The compound described by RbBeYF6 crystallizes in the monoclinic P2_1/m space group. Rb(1) is bonded in a 12-coordinate geometry to one F(2), three equivalent F(4), four equivalent F(1), and four equivalent F(3) atoms. Be(1) is bonded in a tetrahedral geometry to one F(2), one F(4), and two equivalent F(1) atoms. Y(1) is bonded in a 8-coordinate geometry to one F(2), one F(4), two equivalent F(1), and four equivalent F(3) atoms. There are four inequivalent F sites. In the first F site, F(1) is bonded in a 1-coordinate geometry to two equivalent Rb(1), one Be(1), and one Y(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one Rb(1), one Be(1), and one Y(1) atom. In the third F site, F(3) is bonded to two equivalent Rb(1) and two equivalent Y(1) atoms to form a mixture of distorted corner and edge-sharing FRb2Y2 tetrahedra. In the fourth F site, F(4) is bonded in a distorted single-bond geometry to three equivalent Rb(1), one Be(1), and one Y(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbYBeF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.913
_cell_length_b   6.565
_cell_length_c   7.259
_cell_angle_alpha   66.326
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   258.084
_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
  Rb  Rb0  1  0.250  0.079  0.788  1.0
  Rb  Rb1  1  0.750  0.921  0.212  1.0
  Y  Y2  1  0.250  0.391  0.180  1.0
  Y  Y3  1  0.750  0.609  0.820  1.0
  Be  Be4  1  0.250  0.767  0.464  1.0
  Be  Be5  1  0.750  0.233  0.536  1.0
  F  F6  1  0.464  0.759  0.595  1.0
  F  F7  1  0.536  0.241  0.405  1.0
  F  F8  1  0.964  0.241  0.405  1.0
  F  F9  1  0.036  0.759  0.595  1.0
  F  F10  1  0.250  0.569  0.399  1.0
  F  F11  1  0.750  0.431  0.601  1.0
  F  F12  1  0.499  0.676  0.031  1.0
  F  F13  1  0.501  0.324  0.969  1.0
  F  F14  1  0.999  0.324  0.969  1.0
  F  F15  1  0.001  0.676  0.031  1.0
  F  F16  1  0.250  0.994  0.272  1.0
  F  F17  1  0.750  0.006  0.728  1.0
[/CIF]
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The compound described by RbBeYF6 crystallizes in the monoclinic P2_1/m space group. Rb(1) is bonded in a 12-coordinate geometry to one F(2), three equivalent F(4), four equivalent F(1), and four equivalent F(3) atoms. Be(1) is bonded in a tetrahedral geometry to one F(2), one F(4), and two equivalent F(1) atoms. Y(1) is bonded in a 8-coordinate geometry to one F(2), one F(4), two equivalent F(1), and four equivalent F(3) atoms. There are four inequivalent F sites. In the first F site, F(1) is bonded in a 1-coordinate geometry to two equivalent Rb(1), one Be(1), and one Y(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one Rb(1), one Be(1), and one Y(1) atom. In the third F site, F(3) is bonded to two equivalent Rb(1) and two equivalent Y(1) atoms to form a mixture of distorted corner and edge-sharing FRb2Y2 tetrahedra. In the fourth F site, F(4) is bonded in a distorted single-bond geometry to three equivalent Rb(1), one Be(1), and one Y(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbYBeF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.913
_cell_length_b   6.565
_cell_length_c   7.259
_cell_angle_alpha   66.326
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   258.084
_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
  Rb  Rb0  1  0.250  0.079  0.788  1.0
  Rb  Rb1  1  0.750  0.921  0.212  1.0
  Y  Y2  1  0.250  0.391  0.180  1.0
  Y  Y3  1  0.750  0.609  0.820  1.0
  Be  Be4  1  0.250  0.767  0.464  1.0
  Be  Be5  1  0.750  0.233  0.536  1.0
  F  F6  1  0.464  0.759  0.595  1.0
  F  F7  1  0.536  0.241  0.405  1.0
  F  F8  1  0.964  0.241  0.405  1.0
  F  F9  1  0.036  0.759  0.595  1.0
  F  F10  1  0.250  0.569  0.399  1.0
  F  F11  1  0.750  0.431  0.601  1.0
  F  F12  1  0.499  0.676  0.031  1.0
  F  F13  1  0.501  0.324  0.969  1.0
  F  F14  1  0.999  0.324  0.969  1.0
  F  F15  1  0.001  0.676  0.031  1.0
  F  F16  1  0.250  0.994  0.272  1.0
  F  F17  1  0.750  0.006  0.728  1.0
[/CIF]
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