The material described by TmTiFe11 crystallizes in the orthorhombic Imm2 space group. Tm(1) is bonded in a 20-coordinate geometry to one Ti(1), one Fe(5), two equivalent Fe(1), two equivalent Fe(2), two equivalent Fe(6), four equivalent Fe(3), and eight equivalent Fe(4) atoms. Ti(1) is bonded in a 14-coordinate geometry to one Tm(1), one Fe(5), two equivalent Fe(2), two equivalent Fe(3), four equivalent Fe(4), and four equivalent Fe(6) atoms. There are six inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to two equivalent Tm(1), two equivalent Fe(3), two equivalent Fe(5), two equivalent Fe(6), and four equivalent Fe(4) atoms to form distorted FeTm2Fe10 cuboctahedra that share corners with eight equivalent Fe(4)Tm2TiFe9 cuboctahedra, edges with two equivalent Fe(1)Tm2Fe10 cuboctahedra, edges with four equivalent Fe(4)Tm2TiFe9 cuboctahedra, and faces with eight equivalent Fe(4)Tm2TiFe9 cuboctahedra. In the second Fe site, Fe(2) is bonded in a 12-coordinate geometry to two equivalent Tm(1), two equivalent Ti(1), two equivalent Fe(3), two equivalent Fe(6), and four equivalent Fe(4) atoms. In the third Fe site, Fe(3) is bonded in a 12-coordinate geometry to two equivalent Tm(1), one Ti(1), one Fe(1), one Fe(2), one Fe(5), two equivalent Fe(6), and four equivalent Fe(4) atoms. In the fourth Fe site, Fe(4) is bonded to two equivalent Tm(1), one Ti(1), one Fe(1), one Fe(2), one Fe(5), two equivalent Fe(3), two equivalent Fe(4), and two equivalent Fe(6) atoms to form distorted FeTm2TiFe9 cuboctahedra that share corners with two equivalent Fe(1)Tm2Fe10 cuboctahedra, corners with ten equivalent Fe(4)Tm2TiFe9 cuboctahedra,  an edgeedge with one Fe(1)Tm2Fe10 cuboctahedra, edges with four equivalent Fe(4)Tm2TiFe9 cuboctahedra, faces with two equivalent Fe(1)Tm2Fe10 cuboctahedra, and faces with six equivalent Fe(4)Tm2TiFe9 cuboctahedra. In the fifth Fe site, Fe(5) is bonded in a 1-coordinate geometry to one Tm(1), one Ti(1), two equivalent Fe(1), two equivalent Fe(3), four equivalent Fe(4), and four equivalent Fe(6) atoms. In the sixth Fe site, Fe(6) is bonded in a 14-coordinate geometry to one Tm(1), two equivalent Ti(1), one Fe(1), one Fe(2), one Fe(6), two equivalent Fe(3), two equivalent Fe(5), and four equivalent Fe(4) atoms. is represented by the CIF file [CIF]
data_TmTiFe11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.674
_cell_length_b   6.418
_cell_length_c   6.418
_cell_angle_alpha   98.145
_cell_angle_beta   111.355
_cell_angle_gamma   68.645
_symmetry_Int_Tables_number   1
_cell_volume   167.023
_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
  Tm  Tm0  1  0.006  0.994  0.006  1.0
  Ti  Ti1  1  0.632  0.368  0.632  1.0
  Fe  Fe2  1  0.729  0.771  0.229  1.0
  Fe  Fe3  1  0.276  0.224  0.776  1.0
  Fe  Fe4  1  0.500  0.784  0.783  1.0
  Fe  Fe5  1  0.500  0.217  0.216  1.0
  Fe  Fe6  1  0.501  0.998  0.500  1.0
  Fe  Fe7  1  0.002  0.998  0.500  1.0
  Fe  Fe8  1  0.501  0.500  0.002  1.0
  Fe  Fe9  1  0.002  0.500  0.002  1.0
  Fe  Fe10  1  0.353  0.647  0.353  1.0
  Fe  Fe11  1  1.000  0.356  0.356  1.0
  Fe  Fe12  1  1.000  0.644  0.644  1.0
[/CIF]
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The material described by TmTiFe11 crystallizes in the orthorhombic Imm2 space group. Tm(1) is bonded in a 20-coordinate geometry to one Ti(1), one Fe(5), two equivalent Fe(1), two equivalent Fe(2), two equivalent Fe(6), four equivalent Fe(3), and eight equivalent Fe(4) atoms. Ti(1) is bonded in a 14-coordinate geometry to one Tm(1), one Fe(5), two equivalent Fe(2), two equivalent Fe(3), four equivalent Fe(4), and four equivalent Fe(6) atoms. There are six inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to two equivalent Tm(1), two equivalent Fe(3), two equivalent Fe(5), two equivalent Fe(6), and four equivalent Fe(4) atoms to form distorted FeTm2Fe10 cuboctahedra that share corners with eight equivalent Fe(4)Tm2TiFe9 cuboctahedra, edges with two equivalent Fe(1)Tm2Fe10 cuboctahedra, edges with four equivalent Fe(4)Tm2TiFe9 cuboctahedra, and faces with eight equivalent Fe(4)Tm2TiFe9 cuboctahedra. In the second Fe site, Fe(2) is bonded in a 12-coordinate geometry to two equivalent Tm(1), two equivalent Ti(1), two equivalent Fe(3), two equivalent Fe(6), and four equivalent Fe(4) atoms. In the third Fe site, Fe(3) is bonded in a 12-coordinate geometry to two equivalent Tm(1), one Ti(1), one Fe(1), one Fe(2), one Fe(5), two equivalent Fe(6), and four equivalent Fe(4) atoms. In the fourth Fe site, Fe(4) is bonded to two equivalent Tm(1), one Ti(1), one Fe(1), one Fe(2), one Fe(5), two equivalent Fe(3), two equivalent Fe(4), and two equivalent Fe(6) atoms to form distorted FeTm2TiFe9 cuboctahedra that share corners with two equivalent Fe(1)Tm2Fe10 cuboctahedra, corners with ten equivalent Fe(4)Tm2TiFe9 cuboctahedra,  an edgeedge with one Fe(1)Tm2Fe10 cuboctahedra, edges with four equivalent Fe(4)Tm2TiFe9 cuboctahedra, faces with two equivalent Fe(1)Tm2Fe10 cuboctahedra, and faces with six equivalent Fe(4)Tm2TiFe9 cuboctahedra. In the fifth Fe site, Fe(5) is bonded in a 1-coordinate geometry to one Tm(1), one Ti(1), two equivalent Fe(1), two equivalent Fe(3), four equivalent Fe(4), and four equivalent Fe(6) atoms. In the sixth Fe site, Fe(6) is bonded in a 14-coordinate geometry to one Tm(1), two equivalent Ti(1), one Fe(1), one Fe(2), one Fe(6), two equivalent Fe(3), two equivalent Fe(5), and four equivalent Fe(4) atoms. is represented by the CIF file [CIF]
data_TmTiFe11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.674
_cell_length_b   6.418
_cell_length_c   6.418
_cell_angle_alpha   98.145
_cell_angle_beta   111.355
_cell_angle_gamma   68.645
_symmetry_Int_Tables_number   1
_cell_volume   167.023
_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
  Tm  Tm0  1  0.006  0.994  0.006  1.0
  Ti  Ti1  1  0.632  0.368  0.632  1.0
  Fe  Fe2  1  0.729  0.771  0.229  1.0
  Fe  Fe3  1  0.276  0.224  0.776  1.0
  Fe  Fe4  1  0.500  0.784  0.783  1.0
  Fe  Fe5  1  0.500  0.217  0.216  1.0
  Fe  Fe6  1  0.501  0.998  0.500  1.0
  Fe  Fe7  1  0.002  0.998  0.500  1.0
  Fe  Fe8  1  0.501  0.500  0.002  1.0
  Fe  Fe9  1  0.002  0.500  0.002  1.0
  Fe  Fe10  1  0.353  0.647  0.353  1.0
  Fe  Fe11  1  1.000  0.356  0.356  1.0
  Fe  Fe12  1  1.000  0.644  0.644  1.0
[/CIF]
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