The material structure described by Ti6Ge5 crystallizes in the orthorhombic Immm space group. There are four inequivalent Ti sites. In the first Ti site, Ti(1) is bonded in a 7-coordinate geometry to one Ge(1), two equivalent Ge(2), two equivalent Ge(3), and two equivalent Ge(4) atoms. In the second Ti site, Ti(2) is bonded in a 12-coordinate geometry to two equivalent Ti(2), four equivalent Ti(4), two equivalent Ge(1), and four equivalent Ge(4) atoms. In the third Ti site, Ti(3) is bonded in a 6-coordinate geometry to two equivalent Ge(1), two equivalent Ge(2), and two equivalent Ge(4) atoms. In the fourth Ti site, Ti(4) is bonded in a 6-coordinate geometry to two equivalent Ti(2), one Ge(1), one Ge(2), two equivalent Ge(3), and two equivalent Ge(4) atoms. There are four inequivalent Ge sites. In the first Ge site, Ge(1) is bonded in a 9-coordinate geometry to one Ti(1), two equivalent Ti(2), two equivalent Ti(4), and four equivalent Ti(3) atoms. In the second Ge site, Ge(2) is bonded in a 8-coordinate geometry to two equivalent Ti(1), two equivalent Ti(4), and four equivalent Ti(3) atoms. In the third Ge site, Ge(3) is bonded in a 8-coordinate geometry to two equivalent Ti(1), four equivalent Ti(4), and two equivalent Ge(3) atoms. In the fourth Ge site, Ge(4) is bonded in a 7-coordinate geometry to one Ti(1), two equivalent Ti(2), two equivalent Ti(3), and two equivalent Ti(4) atoms. is represented by the CIF file [CIF]
data_Ti6Ge5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.415
_cell_length_b   8.419
_cell_length_c   9.437
_cell_angle_alpha   116.490
_cell_angle_beta   106.671
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   364.709
_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
  Ti  Ti0  1  0.654  0.654  0.307  1.0
  Ti  Ti1  1  0.346  0.346  0.693  1.0
  Ti  Ti2  1  0.754  0.000  0.000  1.0
  Ti  Ti3  1  0.246  0.000  0.000  1.0
  Ti  Ti4  1  0.000  0.500  0.500  1.0
  Ti  Ti5  1  0.500  0.000  0.500  1.0
  Ti  Ti6  1  0.000  0.000  0.500  1.0
  Ti  Ti7  1  0.500  0.500  0.500  1.0
  Ti  Ti8  1  0.911  0.629  0.823  1.0
  Ti  Ti9  1  0.911  0.194  0.823  1.0
  Ti  Ti10  1  0.089  0.806  0.177  1.0
  Ti  Ti11  1  0.089  0.371  0.177  1.0
  Ge  Ge12  1  0.832  0.832  0.664  1.0
  Ge  Ge13  1  0.168  0.168  0.336  1.0
  Ge  Ge14  1  0.795  0.295  0.590  1.0
  Ge  Ge15  1  0.205  0.705  0.410  1.0
  Ge  Ge16  1  0.734  0.500  0.000  1.0
  Ge  Ge17  1  0.266  0.500  0.000  1.0
  Ge  Ge18  1  0.606  0.300  0.212  1.0
  Ge  Ge19  1  0.606  0.912  0.212  1.0
  Ge  Ge20  1  0.394  0.088  0.788  1.0
  Ge  Ge21  1  0.394  0.700  0.788  1.0
[/CIF]
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The material structure described by Ti6Ge5 crystallizes in the orthorhombic Immm space group. There are four inequivalent Ti sites. In the first Ti site, Ti(1) is bonded in a 7-coordinate geometry to one Ge(1), two equivalent Ge(2), two equivalent Ge(3), and two equivalent Ge(4) atoms. In the second Ti site, Ti(2) is bonded in a 12-coordinate geometry to two equivalent Ti(2), four equivalent Ti(4), two equivalent Ge(1), and four equivalent Ge(4) atoms. In the third Ti site, Ti(3) is bonded in a 6-coordinate geometry to two equivalent Ge(1), two equivalent Ge(2), and two equivalent Ge(4) atoms. In the fourth Ti site, Ti(4) is bonded in a 6-coordinate geometry to two equivalent Ti(2), one Ge(1), one Ge(2), two equivalent Ge(3), and two equivalent Ge(4) atoms. There are four inequivalent Ge sites. In the first Ge site, Ge(1) is bonded in a 9-coordinate geometry to one Ti(1), two equivalent Ti(2), two equivalent Ti(4), and four equivalent Ti(3) atoms. In the second Ge site, Ge(2) is bonded in a 8-coordinate geometry to two equivalent Ti(1), two equivalent Ti(4), and four equivalent Ti(3) atoms. In the third Ge site, Ge(3) is bonded in a 8-coordinate geometry to two equivalent Ti(1), four equivalent Ti(4), and two equivalent Ge(3) atoms. In the fourth Ge site, Ge(4) is bonded in a 7-coordinate geometry to one Ti(1), two equivalent Ti(2), two equivalent Ti(3), and two equivalent Ti(4) atoms. is represented by the CIF file [CIF]
data_Ti6Ge5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.415
_cell_length_b   8.419
_cell_length_c   9.437
_cell_angle_alpha   116.490
_cell_angle_beta   106.671
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   364.709
_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
  Ti  Ti0  1  0.654  0.654  0.307  1.0
  Ti  Ti1  1  0.346  0.346  0.693  1.0
  Ti  Ti2  1  0.754  0.000  0.000  1.0
  Ti  Ti3  1  0.246  0.000  0.000  1.0
  Ti  Ti4  1  0.000  0.500  0.500  1.0
  Ti  Ti5  1  0.500  0.000  0.500  1.0
  Ti  Ti6  1  0.000  0.000  0.500  1.0
  Ti  Ti7  1  0.500  0.500  0.500  1.0
  Ti  Ti8  1  0.911  0.629  0.823  1.0
  Ti  Ti9  1  0.911  0.194  0.823  1.0
  Ti  Ti10  1  0.089  0.806  0.177  1.0
  Ti  Ti11  1  0.089  0.371  0.177  1.0
  Ge  Ge12  1  0.832  0.832  0.664  1.0
  Ge  Ge13  1  0.168  0.168  0.336  1.0
  Ge  Ge14  1  0.795  0.295  0.590  1.0
  Ge  Ge15  1  0.205  0.705  0.410  1.0
  Ge  Ge16  1  0.734  0.500  0.000  1.0
  Ge  Ge17  1  0.266  0.500  0.000  1.0
  Ge  Ge18  1  0.606  0.300  0.212  1.0
  Ge  Ge19  1  0.606  0.912  0.212  1.0
  Ge  Ge20  1  0.394  0.088  0.788  1.0
  Ge  Ge21  1  0.394  0.700  0.788  1.0
[/CIF]
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