The crystal structure described by LuHfF7 crystallizes in the monoclinic P2_1 space group. Lu(1) is bonded in a 8-coordinate geometry to one F(2), one F(3), one F(4), one F(5), one F(6), one F(7), and two equivalent F(1) atoms. Hf(1) is bonded in an octahedral geometry to one F(2), one F(3), one F(4), one F(5), one F(6), and one F(7) atom. There are seven inequivalent F sites. In the first F site, F(1) is bonded in a bent 150 degrees geometry to two equivalent Lu(1) atoms. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the third F site, F(3) is bonded in a linear geometry to one Lu(1) and one Hf(1) atom. In the fourth F site, F(4) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the fifth F site, F(5) is bonded in a linear geometry to one Lu(1) and one Hf(1) atom. In the sixth F site, F(6) is bonded in a distorted bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the seventh F site, F(7) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. is represented by the CIF file [CIF]
data_LuHfF7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.578
_cell_length_b   5.875
_cell_length_c   8.031
_cell_angle_alpha   102.894
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   256.569
_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
  Lu  Lu0  1  0.698  0.653  0.685  1.0
  Lu  Lu1  1  0.198  0.347  0.315  1.0
  Hf  Hf2  1  0.708  0.814  0.226  1.0
  Hf  Hf3  1  0.208  0.186  0.774  1.0
  F  F4  1  0.897  0.462  0.479  1.0
  F  F5  1  0.397  0.538  0.521  1.0
  F  F6  1  0.433  0.922  0.769  1.0
  F  F7  1  0.933  0.078  0.231  1.0
  F  F8  1  0.950  0.945  0.759  1.0
  F  F9  1  0.450  0.055  0.241  1.0
  F  F10  1  0.989  0.457  0.789  1.0
  F  F11  1  0.489  0.543  0.211  1.0
  F  F12  1  0.697  0.755  0.974  1.0
  F  F13  1  0.197  0.245  0.026  1.0
  F  F14  1  0.700  0.869  0.479  1.0
  F  F15  1  0.200  0.131  0.521  1.0
  F  F16  1  0.504  0.380  0.782  1.0
  F  F17  1  0.004  0.620  0.218  1.0
[/CIF]
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The crystal structure described by LuHfF7 crystallizes in the monoclinic P2_1 space group. Lu(1) is bonded in a 8-coordinate geometry to one F(2), one F(3), one F(4), one F(5), one F(6), one F(7), and two equivalent F(1) atoms. Hf(1) is bonded in an octahedral geometry to one F(2), one F(3), one F(4), one F(5), one F(6), and one F(7) atom. There are seven inequivalent F sites. In the first F site, F(1) is bonded in a bent 150 degrees geometry to two equivalent Lu(1) atoms. In the second F site, F(2) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the third F site, F(3) is bonded in a linear geometry to one Lu(1) and one Hf(1) atom. In the fourth F site, F(4) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the fifth F site, F(5) is bonded in a linear geometry to one Lu(1) and one Hf(1) atom. In the sixth F site, F(6) is bonded in a distorted bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. In the seventh F site, F(7) is bonded in a bent 150 degrees geometry to one Lu(1) and one Hf(1) atom. is represented by the CIF file [CIF]
data_LuHfF7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.578
_cell_length_b   5.875
_cell_length_c   8.031
_cell_angle_alpha   102.894
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   256.569
_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
  Lu  Lu0  1  0.698  0.653  0.685  1.0
  Lu  Lu1  1  0.198  0.347  0.315  1.0
  Hf  Hf2  1  0.708  0.814  0.226  1.0
  Hf  Hf3  1  0.208  0.186  0.774  1.0
  F  F4  1  0.897  0.462  0.479  1.0
  F  F5  1  0.397  0.538  0.521  1.0
  F  F6  1  0.433  0.922  0.769  1.0
  F  F7  1  0.933  0.078  0.231  1.0
  F  F8  1  0.950  0.945  0.759  1.0
  F  F9  1  0.450  0.055  0.241  1.0
  F  F10  1  0.989  0.457  0.789  1.0
  F  F11  1  0.489  0.543  0.211  1.0
  F  F12  1  0.697  0.755  0.974  1.0
  F  F13  1  0.197  0.245  0.026  1.0
  F  F14  1  0.700  0.869  0.479  1.0
  F  F15  1  0.200  0.131  0.521  1.0
  F  F16  1  0.504  0.380  0.782  1.0
  F  F17  1  0.004  0.620  0.218  1.0
[/CIF]
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