The structure described by Cs2CrH4F10 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 12-coordinate geometry to one F(1), two equivalent F(3), three equivalent F(2), three equivalent F(4), and three equivalent F(5) atoms. Cr(1) is bonded in an octahedral geometry to two equivalent F(1), two equivalent F(2), and two equivalent F(3) atoms. There are two inequivalent H sites. In the first H site, H(1) is bonded in a linear geometry to one F(3) and one F(4) atom. In the second H site, H(2) is bonded in a linear geometry to one F(1) and one F(5) atom. There are five inequivalent F sites. In the first F site, F(1) is bonded in a distorted bent 150 degrees geometry to one Cs(1), one Cr(1), and one H(2) atom. In the second F site, F(2) is bonded in a single-bond geometry to three equivalent Cs(1) and one Cr(1) atom. In the third F site, F(3) is bonded in a bent 120 degrees geometry to two equivalent Cs(1), one Cr(1), and one H(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to three equivalent Cs(1) and one H(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to three equivalent Cs(1) and one H(2) atom. is represented by the CIF card [CIF]
data_Cs2CrH4F10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.220
_cell_length_b   7.771
_cell_length_c   9.934
_cell_angle_alpha   106.729
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   533.811
_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
  Cs  Cs0  1  0.784  0.475  0.835  1.0
  Cs  Cs1  1  0.716  0.975  0.335  1.0
  Cs  Cs2  1  0.216  0.525  0.165  1.0
  Cs  Cs3  1  0.284  0.025  0.665  1.0
  Cr  Cr4  1  0.500  0.500  0.500  1.0
  Cr  Cr5  1  0.000  0.000  0.000  1.0
  H  H6  1  0.296  0.548  0.768  1.0
  H  H7  1  0.204  0.048  0.268  1.0
  H  H8  1  0.704  0.452  0.232  1.0
  H  H9  1  0.796  0.952  0.732  1.0
  H  H10  1  0.597  0.165  0.005  1.0
  H  H11  1  0.903  0.665  0.505  1.0
  H  H12  1  0.403  0.835  0.995  1.0
  H  H13  1  0.097  0.335  0.495  1.0
  F  F14  1  0.261  0.424  0.445  1.0
  F  F15  1  0.239  0.924  0.945  1.0
  F  F16  1  0.739  0.576  0.555  1.0
  F  F17  1  0.761  0.076  0.055  1.0
  F  F18  1  0.535  0.303  0.562  1.0
  F  F19  1  0.965  0.803  0.062  1.0
  F  F20  1  0.465  0.697  0.438  1.0
  F  F21  1  0.035  0.197  0.938  1.0
  F  F22  1  0.411  0.629  0.681  1.0
  F  F23  1  0.089  0.129  0.181  1.0
  F  F24  1  0.589  0.371  0.319  1.0
  F  F25  1  0.911  0.871  0.819  1.0
  F  F26  1  0.226  0.483  0.823  1.0
  F  F27  1  0.274  0.983  0.323  1.0
  F  F28  1  0.774  0.517  0.177  1.0
  F  F29  1  0.726  0.017  0.677  1.0
  F  F30  1  0.505  0.234  0.971  1.0
  F  F31  1  0.995  0.734  0.471  1.0
  F  F32  1  0.495  0.766  0.029  1.0
  F  F33  1  0.005  0.266  0.529  1.0
[/CIF]
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The structure described by Cs2CrH4F10 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 12-coordinate geometry to one F(1), two equivalent F(3), three equivalent F(2), three equivalent F(4), and three equivalent F(5) atoms. Cr(1) is bonded in an octahedral geometry to two equivalent F(1), two equivalent F(2), and two equivalent F(3) atoms. There are two inequivalent H sites. In the first H site, H(1) is bonded in a linear geometry to one F(3) and one F(4) atom. In the second H site, H(2) is bonded in a linear geometry to one F(1) and one F(5) atom. There are five inequivalent F sites. In the first F site, F(1) is bonded in a distorted bent 150 degrees geometry to one Cs(1), one Cr(1), and one H(2) atom. In the second F site, F(2) is bonded in a single-bond geometry to three equivalent Cs(1) and one Cr(1) atom. In the third F site, F(3) is bonded in a bent 120 degrees geometry to two equivalent Cs(1), one Cr(1), and one H(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to three equivalent Cs(1) and one H(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to three equivalent Cs(1) and one H(2) atom. is represented by the CIF card [CIF]
data_Cs2CrH4F10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.220
_cell_length_b   7.771
_cell_length_c   9.934
_cell_angle_alpha   106.729
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   533.811
_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
  Cs  Cs0  1  0.784  0.475  0.835  1.0
  Cs  Cs1  1  0.716  0.975  0.335  1.0
  Cs  Cs2  1  0.216  0.525  0.165  1.0
  Cs  Cs3  1  0.284  0.025  0.665  1.0
  Cr  Cr4  1  0.500  0.500  0.500  1.0
  Cr  Cr5  1  0.000  0.000  0.000  1.0
  H  H6  1  0.296  0.548  0.768  1.0
  H  H7  1  0.204  0.048  0.268  1.0
  H  H8  1  0.704  0.452  0.232  1.0
  H  H9  1  0.796  0.952  0.732  1.0
  H  H10  1  0.597  0.165  0.005  1.0
  H  H11  1  0.903  0.665  0.505  1.0
  H  H12  1  0.403  0.835  0.995  1.0
  H  H13  1  0.097  0.335  0.495  1.0
  F  F14  1  0.261  0.424  0.445  1.0
  F  F15  1  0.239  0.924  0.945  1.0
  F  F16  1  0.739  0.576  0.555  1.0
  F  F17  1  0.761  0.076  0.055  1.0
  F  F18  1  0.535  0.303  0.562  1.0
  F  F19  1  0.965  0.803  0.062  1.0
  F  F20  1  0.465  0.697  0.438  1.0
  F  F21  1  0.035  0.197  0.938  1.0
  F  F22  1  0.411  0.629  0.681  1.0
  F  F23  1  0.089  0.129  0.181  1.0
  F  F24  1  0.589  0.371  0.319  1.0
  F  F25  1  0.911  0.871  0.819  1.0
  F  F26  1  0.226  0.483  0.823  1.0
  F  F27  1  0.274  0.983  0.323  1.0
  F  F28  1  0.774  0.517  0.177  1.0
  F  F29  1  0.726  0.017  0.677  1.0
  F  F30  1  0.505  0.234  0.971  1.0
  F  F31  1  0.995  0.734  0.471  1.0
  F  F32  1  0.495  0.766  0.029  1.0
  F  F33  1  0.005  0.266  0.529  1.0
[/CIF]
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