data_Gd4CoS7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.78
_cell_length_b   9.78
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Gd4CoS7
_chemical_formula_sum   'Gd8 Co2 S14'
_cell_volume   514.14
_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  Gd2  1  0.89  0.82  0.06  1.0
  Gd  Gd3  1  0.6  0.15  0.39  1.0
  Gd  Gd4  1  0.36  0.54  0.39  1.0
  Gd  Gd5  1  0.04  0.24  0.39  1.0
  Gd  Gd6  1  0.0  0.64  0.17  1.0
  Gd  Gd7  1  0.84  0.23  0.49  1.0
  Gd  Gd8  1  0.53  0.93  0.49  1.0
  Gd  Gd9  1  0.29  0.31  0.49  1.0
  Co  Co0  1  0.0  0.0  0.33  1.0
  Co  Co1  1  0.0  0.0  0.44  1.0
  S  S10  1  0.52  0.6  0.06  1.0
  S  S11  1  0.0  0.61  0.06  1.0
  S  S12  1  0.15  0.26  0.06  1.0
  S  S13  1  0.0  0.64  0.54  1.0
  S  S14  1  0.06  0.75  0.96  1.0
  S  S15  1  0.5  0.11  0.96  1.0
  S  S16  1  0.1  0.61  0.96  1.0
  S  S17  1  0.74  0.21  0.95  1.0
  S  S18  1  0.89  0.85  0.95  1.0
  S  S19  1  0.37  0.87  0.95  1.0
  S  S20  1  0.89  0.82  0.64  1.0
  S  S21  1  0.79  0.86  0.06  1.0
  S  S22  1  0.38  0.35  0.06  1.0
  S  S23  1  0.83  0.72  0.06  1.0

data_Gd4CoS7
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.21
_cell_length_b   9.78
_cell_length_c   9.78
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Gd4CoS7
_chemical_formula_sum   'Gd8 Co2 S14'
_cell_volume   514.14
_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  0.06  0.89  0.82  1.0
  Gd  Gd1  1  0.17  -0.0  0.64  1.0
  Gd  Gd2  1  0.39  0.04  0.24  1.0
  Gd  Gd3  1  0.39  0.36  0.54  1.0
  Gd  Gd4  1  0.39  0.6  0.15  1.0
  Gd  Gd5  1  0.49  0.29  0.31  1.0
  Gd  Gd6  1  0.49  0.53  0.93  1.0
  Gd  Gd7  1  0.49  0.84  0.23  1.0
  Co  Co8  1  0.33  0.0  0.0  1.0
  Co  Co9  1  0.44  0.0  0.0  1.0
  S  S10  1  0.06  0.0  0.61  1.0
  S  S11  1  0.06  0.15  0.26  1.0
  S  S12  1  0.06  0.52  0.6  1.0
  S  S13  1  0.06  0.38  0.35  1.0
  S  S14  1  0.06  0.79  0.86  1.0
  S  S15  1  0.06  0.83  0.72  1.0
  S  S16  1  0.54  -0.0  0.64  1.0
  S  S17  1  0.64  0.89  0.82  1.0
  S  S18  1  0.95  0.37  0.87  1.0
  S  S19  1  0.95  0.74  0.21  1.0
  S  S20  1  0.95  0.89  0.85  1.0
  S  S21  1  0.96  0.06  0.75  1.0
  S  S22  1  0.96  0.1  0.61  1.0
  S  S23  1  0.96  0.5  0.11  1.0

Gd Gd Gd Gd Gd Gd Gd Gd Co Co S S S S S S S S S S S S S S
Gd Gd Gd Gd Gd Gd Gd Gd Co Co S S S S S S S S S S S S S S 0 18 o o - 0 21 o o o 0 23 o o o 1 6 o - o 1 5 o o o 2 7 o o o 2 10 o o o 3 5 - o o 3 8 o o o 3 9 o o o 3 12 o o o 3 7 o o o 4 11 o o o 4 13 o o o 4 14 o o - 8 9 o o o 9 20 - - o 10 22 o o o 11 13 o o o 11 14 o o - 11 16 o o - 12 22 o o o 13 20 - o o 13 16 o o o 13 14 o o o 14 16 o o o 15 19 o - o 15 17 o o o 18 20 o o o 18 21 o o + 
Gd4CoS7 crystallizes in the triclinic P1 space group. There are eight inequivalent Gd sites. In the first Gd site, Gd(1) is bonded in a 3-coordinate geometry to one Co(1), one S(12), one S(14), one S(5), and one S(9) atom. The Gd(1)-Co(1) bond length is 2.27 Å. The Gd(1)-S(12) bond length is 1.19 Å. The Gd(1)-S(14) bond length is 0.87 Å. The Gd(1)-S(5) bond length is 2.25 Å. The Gd(1)-S(9) bond length is 0.72 Å. In the second Gd site, Gd(2) is bonded in a 4-coordinate geometry to one Gd(6), one Gd(7), one S(8), and two equivalent S(6) atoms. The Gd(2)-Gd(6) bond length is 2.23 Å. The Gd(2)-Gd(7) bond length is 2.10 Å. The Gd(2)-S(8) bond length is 2.97 Å. There is one shorter (2.80 Å) and one longer (3.62 Å) Gd(2)-S(6) bond length. In the third Gd site, Gd(3) is bonded in a distorted single-bond geometry to one Gd(8), one S(1), and one S(13) atom. The Gd(3)-Gd(8) bond length is 2.10 Å. The Gd(3)-S(1) bond length is 2.47 Å. The Gd(3)-S(13) bond length is 2.83 Å. In the fourth Gd site, Gd(4) is bonded in a 1-coordinate geometry to one Gd(6), one Gd(8), one Co(1), one Co(2), and one S(3) atom. The Gd(4)-Gd(6) bond length is 2.04 Å. The Gd(4)-Gd(8) bond length is 2.23 Å. The Gd(4)-Co(1) bond length is 2.16 Å. The Gd(4)-Co(2) bond length is 2.15 Å. The Gd(4)-S(3) bond length is 2.24 Å. In the fifth Gd site, Gd(5) is bonded in a single-bond geometry to one S(2), one S(4), and one S(5) atom. The Gd(5)-S(2) bond length is 0.72 Å. The Gd(5)-S(4) bond length is 2.30 Å. The Gd(5)-S(5) bond length is 1.56 Å. In the sixth Gd site, Gd(6) is bonded in a 4-coordinate geometry to one Gd(2), one Gd(4), one S(4), and two equivalent S(8) atoms. The Gd(6)-S(4) bond length is 3.56 Å. There is one shorter (2.99 Å) and one longer (3.48 Å) Gd(6)-S(8) bond length. In the seventh Gd site, Gd(7) is bonded in a 2-coordinate geometry to one Gd(2), one S(6), and two equivalent S(10) atoms. The Gd(7)-S(6) bond length is 3.48 Å. There is one shorter (3.17 Å) and one longer (3.63 Å) Gd(7)-S(10) bond length. In the eighth Gd site, Gd(8) is bonded in a 7-coordinate geometry to one Gd(3), one Gd(4), one Co(2), two equivalent S(13), and two equivalent S(3) atoms. The Gd(8)-Co(2) bond length is 2.97 Å. There is one shorter (2.80 Å) and one longer (3.62 Å) Gd(8)-S(13) bond length. There is one shorter (2.97 Å) and one longer (3.72 Å) Gd(8)-S(3) bond length. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 5-coordinate geometry to one Gd(1), one Gd(4), one Co(2), one S(12), and one S(3) atom. The Co(1)-Co(2) bond length is 0.66 Å. The Co(1)-S(12) bond length is 2.46 Å. The Co(1)-S(3) bond length is 2.75 Å. In the second Co site, Co(2) is bonded in a 3-coordinate geometry to one Gd(4), one Gd(8), one Co(1), and one S(11) atom. The Co(2)-S(11) bond length is 1.99 Å. There are fourteen inequivalent S sites. In the first S site, S(1) is bonded in a distorted single-bond geometry to one Gd(3) and one S(13) atom. The S(1)-S(13) bond length is 2.05 Å. In the second S site, S(2) is bonded in a single-bond geometry to one Gd(5), one S(5), and one S(7) atom. The S(2)-S(5) bond length is 1.29 Å. The S(2)-S(7) bond length is 1.18 Å. In the third S site, S(3) is bonded in a distorted single-bond geometry to one Gd(4), two equivalent Gd(8), one Co(1), and one S(13) atom. The S(3)-S(13) bond length is 2.03 Å. In the fourth S site, S(4) is bonded in a distorted single-bond geometry to one Gd(5) and one Gd(6) atom. In the fifth S site, S(5) is bonded in a 4-coordinate geometry to one Gd(1), one Gd(5), one S(10), one S(2), and one S(7) atom. The S(5)-S(10) bond length is 2.63 Å. The S(5)-S(7) bond length is 1.58 Å. In the sixth S site, S(6) is bonded in a 5-coordinate geometry to one Gd(7), two equivalent Gd(2), one S(10), and one S(8) atom. The S(6)-S(10) bond length is 2.05 Å. The S(6)-S(8) bond length is 2.03 Å. In the seventh S site, S(7) is bonded in a 2-coordinate geometry to one S(10), one S(2), and one S(5) atom. The S(7)-S(10) bond length is 2.61 Å. In the eighth S site, S(8) is bonded in a 4-coordinate geometry to one Gd(2), two equivalent Gd(6), and one S(6) atom. In the ninth S site, S(9) is bonded in a single-bond geometry to one Gd(1) atom. In the tenth S site, S(10) is bonded in a 5-coordinate geometry to two equivalent Gd(7), one S(5), one S(6), and one S(7) atom. In the eleventh S site, S(11) is bonded in a distorted single-bond geometry to one Co(2) atom. In the twelfth S site, S(12) is bonded in a single-bond geometry to one Gd(1) and one Co(1) atom. In the thirteenth S site, S(13) is bonded in a 5-coordinate geometry to one Gd(3), two equivalent Gd(8), one S(1), and one S(3) atom. In the fourteenth S site, S(14) is bonded in a single-bond geometry to one Gd(1) atom.