data_La3Te5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.75
_cell_length_b   9.75
_cell_length_c   6.44
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Te5
_chemical_formula_sum   'La6 Te10'
_cell_volume   530.31
_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
  La  La0  1  0.19  0.13  0.83  1.0
  La  La1  1  0.93  0.31  0.61  1.0
  La  La2  1  0.07  0.31  0.83  1.0
  La  La3  1  0.62  0.0  0.83  1.0
  La  La4  1  0.14  0.0  0.61  1.0
  La  La5  1  0.81  0.13  0.61  1.0
  Te  Te6  1  0.88  0.82  0.22  1.0
  Te  Te7  1  0.0  0.63  0.0  1.0
  Te  Te8  1  0.0  0.63  0.22  1.0
  Te  Te9  1  0.88  0.82  0.0  1.0
  Te  Te10  1  0.46  0.13  0.83  1.0
  Te  Te11  1  0.66  0.32  0.61  1.0
  Te  Te12  1  0.34  0.32  0.83  1.0
  Te  Te13  1  0.07  0.0  0.83  1.0
  Te  Te14  1  0.68  0.0  0.61  1.0
  Te  Te15  1  0.54  0.13  0.61  1.0

data_La3Te5
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.44
_cell_length_b   9.75
_cell_length_c   9.75
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Te5
_chemical_formula_sum   'La6 Te10'
_cell_volume   530.31
_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
  La  La0  1  0.61  0.14  0.0  1.0
  La  La1  1  0.61  0.81  0.13  1.0
  La  La2  1  0.61  0.93  0.31  1.0
  La  La3  1  0.83  0.07  0.31  1.0
  La  La4  1  0.83  0.19  0.13  1.0
  La  La5  1  0.83  0.62  0.0  1.0
  Te  Te6  1  -0.0  -0.0  0.63  1.0
  Te  Te7  1  0.0  0.88  0.82  1.0
  Te  Te8  1  0.22  -0.0  0.63  1.0
  Te  Te9  1  0.22  0.88  0.82  1.0
  Te  Te10  1  0.61  0.54  0.13  1.0
  Te  Te11  1  0.61  0.66  0.32  1.0
  Te  Te12  1  0.61  0.68  0.0  1.0
  Te  Te13  1  0.83  0.07  0.0  1.0
  Te  Te14  1  0.83  0.34  0.32  1.0
  Te  Te15  1  0.83  0.46  0.13  1.0

La La La La La La Te Te Te Te Te Te Te Te Te Te
La La La La La La Te Te Te Te Te Te Te Te Te Te 0 13 o o o 0 4 o o o 0 12 o o o 1 5 o o o 1 2 + o o 3 14 o o o 4 13 o o o 5 14 o o o 6 9 o o o 7 8 o o o 10 15 o o o 11 15 o o o 
La3Te5 crystallizes in the triclinic P1 space group. There are six inequivalent La sites. In the first La site, La(1) is bonded in a distorted linear geometry to one La(3), one Te(5), one Te(7), and one Te(8) atom. The La(1)-La(3) bond length is 2.59 Å. The La(1)-Te(5) bond length is 2.68 Å. The La(1)-Te(7) bond length is 1.68 Å. The La(1)-Te(8) bond length is 1.23 Å. In the second La site, La(2) is bonded in a 5-coordinate geometry to one La(3), one La(6), one Te(2), one Te(3), and one Te(6) atom. The La(2)-La(3) bond length is 1.94 Å. The La(2)-La(6) bond length is 1.57 Å. The La(2)-Te(2) bond length is 3.78 Å. The La(2)-Te(3) bond length is 3.78 Å. The La(2)-Te(6) bond length is 2.68 Å. In the third La site, La(3) is bonded in a 6-coordinate geometry to one La(1), one La(2), one La(6), one Te(2), one Te(7), and one Te(8) atom. The La(3)-La(6) bond length is 2.65 Å. The La(3)-Te(2) bond length is 3.64 Å. The La(3)-Te(7) bond length is 2.62 Å. The La(3)-Te(8) bond length is 3.09 Å. In the fourth La site, La(4) is bonded in a distorted single-bond geometry to one Te(10), one Te(4), one Te(5), and one Te(9) atom. The La(4)-Te(10) bond length is 2.25 Å. The La(4)-Te(4) bond length is 3.93 Å. The La(4)-Te(5) bond length is 2.36 Å. The La(4)-Te(9) bond length is 1.53 Å. In the fifth La site, La(5) is bonded in a distorted single-bond geometry to one Te(1), one Te(3), and one Te(8) atom. The La(5)-Te(1) bond length is 3.38 Å. The La(5)-Te(3) bond length is 4.03 Å. The La(5)-Te(8) bond length is 1.53 Å. In the sixth La site, La(6) is bonded in a single-bond geometry to one La(2), one La(3), and one Te(9) atom. The La(6)-Te(9) bond length is 1.27 Å. There are ten inequivalent Te sites. In the first Te site, Te(1) is bonded in a 3-coordinate geometry to one La(5), one Te(3), and one Te(4) atom. The Te(1)-Te(3) bond length is 2.62 Å. The Te(1)-Te(4) bond length is 1.41 Å. In the second Te site, Te(2) is bonded in a 1-coordinate geometry to one La(2), one La(3), one Te(3), and one Te(4) atom. The Te(2)-Te(3) bond length is 1.41 Å. The Te(2)-Te(4) bond length is 2.62 Å. In the third Te site, Te(3) is bonded in a distorted rectangular see-saw-like geometry to one La(2), one La(5), one Te(1), and one Te(2) atom. In the fourth Te site, Te(4) is bonded in a 4-coordinate geometry to one La(4), one Te(1), one Te(2), and one Te(8) atom. The Te(4)-Te(8) bond length is 2.17 Å. In the fifth Te site, Te(5) is bonded in a 3-coordinate geometry to one La(1), one La(4), and one Te(10) atom. The Te(5)-Te(10) bond length is 1.58 Å. In the sixth Te site, Te(6) is bonded in a distorted water-like geometry to one La(2) and one Te(10) atom. The Te(6)-Te(10) bond length is 1.67 Å. In the seventh Te site, Te(7) is bonded in a distorted single-bond geometry to one La(1) and one La(3) atom. In the eighth Te site, Te(8) is bonded in a distorted L-shaped geometry to one La(1), one La(3), one La(5), and one Te(4) atom. In the ninth Te site, Te(9) is bonded in a water-like geometry to one La(4) and one La(6) atom. In the tenth Te site, Te(10) is bonded in a 3-coordinate geometry to one La(4), one Te(5), and one Te(6) atom.