  S  S54  1  0.88  0.72  0.96  1.0
  S  S55  1  0.91  0.53  0.88  1.0
  S  S56  1  0.92  0.86  0.88  1.0
  S  S57  1  0.97  0.85  0.82  1.0

Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S
Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd Gd S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S 0 53 o o o 0 10 o o o 1 11 o - o 1 54 o o o 2 12 o o o 2 54 o o o 3 26 o o o 3 34 o o o 4 25 o o o 4 35 o o o 5 33 o o o 5 23 o o o 5 29 + + o 6 32 o o o 6 24 o o o 7 17 o o o 7 43 o o o 8 19 - o o 8 42 o o o 9 43 o o o 9 18 o o o 10 53 o o o 10 11 + o o 10 34 o o o 11 35 - o o 11 54 o + o 12 54 o o o 13 50 o o o 13 52 o o o 13 53 o o o 14 49 o o o 14 51 o o o 14 54 o o o 15 47 o o o 15 42 o o + 15 44 o o o 16 46 o o o 16 43 o o + 16 45 o o o 17 43 o o o 18 43 o o o 18 23 o - o 18 19 o - o 19 24 o o o 19 42 + o o 20 55 o o o 20 36 o o o 20 44 o o o 20 47 o o o 20 30 - o o 21 46 o o o 21 45 o o o 21 31 o o o 22 41 o o + 22 28 o - + 22 38 o o o 23 29 + + o 25 57 + o o 26 56 o o o 27 37 o o - 28 57 o o - 28 29 o + o 28 41 o + o 28 38 o + - 29 33 - - o 29 39 - o - 29 57 o - - 30 55 + o o 30 36 + o o 32 40 o o - 33 39 o + - 36 55 o o o 37 52 o o o 37 50 o o o 38 49 o o o 38 41 o o + 38 51 o o o 43 46 o o - 44 47 o o o 44 48 o o o 45 46 o o o 45 48 o o o 48 51 o o o 48 52 o o o 49 51 o o o 49 54 o o o 50 52 o o o 