The compound described by Ni(Mo3Te4)2 crystallizes in the triclinic P1 space group. There are six inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 9-coordinate geometry to one Mo(3), one Mo(4), one Mo(5), one Mo(6), one Te(1), one Te(3), one Te(5), one Te(6), and one Te(8) atom. In the second Mo site, Mo(2) is bonded in a 9-coordinate geometry to one Mo(3), one Mo(4), one Mo(5), one Mo(6), one Te(2), one Te(4), one Te(5), one Te(6), and one Te(7) atom. In the third Mo site, Mo(3) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(5), one Mo(6), one Ni(1), one Te(1), one Te(3), one Te(4), one Te(6), and one Te(7) atom. In the fourth Mo site, Mo(4) is bonded in a 9-coordinate geometry to one Mo(1), one Mo(2), one Mo(5), one Mo(6), one Te(2), one Te(3), one Te(4), one Te(5), and one Te(8) atom. In the fifth Mo site, Mo(5) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(3), one Mo(4), one Ni(1), one Te(1), one Te(4), one Te(5), one Te(7), and one Te(8) atom. In the sixth Mo site, Mo(6) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(3), one Mo(4), one Ni(1), one Te(2), one Te(3), one Te(6), one Te(7), and one Te(8) atom. Ni(1) is bonded in a 7-coordinate geometry to one Mo(3), one Mo(5), one Mo(6), one Te(1), one Te(3), one Te(4), and one Te(7) atom. There are eight inequivalent Te sites. In the first Te site, Te(1) is bonded in a 4-coordinate geometry to one Mo(1), one Mo(3), one Mo(5), and one Ni(1) atom. In the second Te site, Te(2) is bonded in a 3-coordinate geometry to one Mo(2), one Mo(4), and one Mo(6) atom. In the third Te site, Te(3) is bonded in a 5-coordinate geometry to one Mo(1), one Mo(3), one Mo(4), one Mo(6), and one Ni(1) atom. In the fourth Te site, Te(4) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(4), one Mo(5), and one Ni(1) atom. In the fifth Te site, Te(5) is bonded in a rectangular see-saw-like geometry to one Mo(1), one Mo(2), one Mo(4), and one Mo(5) atom. In the sixth Te site, Te(6) is bonded in a rectangular see-saw-like geometry to one Mo(1), one Mo(2), one Mo(3), and one Mo(6) atom. In the seventh Te site, Te(7) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(5), one Mo(6), and one Ni(1) atom. In the eighth Te site, Te(8) is bonded in a distorted rectangular see-saw-like geometry to one Mo(1), one Mo(4), one Mo(5), and one Mo(6) atom. is represented by the CIF card [CIF]
data_Ni(Te4Mo3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.155
_cell_length_b   7.183
_cell_length_c   7.238
_cell_angle_alpha   91.223
_cell_angle_beta   95.460
_cell_angle_gamma   90.048
_symmetry_Int_Tables_number   1
_cell_volume   370.195
_cell_formula_units_Z   1
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
  Ni  Ni0  1  0.828  0.932  0.507  1.0
  Te  Te1  1  0.792  0.774  0.806  1.0
  Te  Te2  1  0.205  0.229  0.211  1.0
  Te  Te3  1  0.903  0.256  0.638  1.0
  Te  Te4  1  0.106  0.751  0.374  1.0
  Te  Te5  1  0.269  0.626  0.867  1.0
  Te  Te6  1  0.731  0.373  0.129  1.0
  Te  Te7  1  0.588  0.887  0.244  1.0
  Te  Te8  1  0.389  0.119  0.739  1.0
  Mo  Mo9  1  0.590  0.444  0.747  1.0
  Mo  Mo10  1  0.414  0.547  0.246  1.0
  Mo  Mo11  1  0.757  0.571  0.458  1.0
  Mo  Mo12  1  0.248  0.424  0.542  1.0
  Mo  Mo13  1  0.460  0.760  0.577  1.0
  Mo  Mo14  1  0.548  0.243  0.423  1.0
[/CIF]
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The compound described by Ni(Mo3Te4)2 crystallizes in the triclinic P1 space group. There are six inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 9-coordinate geometry to one Mo(3), one Mo(4), one Mo(5), one Mo(6), one Te(1), one Te(3), one Te(5), one Te(6), and one Te(8) atom. In the second Mo site, Mo(2) is bonded in a 9-coordinate geometry to one Mo(3), one Mo(4), one Mo(5), one Mo(6), one Te(2), one Te(4), one Te(5), one Te(6), and one Te(7) atom. In the third Mo site, Mo(3) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(5), one Mo(6), one Ni(1), one Te(1), one Te(3), one Te(4), one Te(6), and one Te(7) atom. In the fourth Mo site, Mo(4) is bonded in a 9-coordinate geometry to one Mo(1), one Mo(2), one Mo(5), one Mo(6), one Te(2), one Te(3), one Te(4), one Te(5), and one Te(8) atom. In the fifth Mo site, Mo(5) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(3), one Mo(4), one Ni(1), one Te(1), one Te(4), one Te(5), one Te(7), and one Te(8) atom. In the sixth Mo site, Mo(6) is bonded in a 10-coordinate geometry to one Mo(1), one Mo(2), one Mo(3), one Mo(4), one Ni(1), one Te(2), one Te(3), one Te(6), one Te(7), and one Te(8) atom. Ni(1) is bonded in a 7-coordinate geometry to one Mo(3), one Mo(5), one Mo(6), one Te(1), one Te(3), one Te(4), and one Te(7) atom. There are eight inequivalent Te sites. In the first Te site, Te(1) is bonded in a 4-coordinate geometry to one Mo(1), one Mo(3), one Mo(5), and one Ni(1) atom. In the second Te site, Te(2) is bonded in a 3-coordinate geometry to one Mo(2), one Mo(4), and one Mo(6) atom. In the third Te site, Te(3) is bonded in a 5-coordinate geometry to one Mo(1), one Mo(3), one Mo(4), one Mo(6), and one Ni(1) atom. In the fourth Te site, Te(4) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(4), one Mo(5), and one Ni(1) atom. In the fifth Te site, Te(5) is bonded in a rectangular see-saw-like geometry to one Mo(1), one Mo(2), one Mo(4), and one Mo(5) atom. In the sixth Te site, Te(6) is bonded in a rectangular see-saw-like geometry to one Mo(1), one Mo(2), one Mo(3), and one Mo(6) atom. In the seventh Te site, Te(7) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(5), one Mo(6), and one Ni(1) atom. In the eighth Te site, Te(8) is bonded in a distorted rectangular see-saw-like geometry to one Mo(1), one Mo(4), one Mo(5), and one Mo(6) atom. is represented by the CIF card [CIF]
data_Ni(Te4Mo3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.155
_cell_length_b   7.183
_cell_length_c   7.238
_cell_angle_alpha   91.223
_cell_angle_beta   95.460
_cell_angle_gamma   90.048
_symmetry_Int_Tables_number   1
_cell_volume   370.195
_cell_formula_units_Z   1
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
  Ni  Ni0  1  0.828  0.932  0.507  1.0
  Te  Te1  1  0.792  0.774  0.806  1.0
  Te  Te2  1  0.205  0.229  0.211  1.0
  Te  Te3  1  0.903  0.256  0.638  1.0
  Te  Te4  1  0.106  0.751  0.374  1.0
  Te  Te5  1  0.269  0.626  0.867  1.0
  Te  Te6  1  0.731  0.373  0.129  1.0
  Te  Te7  1  0.588  0.887  0.244  1.0
  Te  Te8  1  0.389  0.119  0.739  1.0
  Mo  Mo9  1  0.590  0.444  0.747  1.0
  Mo  Mo10  1  0.414  0.547  0.246  1.0
  Mo  Mo11  1  0.757  0.571  0.458  1.0
  Mo  Mo12  1  0.248  0.424  0.542  1.0
  Mo  Mo13  1  0.460  0.760  0.577  1.0
  Mo  Mo14  1  0.548  0.243  0.423  1.0
[/CIF]
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