The compound described by CuSiTi crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded in a 11-coordinate geometry to six equivalent Cu(1) and five equivalent Si(1) atoms. Cu(1) is bonded in a 10-coordinate geometry to six equivalent Ti(1) and four equivalent Si(1) atoms. Si(1) is bonded in a 9-coordinate geometry to five equivalent Ti(1) and four equivalent Cu(1) atoms. is represented by the CIF card [CIF]
data_TiCuSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.727
_cell_length_b   6.173
_cell_length_c   7.092
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   163.159
_cell_formula_units_Z   4
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  0.750  0.482  0.683  1.0
  Ti  Ti1  1  0.250  0.018  0.183  1.0
  Ti  Ti2  1  0.750  0.982  0.817  1.0
  Ti  Ti3  1  0.250  0.518  0.317  1.0
  Cu  Cu4  1  0.250  0.655  0.932  1.0
  Cu  Cu5  1  0.250  0.155  0.568  1.0
  Cu  Cu6  1  0.750  0.845  0.432  1.0
  Cu  Cu7  1  0.750  0.345  0.068  1.0
  Si  Si8  1  0.250  0.269  0.884  1.0
  Si  Si9  1  0.250  0.769  0.616  1.0
  Si  Si10  1  0.750  0.731  0.116  1.0
  Si  Si11  1  0.750  0.231  0.384  1.0
[/CIF]
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The compound described by CuSiTi crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded in a 11-coordinate geometry to six equivalent Cu(1) and five equivalent Si(1) atoms. Cu(1) is bonded in a 10-coordinate geometry to six equivalent Ti(1) and four equivalent Si(1) atoms. Si(1) is bonded in a 9-coordinate geometry to five equivalent Ti(1) and four equivalent Cu(1) atoms. is represented by the CIF card [CIF]
data_TiCuSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.727
_cell_length_b   6.173
_cell_length_c   7.092
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   163.159
_cell_formula_units_Z   4
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  0.750  0.482  0.683  1.0
  Ti  Ti1  1  0.250  0.018  0.183  1.0
  Ti  Ti2  1  0.750  0.982  0.817  1.0
  Ti  Ti3  1  0.250  0.518  0.317  1.0
  Cu  Cu4  1  0.250  0.655  0.932  1.0
  Cu  Cu5  1  0.250  0.155  0.568  1.0
  Cu  Cu6  1  0.750  0.845  0.432  1.0
  Cu  Cu7  1  0.750  0.345  0.068  1.0
  Si  Si8  1  0.250  0.269  0.884  1.0
  Si  Si9  1  0.250  0.769  0.616  1.0
  Si  Si10  1  0.750  0.731  0.116  1.0
  Si  Si11  1  0.750  0.231  0.384  1.0
[/CIF]
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