# Supplementary Information (SI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_300k
_database_code_depnum_ccdc_archive 'CCDC 2371295'
loop_
_audit_author_name
_audit_author_address
'Oksana Sologub'
;TU Wien
Austria
;
_audit_update_record             
;
2024-07-16 deposited with the CCDC.	2024-08-27 downloaded from the CCDC.
;

_audit_creation_date             2024-07-15T16:38:46-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.2
_audit_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic

#----------------------------------------------------------------------------#
#                   CHEMICAL INFORMATION                                     #
#----------------------------------------------------------------------------#

_chemical_name_systematic        
;
 ?
;
_chemical_formula_sum            'B2.46 Ir2'
_chemical_formula_weight         410.99

#----------------------------------------------------------------------------#
#                   UNIT CELL INFORMATION                                    #
#----------------------------------------------------------------------------#

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'C 2/M'
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_Int_Tables_number      12

loop_
_symmetry_equiv_pos_as_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'

_cell_length_a                   10.5515(11)
_cell_length_b                   2.8842(3)
_cell_length_c                   6.0965(7)
_cell_angle_alpha                90
_cell_angle_beta                 91.121(9)
_cell_angle_gamma                90
_cell_volume                     185.50(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_wavelength     0.71073
_cell_measurement_reflns_used    3391
_cell_measurement_theta_min      3.34
_cell_measurement_theta_max      34.42

#----------------------------------------------------------------------------#
#                   CRYSTAL INFORMATION                                      #
#----------------------------------------------------------------------------#

_exptl_crystal_description       prism
_exptl_crystal_colour            silver
_exptl_crystal_size_max          0.05
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.05
_exptl_crystal_density_diffrn    14.717
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             665
_exptl_special_details           
;
 ?
;

#----------------------------------------------------------------------------#
#                   ABSORPTION CORRECTION                                    #
#----------------------------------------------------------------------------#

_exptl_absorpt_coefficient_mu    142.787
_exptl_absorpt_correction_type   none

#----------------------------------------------------------------------------#
#                   DATA COLLECTION                                          #
#----------------------------------------------------------------------------#

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX II CCD area-detector'
_diffrn_reflns_av_R_equivalents  0.0578
_diffrn_reflns_av_unetI/netI     0.0225
_diffrn_reflns_number            3391
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -4
_diffrn_reflns_limit_k_max       4
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_limit_l_max       9
_diffrn_reflns_theta_min         3.34
_diffrn_reflns_theta_max         34.42
_diffrn_reflns_theta_full        34.42
_diffrn_measured_fraction_theta_full 0.967
_diffrn_measured_fraction_theta_max 0.967
_reflns_number_total             445
_reflns_number_gt                417
_reflns_threshold_expression     >2sigma(I)

#----------------------------------------------------------------------------#
#                   COMPUTER PROGRAMS USED                                   #
#----------------------------------------------------------------------------#

_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'

#----------------------------------------------------------------------------#
#                   REFINEMENT INFORMATION                                   #
#----------------------------------------------------------------------------#

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0539P)²+26.8920P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   none
_refine_ls_hydrogen_treatment    none
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_coef       0.0012(4)
_refine_ls_number_reflns         445
_refine_ls_number_parameters     21
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0395
_refine_ls_R_factor_gt           0.0372
_refine_ls_wR_factor_ref         0.1019
_refine_ls_wR_factor_gt          0.1003
_refine_ls_goodness_of_fit_ref   1.202
_refine_ls_restrained_S_all      1.202
_refine_ls_shift/su_max          0
_refine_ls_shift/su_mean         0
_refine_diff_density_max         3.867
_refine_diff_density_min         -3.752
_refine_diff_density_rms         1.081

#----------------------------------------------------------------------------#
#                   ATOMIC TYPES, COORDINATES AND THERMAL PARAMETERS         #
#----------------------------------------------------------------------------#

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ir Ir -1.4442 7.9887 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ir1 Ir 0.09953(6) 0 0.13822(10) 0.0097(2) Uani 1 2 d S . .
Ir2 Ir 0.35744(6) 0 0.28831(10) 0.0094(2) Uani 1 2 d S . .
B1 B 0.179(2) 0 0.459(3) 0.011(2) Uiso 1 2 d S . .
B2 B 0.560(2) 0 0.383(3) 0.011(2) Uiso 1 2 d S . .
B3 B 0.740(4) 0 0.0565 0.011(2) Uiso 0.46(7) 2 d SP . .



#----------------------------------------------------------------------------#
#                   MOLECULAR GEOMETRY                                       #
#----------------------------------------------------------------------------#

_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ir1 B3 2.08(4) 5_655 ?
Ir1 B1 2.11(2) . ?
Ir1 B2 2.120(15) 3_455 ?
Ir1 B2 2.120(15) 3_445 ?
Ir1 B3 2.14(3) 3_455 ?
Ir1 B3 2.14(3) 3_445 ?
Ir1 Ir1 2.6671(12) 5 ?
Ir1 Ir2 2.8541(9) . ?
Ir1 Ir1 2.8842(3) 1_545 ?
Ir1 Ir1 2.8842(3) 1_565 ?
Ir1 Ir2 3.0155(8) 7_545 ?
Ir1 Ir2 3.0155(8) 7 ?
Ir2 B1 2.150(15) 7_556 ?
Ir2 B1 2.150(15) 7_546 ?
Ir2 B2 2.17(2) 5_656 ?
Ir2 B1 2.17(2) . ?
Ir2 B2 2.21(2) . ?
Ir2 B3 2.324(19) 5_655 ?
Ir2 B3 2.35(2) 3_445 ?
Ir2 B3 2.35(2) 3_455 ?
Ir2 Ir2 2.8842(3) 1_545 ?
Ir2 Ir2 2.8842(3) 1_565 ?
Ir2 Ir1 3.0155(8) 7_545 ?
B1 B2 1.96(2) 3_445 ?
B1 B2 1.96(2) 3_455 ?
B1 B1 2.13(3) 7_556 ?
B1 B1 2.13(3) 7_546 ?
B1 Ir2 2.150(15) 7_556 ?
B1 Ir2 2.150(15) 7_546 ?
B2 B2 1.93(4) 5_656 ?
B2 B1 1.96(2) 3 ?
B2 B1 1.96(2) 3_545 ?
B2 Ir1 2.120(15) 3_545 ?
B2 Ir1 2.120(15) 3 ?
B2 Ir2 2.17(2) 5_656 ?
B3 B3 1.613(12) 7_645 ?
B3 B3 1.613(12) 7_655 ?
B3 Ir1 2.08(4) 5_655 ?
B3 Ir1 2.14(3) 3_545 ?
B3 Ir1 2.14(3) 3 ?
B3 Ir2 2.324(19) 5_655 ?
B3 Ir2 2.35(2) 3 ?
B3 Ir2 2.35(2) 3_545 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
B3 Ir1 B1 102.5(9) 5_655 . ?
B3 Ir1 B2 124.9(7) 5_655 3_455 ?
B1 Ir1 B2 55.1(6) . 3_455 ?
B3 Ir1 B2 124.9(6) 5_655 3_445 ?
B1 Ir1 B2 55.1(6) . 3_445 ?
B2 Ir1 B2 85.7(7) 3_455 3_445 ?
B3 Ir1 B3 44.9(3) 5_655 3_455 ?
B1 Ir1 B3 87.2(6) . 3_455 ?
B2 Ir1 B3 81.4(6) 3_455 3_455 ?
B2 Ir1 B3 140.3(8) 3_445 3_455 ?
B3 Ir1 B3 44.9(3) 5_655 3_445 ?
B1 Ir1 B3 87.2(6) . 3_445 ?
B2 Ir1 B3 140.3(8) 3_455 3_445 ?
B2 Ir1 B3 81.4(6) 3_445 3_445 ?
B3 Ir1 B3 84.9(15) 3_455 3_445 ?
B3 Ir1 Ir1 106.1(7) 5_655 5 ?
B1 Ir1 Ir1 151.4(6) . 5 ?
B2 Ir1 Ir1 106.4(6) 3_455 5 ?
B2 Ir1 Ir1 106.4(6) 3_445 5 ?
B3 Ir1 Ir1 113.3(6) 3_455 5 ?
B3 Ir1 Ir1 113.3(6) 3_445 5 ?
B3 Ir1 Ir2 53.4(7) 5_655 . ?
B1 Ir1 Ir2 49.1(6) . . ?
B2 Ir1 Ir2 88.4(6) 3_455 . ?
B2 Ir1 Ir2 88.4(6) 3_445 . ?
B3 Ir1 Ir2 54.0(8) 3_455 . ?
B3 Ir1 Ir2 54.0(8) 3_445 . ?
Ir1 Ir1 Ir2 159.52(4) 5 . ?
B3 Ir1 Ir1 90 5_655 1_545 ?
B1 Ir1 Ir1 90 . 1_545 ?
B2 Ir1 Ir1 132.9(4) 3_455 1_545 ?
B2 Ir1 Ir1 47.1(4) 3_445 1_545 ?
B3 Ir1 Ir1 132.5(8) 3_455 1_545 ?
B3 Ir1 Ir1 47.5(8) 3_445 1_545 ?
Ir1 Ir1 Ir1 90 5 1_545 ?
Ir2 Ir1 Ir1 90 . 1_545 ?
B3 Ir1 Ir1 90 5_655 1_565 ?
B1 Ir1 Ir1 90 . 1_565 ?
B2 Ir1 Ir1 47.1(4) 3_455 1_565 ?
B2 Ir1 Ir1 132.9(4) 3_445 1_565 ?
B3 Ir1 Ir1 47.5(8) 3_455 1_565 ?
B3 Ir1 Ir1 132.5(8) 3_445 1_565 ?
Ir1 Ir1 Ir1 90 5 1_565 ?
Ir2 Ir1 Ir1 90 . 1_565 ?
Ir1 Ir1 Ir1 180.00(5) 1_545 1_565 ?
B3 Ir1 Ir2 51.0(5) 5_655 7_545 ?
B1 Ir1 Ir2 137.3(4) . 7_545 ?
B2 Ir1 Ir2 165.0(4) 3_455 7_545 ?
B2 Ir1 Ir2 108.4(4) 3_445 7_545 ?
B3 Ir1 Ir2 90.3(2) 3_455 7_545 ?
B3 Ir1 Ir2 50.1(4) 3_445 7_545 ?
Ir1 Ir1 Ir2 65.49(2) 5 7_545 ?
Ir2 Ir1 Ir2 96.76(2) . 7_545 ?
Ir1 Ir1 Ir2 61.431(9) 1_545 7_545 ?
Ir1 Ir1 Ir2 118.569(9) 1_565 7_545 ?
B3 Ir1 Ir2 51.0(5) 5_655 7 ?
B1 Ir1 Ir2 137.3(4) . 7 ?
B2 Ir1 Ir2 108.4(4) 3_455 7 ?
B2 Ir1 Ir2 165.0(4) 3_445 7 ?
B3 Ir1 Ir2 50.1(4) 3_455 7 ?
B3 Ir1 Ir2 90.3(2) 3_445 7 ?
Ir1 Ir1 Ir2 65.49(2) 5 7 ?
Ir2 Ir1 Ir2 96.76(2) . 7 ?
Ir1 Ir1 Ir2 118.569(9) 1_545 7 ?
Ir1 Ir1 Ir2 61.431(9) 1_565 7 ?
Ir2 Ir1 Ir2 57.139(17) 7_545 7 ?
B1 Ir2 B1 84.3(7) 7_556 7_546 ?
B1 Ir2 B2 53.9(6) 7_556 5_656 ?
B1 Ir2 B2 53.9(6) 7_546 5_656 ?
B1 Ir2 B1 59.2(7) 7_556 . ?
B1 Ir2 B1 59.2(7) 7_546 . ?
B2 Ir2 B1 83.8(8) 5_656 . ?
B1 Ir2 B2 89.9(7) 7_556 . ?
B1 Ir2 B2 89.9(7) 7_546 . ?
B2 Ir2 B2 52.4(10) 5_656 . ?
B1 Ir2 B2 136.2(7) . . ?
B1 Ir2 B3 124.5(8) 7_556 5_655 ?
B1 Ir2 B3 124.5(8) 7_546 5_655 ?
B2 Ir2 B3 177.2(11) 5_656 5_655 ?
B1 Ir2 B3 93.4(11) . 5_655 ?
B2 Ir2 B3 130.4(11) . 5_655 ?
B1 Ir2 B3 138.0(11) 7_556 3_445 ?
B1 Ir2 B3 85.4(5) 7_546 3_445 ?
B2 Ir2 B3 138.7(2) 5_656 3_445 ?
B1 Ir2 B3 80.6(10) . 3_445 ?
B2 Ir2 B3 130.7(9) . 3_445 ?
B3 Ir2 B3 40.3(3) 5_655 3_445 ?
B1 Ir2 B3 85.4(5) 7_556 3_455 ?
B1 Ir2 B3 138.0(11) 7_546 3_455 ?
B2 Ir2 B3 138.7(2) 5_656 3_455 ?
B1 Ir2 B3 80.6(10) . 3_455 ?
B2 Ir2 B3 130.7(9) . 3_455 ?
B3 Ir2 B3 40.3(3) 5_655 3_455 ?
B3 Ir2 B3 75.6(9) 3_445 3_455 ?
B1 Ir2 Ir1 92.7(6) 7_556 . ?
B1 Ir2 Ir1 92.7(6) 7_546 . ?
B2 Ir2 Ir1 131.1(5) 5_656 . ?
B1 Ir2 Ir1 47.3(5) . . ?
B2 Ir2 Ir1 176.4(5) . . ?
B3 Ir2 Ir1 46.1(10) 5_655 . ?
B3 Ir2 Ir1 47.2(9) 3_445 . ?
B3 Ir2 Ir1 47.2(9) 3_455 . ?
B1 Ir2 Ir2 132.1(4) 7_556 1_545 ?
B1 Ir2 Ir2 47.9(4) 7_546 1_545 ?
B2 Ir2 Ir2 90 5_656 1_545 ?
B1 Ir2 Ir2 90.0000(10) . 1_545 ?
B2 Ir2 Ir2 90 . 1_545 ?
B3 Ir2 Ir2 90.0000(10) 5_655 1_545 ?
B3 Ir2 Ir2 52.2(4) 3_445 1_545 ?
B3 Ir2 Ir2 127.8(4) 3_455 1_545 ?
Ir1 Ir2 Ir2 90 . 1_545 ?
B1 Ir2 Ir2 47.9(4) 7_556 1_565 ?
B1 Ir2 Ir2 132.1(4) 7_546 1_565 ?
B2 Ir2 Ir2 90 5_656 1_565 ?
B1 Ir2 Ir2 90.0000(10) . 1_565 ?
B2 Ir2 Ir2 90 . 1_565 ?
B3 Ir2 Ir2 90.0000(10) 5_655 1_565 ?
B3 Ir2 Ir2 127.8(4) 3_445 1_565 ?
B3 Ir2 Ir2 52.2(4) 3_455 1_565 ?
Ir1 Ir2 Ir2 90 . 1_565 ?
Ir2 Ir2 Ir2 180.00(2) 1_545 1_565 ?
B1 Ir2 Ir1 166.1(4) 7_556 7_545 ?
B1 Ir2 Ir1 109.2(4) 7_546 7_545 ?
B2 Ir2 Ir1 137.1(4) 5_656 7_545 ?
B1 Ir2 Ir1 124.1(4) . 7_545 ?
B2 Ir2 Ir1 93.6(5) . 7_545 ?
B3 Ir2 Ir1 44.9(7) 5_655 7_545 ?
B3 Ir2 Ir1 43.5(8) 3_445 7_545 ?
B3 Ir2 Ir1 82.0(3) 3_455 7_545 ?
Ir1 Ir2 Ir1 83.24(2) . 7_545 ?
Ir2 Ir2 Ir1 61.431(9) 1_545 7_545 ?
Ir2 Ir2 Ir1 118.569(9) 1_565 7_545 ?
B2 B1 B2 94.8(13) 3_445 3_455 ?
B2 B1 Ir1 62.6(8) 3_445 . ?
B2 B1 Ir1 62.6(8) 3_455 . ?
B2 B1 B1 174.9(14) 3_445 7_556 ?
B2 B1 B1 90.1(5) 3_455 7_556 ?
Ir1 B1 B1 118.7(12) . 7_556 ?
B2 B1 B1 90.1(5) 3_445 7_546 ?
B2 B1 B1 174.9(14) 3_455 7_546 ?
Ir1 B1 B1 118.7(12) . 7_546 ?
B1 B1 B1 85.0(15) 7_556 7_546 ?
B2 B1 Ir2 122.8(12) 3_445 7_556 ?
B2 B1 Ir2 63.6(7) 3_455 7_556 ?
Ir1 B1 Ir2 126.2(7) . 7_556 ?
B1 B1 Ir2 60.9(7) 7_556 7_556 ?
B1 B1 Ir2 114.8(14) 7_546 7_556 ?
B2 B1 Ir2 63.6(7) 3_445 7_546 ?
B2 B1 Ir2 122.8(12) 3_455 7_546 ?
Ir1 B1 Ir2 126.2(7) . 7_546 ?
B1 B1 Ir2 114.8(14) 7_556 7_546 ?
B1 B1 Ir2 60.9(7) 7_546 7_546 ?
Ir2 B1 Ir2 84.3(7) 7_556 7_546 ?
B2 B1 Ir2 116.2(10) 3_445 . ?
B2 B1 Ir2 116.2(10) 3_455 . ?
Ir1 B1 Ir2 83.6(7) . . ?
B1 B1 Ir2 59.9(10) 7_556 . ?
B1 B1 Ir2 59.9(10) 7_546 . ?
Ir2 B1 Ir2 120.8(7) 7_556 . ?
Ir2 B1 Ir2 120.8(7) 7_546 . ?
B2 B2 B1 104.5(13) 5_656 3 ?
B2 B2 B1 104.5(13) 5_656 3_545 ?
B1 B2 B1 94.8(13) 3 3_545 ?
B2 B2 Ir1 131.3(8) 5_656 3_545 ?
B1 B2 Ir1 122.4(12) 3 3_545 ?
B1 B2 Ir1 62.2(7) 3_545 3_545 ?
B2 B2 Ir1 131.3(8) 5_656 3 ?
B1 B2 Ir1 62.2(7) 3 3 ?
B1 B2 Ir1 122.4(12) 3_545 3 ?
Ir1 B2 Ir1 85.7(7) 3_545 3 ?
B2 B2 Ir2 64.7(11) 5_656 5_656 ?
B1 B2 Ir2 62.5(8) 3 5_656 ?
B1 B2 Ir2 62.5(8) 3_545 5_656 ?
Ir1 B2 Ir2 124.7(7) 3_545 5_656 ?
Ir1 B2 Ir2 124.7(7) 3 5_656 ?
B2 B2 Ir2 62.8(11) 5_656 . ?
B1 B2 Ir2 132.4(7) 3 . ?
B1 B2 Ir2 132.4(7) 3_545 . ?
Ir1 B2 Ir2 91.1(7) 3_545 . ?
Ir1 B2 Ir2 91.1(7) 3 . ?
Ir2 B2 Ir2 127.6(10) 5_656 . ?
B3 B3 B3 126.8(17) 7_645 7_655 ?
B3 B3 Ir1 69(2) 7_645 5_655 ?
B3 B3 Ir1 69(2) 7_655 5_655 ?
B3 B3 Ir1 66(2) 7_645 3_545 ?
B3 B3 Ir1 143(4) 7_655 3_545 ?
Ir1 B3 Ir1 135.1(3) 5_655 3_545 ?
B3 B3 Ir1 143(4) 7_645 3 ?
B3 B3 Ir1 66(2) 7_655 3 ?
Ir1 B3 Ir1 135.1(3) 5_655 3 ?
Ir1 B3 Ir1 84.9(15) 3_545 3 ?
B3 B3 Ir2 70.8(13) 7_645 5_655 ?
B3 B3 Ir2 70.8(13) 7_655 5_655 ?
Ir1 B3 Ir2 80.5(3) 5_655 5_655 ?
Ir1 B3 Ir2 85.0(12) 3_545 5_655 ?
Ir1 B3 Ir2 85.0(12) 3 5_655 ?
B3 B3 Ir2 137(4) 7_645 3 ?
B3 B3 Ir2 68.9(15) 7_655 3 ?
Ir1 B3 Ir2 85.4(14) 5_655 3 ?
Ir1 B3 Ir2 129.3(4) 3_545 3 ?
Ir1 B3 Ir2 78.79(10) 3 3 ?
Ir2 B3 Ir2 139.7(3) 5_655 3 ?
B3 B3 Ir2 68.9(15) 7_645 3_545 ?
B3 B3 Ir2 137(4) 7_655 3_545 ?
Ir1 B3 Ir2 85.4(14) 5_655 3_545 ?
Ir1 B3 Ir2 78.79(10) 3_545 3_545 ?
Ir1 B3 Ir2 129.3(4) 3 3_545 ?
Ir2 B3 Ir2 139.7(3) 5_655 3_545 ?
Ir2 B3 Ir2 75.6(9) 3 3_545 ?

