data_Te3Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.44
_cell_length_b   11.11
_cell_length_c   7.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te3Pt
_chemical_formula_sum   'Te18 Pt6'
_cell_volume   669.34
_cell_formula_units_Z   6
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
  Te  Te6  1  0.99  0.94  0.18  1.0
  Te  Te7  1  0.99  0.17  0.18  1.0
  Te  Te8  1  1.0  0.55  0.33  1.0
  Te  Te9  1  0.66  0.0  0.81  1.0
  Te  Te10  1  0.67  0.49  0.96  1.0
  Te  Te11  1  0.67  0.61  0.96  1.0
  Te  Te12  1  0.0  0.0  0.73  1.0
  Te  Te13  1  0.0  0.63  0.71  1.0
  Te  Te14  1  0.0  0.48  0.71  1.0
  Te  Te15  1  0.45  0.94  0.18  1.0
  Te  Te16  1  0.45  0.17  0.18  1.0
  Te  Te17  1  0.44  0.55  0.33  1.0
  Te  Te18  1  0.78  0.0  0.81  1.0
  Te  Te19  1  0.77  0.49  0.96  1.0
  Te  Te20  1  0.77  0.61  0.96  1.0
  Te  Te21  1  0.22  0.55  0.41  1.0
  Te  Te22  1  0.22  0.07  0.43  1.0
  Te  Te23  1  0.22  0.03  0.43  1.0
  Pt  Pt0  1  0.0  0.55  0.43  1.0
  Pt  Pt1  1  0.0  0.86  0.8  1.0
  Pt  Pt2  1  0.0  0.25  0.8  1.0
  Pt  Pt3  1  0.22  0.0  0.71  1.0
  Pt  Pt4  1  0.22  0.42  0.34  1.0
  Pt  Pt5  1  0.22  0.69  0.34  1.0

data_Te3Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.14
_cell_length_b   8.44
_cell_length_c   11.11
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te3Pt
_chemical_formula_sum   'Te18 Pt6'
_cell_volume   669.34
_cell_formula_units_Z   6
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
  Te  Te0  1  0.18  0.45  0.17  1.0
  Te  Te1  1  0.18  0.45  0.94  1.0
  Te  Te2  1  0.18  0.99  0.17  1.0
  Te  Te3  1  0.18  0.99  0.94  1.0
  Te  Te4  1  0.33  0.44  0.55  1.0
  Te  Te5  1  0.33  1.0  0.55  1.0
  Te  Te6  1  0.41  0.22  0.55  1.0
  Te  Te7  1  0.43  0.22  0.03  1.0
  Te  Te8  1  0.43  0.22  0.07  1.0
  Te  Te9  1  0.71  0.0  0.48  1.0
  Te  Te10  1  0.71  0.0  0.63  1.0
  Te  Te11  1  0.73  0.0  0.0  1.0
  Te  Te12  1  0.81  0.66  0.0  1.0
  Te  Te13  1  0.81  0.78  0.0  1.0
  Te  Te14  1  0.96  0.67  0.49  1.0
  Te  Te15  1  0.96  0.67  0.61  1.0
  Te  Te16  1  0.96  0.77  0.49  1.0
  Te  Te17  1  0.96  0.77  0.61  1.0
  Pt  Pt18  1  0.34  0.22  0.42  1.0
  Pt  Pt19  1  0.34  0.22  0.69  1.0
  Pt  Pt20  1  0.43  0.0  0.55  1.0
  Pt  Pt21  1  0.71  0.22  0.0  1.0
  Pt  Pt22  1  0.8  0.0  0.25  1.0
  Pt  Pt23  1  0.8  0.0  0.86  1.0

Te Te Te Te Te Te Te Te Te Te Te Te Te Te Te Te Te Te Pt Pt Pt Pt Pt Pt
PtTe3 crystallizes in the triclinic P1 space group. There are six inequivalent Pt sites. In the first Pt site, Pt(1) is bonded in a 1-coordinate geometry to one Te(16), one Te(3), one Te(8), and one Te(9) atom. The Pt(1)-Te(16) bond length is 1.85 Å. The Pt(1)-Te(3) bond length is 0.71 Å. The Pt(1)-Te(8) bond length is 2.18 Å. The Pt(1)-Te(9) bond length is 2.18 Å. In the second Pt site, Pt(2) is bonded in a distorted single-bond geometry to one Te(1), one Te(13), one Te(7), and one Te(8) atom. The Pt(2)-Te(1) bond length is 2.81 Å. The Pt(2)-Te(13) bond length is 2.42 Å. The Pt(2)-Te(7) bond length is 1.63 Å. The Pt(2)-Te(8) bond length is 2.67 Å. In the third Pt site, Pt(3) is bonded in a 3-coordinate geometry to one Te(2), one Te(7), and one Te(9) atom. The Pt(3)-Te(2) bond length is 2.81 Å. The Pt(3)-Te(7) bond length is 2.80 Å. The Pt(3)-Te(9) bond length is 2.67 Å. In the fourth Pt site, Pt(4) is bonded in a 2-coordinate geometry to one Te(18) and one Te(7) atom. The Pt(4)-Te(18) bond length is 2.05 Å. The Pt(4)-Te(7) bond length is 1.85 Å. In the fifth Pt site, Pt(5) is bonded in a single-bond geometry to one Te(12) and one Te(16) atom. The Pt(5)-Te(12) bond length is 2.42 Å. The Pt(5)-Te(16) bond length is 1.63 Å. In the sixth Pt site, Pt(6) is bonded in a single-bond geometry to one Te(12) and one Te(16) atom. The Pt(6)-Te(12) bond length is 2.42 Å. The Pt(6)-Te(16) bond length is 1.63 Å. There are eighteen inequivalent Te sites. In the first Te site, Te(1) is bonded in a 3-coordinate geometry to one Pt(2), one Te(18), and one Te(2) atom. The Te(1)-Te(18) bond length is 2.85 Å. The Te(1)-Te(2) bond length is 2.52 Å. In the second Te site, Te(2) is bonded in a 3-coordinate geometry to one Pt(3), one Te(1), and one Te(17) atom. The Te(2)-Te(17) bond length is 2.85 Å. In the third Te site, Te(3) is bonded in a single-bond geometry to one Pt(1) atom. In the fourth Te site, Te(4) is bonded in a distorted single-bond geometry to one Te(10) and one Te(13) atom. The Te(4)-Te(10) bond length is 3.21 Å. The Te(4)-Te(13) bond length is 1.02 Å. In the fifth Te site, Te(5) is bonded in an L-shaped geometry to one Te(14) and one Te(6) atom. The Te(5)-Te(14) bond length is 0.86 Å. The Te(5)-Te(6) bond length is 1.32 Å. In the sixth Te site, Te(6) is bonded in an L-shaped geometry to one Te(15) and one Te(5) atom. The Te(6)-Te(15) bond length is 0.86 Å. In the seventh Te site, Te(7) is bonded in a distorted L-shaped geometry to one Pt(2), one Pt(3), one Pt(4), and one Te(13) atom. The Te(7)-Te(13) bond length is 1.95 Å. In the eighth Te site, Te(8) is bonded in a 4-coordinate geometry to one Pt(1), one Pt(2), one Te(15), and one Te(9) atom. The Te(8)-Te(15) bond length is 2.66 Å. The Te(8)-Te(9) bond length is 1.66 Å. In the ninth Te site, Te(9) is bonded in a 4-coordinate geometry to one Pt(1), one Pt(3), one Te(14), and one Te(8) atom. The Te(9)-Te(14) bond length is 2.66 Å. In the tenth Te site, Te(10) is bonded in a 3-coordinate geometry to one Te(11), one Te(18), and one Te(4) atom. The Te(10)-Te(11) bond length is 2.52 Å. The Te(10)-Te(18) bond length is 2.85 Å. In the eleventh Te site, Te(11) is bonded in a 2-coordinate geometry to one Te(10) and one Te(17) atom. The Te(11)-Te(17) bond length is 2.85 Å. In the twelfth Te site, Te(12) is bonded in a 3-coordinate geometry to one Pt(5), one Pt(6), and one Te(16) atom. The Te(12)-Te(16) bond length is 1.95 Å. In the thirteenth Te site, Te(13) is bonded in a 3-coordinate geometry to one Pt(2), one Te(4), and one Te(7) atom. In the fourteenth Te site, Te(14) is bonded in a distorted L-shaped geometry to one Te(15), one Te(5), and one Te(9) atom. The Te(14)-Te(15) bond length is 1.32 Å. In the fifteenth Te site, Te(15) is bonded in a distorted L-shaped geometry to one Te(14), one Te(6), and one Te(8) atom. In the sixteenth Te site, Te(16) is bonded in a 3-coordinate geometry to one Pt(1), one Pt(5), one Pt(6), and one Te(12) atom. In the seventeenth Te site, Te(17) is bonded in a single-bond geometry to one Te(11), one Te(18), and one Te(2) atom. The Te(17)-Te(18) bond length is 0.45 Å. In the eighteenth Te site, Te(18) is bonded in a distorted single-bond geometry to one Pt(4), one Te(1), one Te(10), and one Te(17) atom.