#------------------------------------------------------------------------------
#$Date: 2023-12-07 13:50:39 +0200 (Thu, 07 Dec 2023) $
#$Revision: 288142 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/02/29/2022928.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2022928
loop_
_publ_author_name
'Tokuda, Makoto'
'Yubuta, Kunio'
'Shishido, Toetsu'
'Sugiyama, Kazumasa'
_publ_section_title
;
 Redetermination of the crystal structure of yttrium chromium
 tetra-boride, YCrB₄, from single-crystal X-ray diffraction
 data.
;
_journal_coeditor_code           PK2696
_journal_issue                   'Pt 11'
_journal_name_full
'Acta crystallographica. Section E, Crystallographic communications'
_journal_page_first              1072
_journal_page_last               1075
_journal_paper_doi               10.1107/S2056989023008952
_journal_volume                  79
_journal_year                    2023
_chemical_compound_source        'synthesised by authors, see text'
_chemical_formula_iupac          'Y Cr B4'
_chemical_formula_moiety         'Y Cr B4'
_chemical_formula_sum            'B4 Cr Y'
_chemical_formula_weight         184.15
_chemical_name_systematic
;
Yttrium chromium tetraboride
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           55
_space_group_name_Hall           '-P 2 2ab'
_space_group_name_H-M_alt        'P b a m'
_audit_creation_method           'from SHELXL-97'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.9425(2)
_cell_length_b                   11.4831(4)
_cell_length_c                   3.46425(12)
_cell_measurement_reflns_used    6090
_cell_measurement_temperature    294(2)
_cell_measurement_theta_max      44.8740
_cell_measurement_theta_min      3.5260
_cell_volume                     236.395(14)
_computing_cell_refinement
;
CrysAlisPro (Rigaku OD, 2021)
;
_computing_data_collection
;
CrysAlisPro (Rigaku OD, 2021)
;
_computing_data_reduction
;
CrysAlisPro (Rigaku OD, 2021)
;
_computing_molecular_graphics
;
VESTA (Momma & Izumi, 2011)
;
_computing_structure_refinement
;
SHELXL (Sheldrick, 2015b)
;
_computing_structure_solution
;
SHELXT (Sheldrick, 2015a)
;
_diffrn_ambient_temperature      294(2)
_diffrn_detector                 'hybrid pixel array'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0355
_diffrn_reflns_av_unetI/netI     0.0156
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       6
_diffrn_reflns_limit_l_min       -6
_diffrn_reflns_number            13376
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         44.847
_diffrn_reflns_theta_min         3.549
_diffrn_source                   'micro-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    28.572
_exptl_absorpt_correction_T_max  0.655
_exptl_absorpt_correction_T_min  0.367
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details
;
(CrysAlisPro; Rigaku OD, 2021)
;
_exptl_crystal_colour            metallic
_exptl_crystal_density_diffrn    5.174
_exptl_crystal_description       block
_exptl_crystal_F_000             332
_exptl_crystal_size_max          0.051
_exptl_crystal_size_mid          0.032
_exptl_crystal_size_min          0.026
_refine_diff_density_max         0.583
_refine_diff_density_min         -0.706
_refine_ls_extinction_coef       0.0111(7)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method
;
SHELXL (Sheldrick, 2015b)
;
_refine_ls_goodness_of_fit_ref   1.114
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     38
_refine_ls_number_reflns         1074
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.114
_refine_ls_R_factor_all          0.0222
_refine_ls_R_factor_gt           0.0146
_refine_ls_shift/su_max          0.020
_refine_ls_shift/su_mean         0.003
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0074P)²+0.1807P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0280
_refine_ls_wR_factor_ref         0.0292
_reflns_number_gt                865
_reflns_number_total             1074
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            pk2696sup1.cif
_cod_data_source_block           I
_cod_depositor_comments          'Adding full bibliography for 2022928.cif.'
_cod_original_formula_sum        'Y Cr B4'
_cod_database_code               2022928
_cod_database_fobs_code          2022928
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'-x+1/2, y+1/2, -z'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x, y, -z'
'x-1/2, -y-1/2, z'
'-x-1/2, y-1/2, z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Y Y 0.12446(2) 0.15077(2) 0.000000 0.00285(3) Uani d 1 . .
Cr Cr 0.12421(4) 0.41902(2) 0.000000 0.00267(3) Uani d 1 . .
B B1 0.2818(3) 0.31614(15) 0.500000 0.0042(2) Uani d 1 . .
B B2 0.3630(4) 0.46779(13) 0.500000 0.0042(2) Uani d 1 . .
B B3 0.3869(4) 0.04697(12) 0.500000 0.0036(2) Uani d 1 . .
B B4 0.4746(3) 0.19170(13) 0.500000 0.0041(2) Uani d 1 . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cr Cr 0.3209 0.6236 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Y Y -2.7962 3.5667 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
B3 Y B3 . 1_554 82.86(6) ?
B3 Y B4 . 7_565 94.49(3) ?
B3 Y B4 1_554 7_565 160.16(5) ?
B3 Y B4 . 7_564 160.16(5) ?
B3 Y B4 1_554 7_564 94.49(3) ?
B4 Y B4 7_565 7_564 81.33(4) ?
B3 Y B2 . 7_564 122.58(4) ?
B3 Y B2 1_554 7_564 71.84(4) ?
B4 Y B2 7_565 7_564 124.69(6) ?
B4 Y B2 7_564 7_564 74.45(4) ?
B3 Y B2 . 7_565 71.84(4) ?
B3 Y B2 1_554 7_565 122.58(4) ?
B4 Y B2 7_565 7_565 74.45(4) ?
B4 Y B2 7_564 7_565 124.69(5) ?
B2 Y B2 7_564 7_565 79.96(5) ?
B3 Y B1 . 7_564 159.68(5) ?
B3 Y B1 1_554 7_564 95.10(4) ?
B4 Y B1 7_565 7_564 93.99(4) ?
B4 Y B1 7_564 7_564 39.96(4) ?
B2 Y B1 7_564 7_564 39.13(5) ?
B2 Y B1 7_565 7_564 92.78(5) ?
B3 Y B1 . 7_565 95.10(4) ?
B3 Y B1 1_554 7_565 159.68(5) ?
B4 Y B1 7_565 7_565 39.96(4) ?
B4 Y B1 7_564 7_565 93.99(4) ?
B2 Y B1 7_564 7_565 92.78(5) ?
B2 Y B1 7_565 7_565 39.13(5) ?
B1 Y B1 7_564 7_565 79.80(4) ?
B3 Y B2 . 3_545 93.05(4) ?
B3 Y B2 1_554 3_545 37.98(7) ?
B4 Y B2 7_565 3_545 161.52(6) ?
B4 Y B2 7_564 3_545 96.88(3) ?
B2 Y B2 7_564 3_545 38.53(9) ?
B2 Y B2 7_565 3_545 92.00(3) ?
B1 Y B2 7_564 3_545 73.82(5) ?
B1 Y B2 7_565 3_545 122.48(5) ?
B3 Y B2 . 3_546 37.98(7) ?
B3 Y B2 1_554 3_546 93.05(4) ?
B4 Y B2 7_565 3_546 96.88(3) ?
B4 Y B2 7_564 3_546 161.52(6) ?
B2 Y B2 7_564 3_546 92.00(3) ?
B2 Y B2 7_565 3_546 38.53(9) ?
B1 Y B2 7_564 3_546 122.48(5) ?
B1 Y B2 7_565 3_546 73.82(5) ?
B2 Y B2 3_545 3_546 78.97(4) ?
B3 Y B1 . . 72.15(4) ?
B3 Y B1 1_554 . 122.11(5) ?
B4 Y B1 7_565 . 39.59(4) ?
B4 Y B1 7_564 . 93.14(3) ?
B2 Y B1 7_564 . 162.65(5) ?
B2 Y B1 7_565 . 98.09(3) ?
B1 Y B1 7_564 . 124.49(3) ?
B1 Y B1 7_565 . 75.75(3) ?
B2 Y B1 3_545 . 158.26(6) ?
B2 Y B1 3_546 . 97.09(4) ?
B3 Y B1 . 1_554 122.11(5) ?
B3 Y B1 1_554 1_554 72.15(4) ?
B4 Y B1 7_565 1_554 93.14(3) ?
B4 Y B1 7_564 1_554 39.59(4) ?
B2 Y B1 7_564 1_554 98.09(3) ?
B2 Y B1 7_565 1_554 162.65(5) ?
B1 Y B1 7_564 1_554 75.75(3) ?
B1 Y B1 7_565 1_554 124.49(3) ?
B2 Y B1 3_545 1_554 97.09(4) ?
B2 Y B1 3_546 1_554 158.26(6) ?
B1 Y B1 . 1_554 78.59(4) ?
B3 Cr B3 7_564 7_565 99.61(9) ?
B3 Cr B3 7_564 3_556 116.93(3) ?
B3 Cr B3 7_565 3_556 44.63(10) ?
B3 Cr B3 7_564 3 44.63(10) ?
B3 Cr B3 7_565 3 116.93(3) ?
B3 Cr B3 3_556 3 99.33(5) ?
B3 Cr B1 7_564 1_554 76.47(5) ?
B3 Cr B1 7_565 1_554 156.70(6) ?
B3 Cr B1 3_556 1_554 156.85(7) ?
B3 Cr B1 3 1_554 76.67(5) ?
B3 Cr B1 7_564 . 156.70(6) ?
B3 Cr B1 7_565 . 76.47(5) ?
B3 Cr B1 3_556 . 76.67(5) ?
B3 Cr B1 3 . 156.85(7) ?
B1 Cr B1 1_554 . 97.94(6) ?
B3 Cr B2 7_564 1_554 76.55(4) ?
B3 Cr B2 7_565 1_554 156.04(5) ?
B3 Cr B2 3_556 1_554 115.66(5) ?
B3 Cr B2 3 1_554 44.67(8) ?
B1 Cr B2 1_554 1_554 46.21(5) ?
B1 Cr B2 . 1_554 116.12(6) ?
B3 Cr B2 7_564 . 156.04(5) ?
B3 Cr B2 7_565 . 76.55(4) ?
B3 Cr B2 3_556 . 44.67(8) ?
B3 Cr B2 3 . 115.66(5) ?
B1 Cr B2 1_554 . 116.12(6) ?
B1 Cr B2 . . 46.22(5) ?
B2 Cr B2 1_554 . 97.26(9) ?
B3 Cr B4 7_564 7_564 44.55(5) ?
B3 Cr B4 7_565 7_564 115.17(6) ?
B3 Cr B4 3_556 7_564 155.54(7) ?
B3 Cr B4 3 7_564 76.98(5) ?
B1 Cr B4 1_554 7_564 46.59(5) ?
B1 Cr B4 . 7_564 115.88(4) ?
B2 Cr B4 1_554 7_564 78.97(5) ?
B2 Cr B4 . 7_564 157.93(6) ?
B3 Cr B4 7_564 7_565 115.17(6) ?
B3 Cr B4 7_565 7_565 44.55(5) ?
B3 Cr B4 3_556 7_565 76.98(5) ?
B3 Cr B4 3 7_565 155.54(7) ?
B1 Cr B4 1_554 7_565 115.88(4) ?
B1 Cr B4 . 7_565 46.59(5) ?
B2 Cr B4 1_554 7_565 157.93(6) ?
B2 Cr B4 . 7_565 78.97(5) ?
B4 Cr B4 7_564 7_565 96.30(6) ?
B3 Cr Cr 7_564 5_565 58.56(3) ?
B3 Cr Cr 7_565 5_565 58.56(3) ?
B3 Cr Cr 3_556 5_565 58.37(4) ?
B3 Cr Cr 3 5_565 58.37(4) ?
B1 Cr Cr 1_554 5_565 131.03(3) ?
B1 Cr Cr . 5_565 131.03(3) ?
B2 Cr Cr 1_554 5_565 101.08(4) ?
B2 Cr Cr . 5_565 101.08(4) ?
B4 Cr Cr 7_564 5_565 100.98(4) ?
B4 Cr Cr 7_565 5_565 100.98(4) ?
B3 Cr Y 7_564 3 98.87(4) ?
B3 Cr Y 7_565 3 98.87(4) ?
B3 Cr Y 3_556 3 56.65(4) ?
B3 Cr Y 3 3 56.65(4) ?
B1 Cr Y 1_554 3 104.42(4) ?
B1 Cr Y . 3 104.42(4) ?
B2 Cr Y 1_554 3 59.17(4) ?
B2 Cr Y . 3 59.17(4) ?
B4 Cr Y 7_564 3 131.60(3) ?
B4 Cr Y 7_565 3 131.60(3) ?
Cr Cr Y 5_565 3 67.744(10) ?
B2 B1 B4 . 7_565 108.31(12) ?
B2 B1 B4 . . 125.79(12) ?
B4 B1 B4 7_565 . 125.90(10) ?
B2 B1 Cr . . 67.24(6) ?
B4 B1 Cr 7_565 . 67.55(5) ?
B4 B1 Cr . . 131.03(3) ?
B2 B1 Cr . 1_556 67.24(6) ?
B4 B1 Cr 7_565 1_556 67.55(5) ?
B4 B1 Cr . 1_556 131.03(3) ?
Cr B1 Cr . 1_556 97.93(6) ?
B2 B1 Y . 7_666 70.31(7) ?
B4 B1 Y 7_565 7_666 139.48(3) ?
B4 B1 Y . 7_666 68.78(5) ?
Cr B1 Y . 7_666 135.97(7) ?
Cr B1 Y 1_556 7_666 75.60(2) ?
B2 B1 Y . 7_665 70.31(7) ?
B4 B1 Y 7_565 7_665 139.48(3) ?
B4 B1 Y . 7_665 68.78(5) ?
Cr B1 Y . 7_665 75.60(2) ?
Cr B1 Y 1_556 7_665 135.97(7) ?
Y B1 Y 7_666 7_665 79.80(4) ?
B2 B1 Y . 1_556 139.50(3) ?
B4 B1 Y 7_565 1_556 67.94(6) ?
B4 B1 Y . 1_556 70.86(5) ?
Cr B1 Y . 1_556 134.07(6) ?
Cr B1 Y 1_556 1_556 74.94(2) ?
Y B1 Y 7_666 1_556 87.09(2) ?
Y B1 Y 7_665 1_556 139.62(6) ?
B2 B1 Y . . 139.50(3) ?
B4 B1 Y 7_565 . 67.94(6) ?
B4 B1 Y . . 70.86(5) ?
Cr B1 Y . . 74.94(2) ?
Cr B1 Y 1_556 . 134.07(6) ?
Y B1 Y 7_666 . 139.62(6) ?
Y B1 Y 7_665 . 87.09(2) ?
Y B1 Y 1_556 . 78.59(4) ?
B3 B2 B2 3_556 5_666 124.09(14) ?
B3 B2 B1 3_556 . 105.99(17) ?
B2 B2 B1 5_666 . 129.92(17) ?
B3 B2 Cr 3_556 . 66.58(9) ?
B2 B2 Cr 5_666 . 131.30(4) ?
B1 B2 Cr . . 66.55(6) ?
B3 B2 Cr 3_556 1_556 66.58(9) ?
B2 B2 Cr 5_666 1_556 131.30(4) ?
B1 B2 Cr . 1_556 66.55(6) ?
Cr B2 Cr . 1_556 97.26(9) ?
B3 B2 Y 3_556 7_666 139.05(5) ?
B2 B2 Y 5_666 7_666 71.58(9) ?
B1 B2 Y . 7_666 70.56(6) ?
Cr B2 Y . 7_666 135.56(6) ?
Cr B2 Y 1_556 7_666 75.50(2) ?
B3 B2 Y 3_556 7_665 139.05(5) ?
B2 B2 Y 5_666 7_665 71.58(9) ?
B1 B2 Y . 7_665 70.56(6) ?
Cr B2 Y . 7_665 75.50(2) ?
Cr B2 Y 1_556 7_665 135.56(6) ?
Y B2 Y 7_666 7_665 79.95(5) ?
B3 B2 Y 3_556 3_556 67.70(5) ?
B2 B2 Y 5_666 3_556 69.88(7) ?
B1 B2 Y . 3_556 138.64(4) ?
Cr B2 Y . 3_556 132.94(8) ?
Cr B2 Y 1_556 3_556 74.15(3) ?
Y B2 Y 7_666 3_556 88.01(3) ?
Y B2 Y 7_665 3_556 141.47(9) ?
B3 B2 Y 3_556 3 67.70(5) ?
B2 B2 Y 5_666 3 69.88(7) ?
B1 B2 Y . 3 138.64(4) ?
Cr B2 Y . 3 74.15(3) ?
Cr B2 Y 1_556 3 132.94(8) ?
Y B2 Y 7_666 3 141.47(9) ?
Y B2 Y 7_665 3 88.01(3) ?
Y B2 Y 3_556 3 78.97(4) ?
B3 B3 B2 5_656 3_546 109.78(13) ?
B3 B3 B4 5_656 . 111.32(18) ?
B2 B3 B4 3_546 . 138.90(18) ?
B3 B3 Cr 5_656 7_666 67.83(9) ?
B2 B3 Cr 3_546 7_666 128.34(4) ?
B4 B3 Cr . 7_666 69.48(6) ?
B3 B3 Cr 5_656 7_665 67.83(9) ?
B2 B3 Cr 3_546 7_665 128.34(4) ?
B4 B3 Cr . 7_665 69.48(6) ?
Cr B3 Cr 7_666 7_665 99.61(9) ?
B3 B3 Cr 5_656 3_545 67.54(6) ?
B2 B3 Cr 3_546 3_545 68.75(5) ?
B4 B3 Cr . 3_545 128.73(4) ?
Cr B3 Cr 7_666 3_545 135.37(10) ?
Cr B3 Cr 7_665 3_545 63.07(3) ?
B3 B3 Cr 5_656 3_546 67.54(6) ?
B2 B3 Cr 3_546 3_546 68.75(5) ?
B4 B3 Cr . 3_546 128.73(4) ?
Cr B3 Cr 7_666 3_546 63.07(3) ?
Cr B3 Cr 7_665 3_546 135.37(10) ?
Cr B3 Cr 3_545 3_546 99.33(5) ?
B3 B3 Y 5_656 . 138.55(3) ?
B2 B3 Y 3_546 . 74.33(10) ?
B4 B3 Y . . 75.16(6) ?
Cr B3 Y 7_666 . 142.90(6) ?
Cr B3 Y 7_665 . 77.682(19) ?
Cr B3 Y 3_545 . 76.87(3) ?
Cr B3 Y 3_546 . 141.41(10) ?
B3 B3 Y 5_656 1_556 138.55(3) ?
B2 B3 Y 3_546 1_556 74.33(10) ?
B4 B3 Y . 1_556 75.15(6) ?
Cr B3 Y 7_666 1_556 77.682(19) ?
Cr B3 Y 7_665 1_556 142.89(6) ?
Cr B3 Y 3_545 1_556 141.41(10) ?
Cr B3 Y 3_546 1_556 76.87(3) ?
Y B3 Y . 1_556 82.86(6) ?
B3 B4 B1 . 7_665 104.59(12) ?
B3 B4 B1 . . 123.87(12) ?
B1 B4 B1 7_665 . 131.54(10) ?
B3 B4 Cr . 7_665 65.97(6) ?
B1 B4 Cr 7_665 7_665 65.87(5) ?
B1 B4 Cr . 7_665 131.74(3) ?
B3 B4 Cr . 7_666 65.97(6) ?
B1 B4 Cr 7_665 7_666 65.87(5) ?
B1 B4 Cr . 7_666 131.74(3) ?
Cr B4 Cr 7_665 7_666 96.30(6) ?
B3 B4 Y . 7_666 138.56(3) ?
B1 B4 Y 7_665 7_666 72.47(6) ?
B1 B4 Y . 7_666 71.26(5) ?
Cr B4 Y 7_665 7_666 136.83(7) ?
Cr B4 Y 7_666 7_666 76.03(2) ?
B3 B4 Y . 7_665 138.56(3) ?
B1 B4 Y 7_665 7_665 72.47(6) ?
B1 B4 Y . 7_665 71.26(5) ?
Cr B4 Y 7_665 7_665 76.03(2) ?
Cr B4 Y 7_666 7_665 136.83(7) ?
Y B4 Y 7_666 7_665 81.33(4) ?
B3 B4 Y . 1_556 67.06(7) ?
B1 B4 Y 7_665 1_556 138.40(4) ?
B1 B4 Y . 1_556 70.11(5) ?
Cr B4 Y 7_665 1_556 131.73(6) ?
Cr B4 Y 7_666 1_556 74.13(2) ?
Y B4 Y 7_666 1_556 87.67(2) ?
Y B4 Y 7_665 1_556 141.34(6) ?
B3 B4 Y . . 67.06(7) ?
B1 B4 Y 7_665 . 138.40(4) ?
B1 B4 Y . . 70.11(5) ?
Cr B4 Y 7_665 . 74.13(2) ?
Cr B4 Y 7_666 . 131.73(6) ?
Y B4 Y 7_666 . 141.34(6) ?
Y B4 Y 7_665 . 87.67(2) ?
Y B4 Y 1_556 . 78.16(4) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Y B3 . 2.6177(16) ?
Y B3 1_554 2.6177(16) ?
Y B4 7_565 2.6582(11) ?
Y B4 7_564 2.6582(11) ?
Y B2 7_564 2.6959(15) ?
Y B2 7_565 2.6959(15) ?
Y B1 7_564 2.7003(12) ?
Y B1 7_565 2.7003(12) ?
Y B2 3_545 2.7241(11) ?
Y B2 3_546 2.7241(11) ?
Y B1 . 2.7350(13) ?
Y B1 1_554 2.7350(13) ?
Cr B3 7_564 2.2677(15) ?
Cr B3 7_565 2.2677(15) ?
Cr B3 3_556 2.2723(9) ?
Cr B3 3 2.2723(9) ?
Cr B1 1_554 2.2962(11) ?
Cr B1 . 2.2962(11) ?
Cr B2 1_554 2.3081(16) ?
Cr B2 . 2.3081(16) ?
Cr B4 7_564 2.3254(10) ?
Cr B4 7_565 2.3254(10) ?
Cr Cr 5_565 2.3745(4) ?
B1 B2 . 1.807(2) ?
B1 B4 7_565 1.828(2) ?
B1 B4 . 1.832(2) ?
B2 B3 3_556 1.741(4) ?
B2 B2 5_666 1.789(5) ?
B3 B3 5_656 1.724(4) ?
B3 B4 . 1.742(2) ?
