# Electronic Supplementary Material (ESI) for Chemical Communications.
# This journal is © The Royal Society of Chemistry 2019

####################################################################### 
# 
# 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_a
_database_code_depnum_ccdc_archive 'CCDC 1920897'
loop_
_audit_author_name
_audit_author_address
'Dr Sukhen Bala'
;Post Doc
China
;
_audit_update_record             
;
2019-06-05 deposited with the CCDC.	2019-07-24 downloaded from the CCDC.
;
_audit_creation_date             2019-06-04
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ? 
;
_chemical_formula_moiety         'C64 H58 Dy N4 O4 P2, C24 H20 B'
_chemical_formula_sum            'C88 H78 B Dy N4 O4 P2'
_chemical_formula_weight         1490.79
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 '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'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, y, -z+1/2'
3 'x+1/2, y+1/2, z'
4 '-x+1/2, y+1/2, -z+1/2'
5 '-x, -y, -z'
6 'x, -y, z-1/2'
7 '-x+1/2, -y+1/2, -z'
8 'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   20.8027(9)
_cell_length_b                   19.3411(9)
_cell_length_c                   18.5062(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 106.428(2)
_cell_angle_gamma                90.00
_cell_volume                     7141.9(5)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9914
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      27.49
_cell_measurement_theta_min      2.47
_exptl_absorpt_coefficient_mu    1.148
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.6181
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'SADABS-2014/5 (Bruker,2014/5) was used for absorption correction. wR2(int) was 0.0979 before and 0.0508 after correction. The Ratio of minimum to maximum transmission is 0.8290. The λ/2 correction factor is Not present.'
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.386
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             3068
_exptl_crystal_size_max          0.235
_exptl_crystal_size_mid          0.211
_exptl_crystal_size_min          0.162
_exptl_special_details           
;
 ? 
;
_diffrn_reflns_av_R_equivalents  0.0349
_diffrn_reflns_av_unetI/netI     0.0416
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            24156
_diffrn_reflns_theta_full        27.53
_diffrn_reflns_theta_max         27.53
_diffrn_reflns_theta_min         2.03
_diffrn_ambient_temperature      120.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker D8 QUEST'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  'mirror optics'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'I\mS microfocus'
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         0
_reflns_number_gt                6891
_reflns_number_total             8112
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         1.475
_refine_diff_density_min         -1.480
_refine_diff_density_rms         0.114
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.064
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     452
_refine_ls_number_reflns         8112
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0654
_refine_ls_R_factor_gt           0.0497
_refine_ls_restrained_S_all      1.064
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0000P)²+84.5710P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1020
_refine_ls_wR_factor_ref         0.1106
_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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C8(H8A,H8B), C7(H7A,H7B), C9(H9A,H9B)
2.b Aromatic/amide H refined with riding coordinates:
 C28(H28), C20(H20), C38(H38), C41(H41), C32(H32), C34(H34), C11(H11),
 C40(H40), C44(H44), C19(H19), C35(H35), C12(H12), C43(H43), C18(H18), C36(H36),
  C22(H22), C42(H42), C13(H13), C37(H37), C29(H29), C14(H14), C16(H16), C5(H5),
 C31(H31), C3(H3), C17(H17), C26(H26), C2(H2), C30(H30), C23(H23), C4(H4),
 C25(H25), C24(H24)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_site_symmetry_order
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Dy1 Dy 1.0000 0.353116(14) 0.7500 0.02183(8) Uani 1 d . . 2 S T P
P1 P 0.86580(5) 0.21695(5) 0.72618(6) 0.0173(2) Uani 1 d . . 1 . . .
O1 O 0.92943(14) 0.25778(15) 0.74510(17) 0.0266(7) Uani 1 d . . 1 . . .
O2 O 0.97290(14) 0.33490(15) 0.62727(16) 0.0253(6) Uani 1 d . . 1 . . .
N1 N 0.94282(17) 0.46870(17) 0.67974(19) 0.0215(7) Uani 1 d . . 1 . . .
N2 N 0.89374(17) 0.39983(17) 0.78097(19) 0.0212(7) Uani 1 d . . 1 . . .
C28 C 0.8142(2) 0.1043(2) 0.6334(2) 0.0224(8) Uani 1 d . . 1 . . .
H28 H 0.7716 0.1171 0.6383 0.027 Uiso 1 calc . . 1 R . .
C27 C 0.87089(19) 0.1433(2) 0.6686(2) 0.0188(7) Uani 1 d . . 1 . . .
C20 C 0.7390(2) 0.2830(2) 0.6943(2) 0.0220(8) Uani 1 d . . 1 . . .
H20 H 0.7353 0.2684 0.7420 0.026 Uiso 1 calc . . 1 R . .
C33 C 0.5554(2) 0.2868(2) 0.8074(2) 0.0238(9) Uani 1 d . . 1 . . .
C38 C 0.6251(2) 0.2949(2) 0.8258(2) 0.0273(9) Uani 1 d . . 1 . . .
H38 H 0.6431 0.3297 0.8010 0.033 Uiso 1 calc . . 1 R . .
C41 C 0.3942(2) 0.4870(2) 0.8060(2) 0.0247(9) Uani 1 d . . 1 . . .
H41 H 0.3639 0.5215 0.7800 0.030 Uiso 1 calc . . 1 R . .
C15 C 0.79508(19) 0.2655(2) 0.6716(2) 0.0197(8) Uani 1 d . . 1 . . .
C32 C 0.9325(2) 0.1247(2) 0.6605(2) 0.0281(10) Uani 1 d . . 1 . . .
H32 H 0.9711 0.1516 0.6836 0.034 Uiso 1 calc . . 1 R . .
C39 C 0.46642(18) 0.3881(2) 0.8005(2) 0.0172(8) Uani 1 d . . 1 . . .
C34 C 0.5325(2) 0.2335(2) 0.8459(2) 0.0280(9) Uani 1 d . . 1 . . .
H34 H 0.4857 0.2252 0.8340 0.034 Uiso 1 calc . . 1 R . .
C8 C 0.9626(2) 0.5299(2) 0.7306(2) 0.0240(9) Uani 1 d . . 1 . . .
H8A H 0.9378 0.5291 0.7690 0.029 Uiso 1 calc . . 1 R . .
H8B H 0.9503 0.5729 0.7007 0.029 Uiso 1 calc . . 1 R . .
C11 C 0.7873(2) 0.4552(2) 0.7389(2) 0.0258(9) Uani 1 d . . 1 . . .
H11 H 0.7566 0.4824 0.7020 0.031 Uiso 1 calc . . 1 R . .
C40 C 0.4225(2) 0.4414(2) 0.7658(2) 0.0219(8) Uani 1 d . . 1 . . .
H40 H 0.4117 0.4463 0.7127 0.026 Uiso 1 calc . . 1 R . .
C21 C 0.8497(2) 0.1863(2) 0.8113(2) 0.0231(9) Uani 1 d . . 1 . . .
C44 C 0.4815(2) 0.3857(2) 0.8792(2) 0.0213(8) Uani 1 d . . 1 . . .
H44 H 0.5116 0.3512 0.9056 0.026 Uiso 1 calc . . 1 R . .
C19 C 0.6880(2) 0.3222(2) 0.6466(2) 0.0268(9) Uani 1 d . . 1 . . .
H19 H 0.6494 0.3342 0.6616 0.032 Uiso 1 calc . . 1 R . .
C35 C 0.5758(3) 0.1925(2) 0.9006(3) 0.0348(11) Uani 1 d . . 1 . . .
H35 H 0.5583 0.1581 0.9264 0.042 Uiso 1 calc . . 1 R . .
C12 C 0.7704(2) 0.4324(2) 0.8024(3) 0.0297(10) Uani 1 d . . 1 . . .
H12 H 0.7280 0.4432 0.8093 0.036 Uiso 1 calc . . 1 R . .
C43 C 0.4543(2) 0.4318(2) 0.9204(2) 0.0246(9) Uani 1 d . . 1 . . .
H43 H 0.4665 0.4285 0.9737 0.030 Uiso 1 calc . . 1 R . .
C18 C 0.6939(2) 0.3437(2) 0.5769(2) 0.0277(9) Uani 1 d . . 1 . . .
H18 H 0.6592 0.3705 0.5446 0.033 Uiso 1 calc . . 1 R . .
C36 C 0.6444(3) 0.2024(3) 0.9169(3) 0.0381(12) Uani 1 d . . 1 . . .
H36 H 0.6743 0.1745 0.9537 0.046 Uiso 1 calc . . 1 R . .
C22 C 0.7936(2) 0.1473(2) 0.8121(3) 0.0299(9) Uani 1 d . . 1 . . .
H22 H 0.7617 0.1353 0.7660 0.036 Uiso 1 calc . . 1 R . .
C10 C 0.8490(2) 0.4381(2) 0.7301(2) 0.0227(8) Uani 1 d . . 1 . . .
C7 C 0.9625(2) 0.4822(2) 0.6093(2) 0.0246(9) Uani 1 d . . 1 . . .
H7A H 1.0120 0.4824 0.6221 0.029 Uiso 1 calc . . 1 R . .
H7B H 0.9467 0.5290 0.5908 0.029 Uiso 1 calc . . 1 R . .
C42 C 0.4098(2) 0.4824(2) 0.8841(3) 0.0253(9) Uani 1 d . . 1 . . .
H42 H 0.3903 0.5133 0.9119 0.030 Uiso 1 calc . . 1 R . .
C13 C 0.8164(2) 0.3938(2) 0.8553(2) 0.0282(9) Uani 1 d . . 1 . . .
H13 H 0.8064 0.3778 0.8994 0.034 Uiso 1 calc . . 1 R . .
C37 C 0.6691(3) 0.2532(3) 0.8794(3) 0.0366(11) Uani 1 d . . 1 . . .
H37 H 0.7162 0.2598 0.8901 0.044 Uiso 1 calc . . 1 R . .
C29 C 0.8204(3) 0.0463(2) 0.5911(2) 0.0324(11) Uani 1 d . . 1 . . .
H29 H 0.7819 0.0198 0.5669 0.039 Uiso 1 calc . . 1 R . .
C14 C 0.8772(2) 0.3788(2) 0.8428(2) 0.0242(9) Uani 1 d . . 1 . . .
H14 H 0.9090 0.3525 0.8795 0.029 Uiso 1 calc . . 1 R . .
C9 C 0.8699(2) 0.4600(2) 0.6620(2) 0.0253(9) Uani 1 d . . 1 . . .
H9A H 0.8550 0.4248 0.6219 0.030 Uiso 1 calc . . 1 R . .
H9B H 0.8476 0.5042 0.6427 0.030 Uiso 1 calc . . 1 R . .
C16 C 0.8000(2) 0.2871(2) 0.6011(2) 0.0247(9) Uani 1 d . . 1 . . .
H16 H 0.8382 0.2747 0.5854 0.030 Uiso 1 calc . . 1 R . .
C1 C 0.94526(18) 0.3588(2) 0.5591(2) 0.0203(8) Uani 1 d . . 1 . . .
C5 C 0.9045(2) 0.4555(2) 0.4739(2) 0.0288(10) Uani 1 d . . 1 . . .
H5 H 0.8980 0.5038 0.4661 0.035 Uiso 1 calc . . 1 R . .
C31 C 0.9380(3) 0.0663(3) 0.6183(2) 0.0388(12) Uani 1 d . . 1 . . .
H31 H 0.9805 0.0532 0.6130 0.047 Uiso 1 calc . . 1 R . .
B1 B 0.5000 0.3369(3) 0.7500 0.0198(13) Uani 1 d . . 2 S T P
C6 C 0.9358(2) 0.4313(2) 0.5462(2) 0.0223(8) Uani 1 d . . 1 . . .
C3 C 0.8929(2) 0.3411(3) 0.4250(2) 0.0325(11) Uani 1 d . . 1 . . .
H3 H 0.8789 0.3103 0.3835 0.039 Uiso 1 calc . . 1 R . .
C17 C 0.7498(2) 0.3264(2) 0.5544(2) 0.0308(10) Uani 1 d . . 1 . . .
H17 H 0.7536 0.3415 0.5069 0.037 Uiso 1 calc . . 1 R . .
C26 C 0.8971(3) 0.2027(2) 0.8790(3) 0.0363(12) Uani 1 d . . 1 . . .
H26 H 0.9362 0.2281 0.8793 0.044 Uiso 1 calc . . 1 R . .
C2 C 0.9234(2) 0.3149(2) 0.4965(2) 0.0253(9) Uani 1 d . . 1 . . .
H2 H 0.9294 0.2664 0.5031 0.030 Uiso 1 calc . . 1 R . .
C30 C 0.8823(3) 0.0277(3) 0.5844(2) 0.0401(13) Uani 1 d . . 1 . . .
H30 H 0.8864 -0.0121 0.5561 0.048 Uiso 1 calc . . 1 R . .
C23 C 0.7840(3) 0.1256(3) 0.8801(3) 0.0467(15) Uani 1 d . . 1 . . .
H23 H 0.7457 0.0989 0.8802 0.056 Uiso 1 calc . . 1 R . .
C4 C 0.8828(2) 0.4116(3) 0.4134(2) 0.0338(11) Uani 1 d . . 1 . . .
H4 H 0.8613 0.4292 0.3647 0.041 Uiso 1 calc . . 1 R . .
C25 C 0.8859(4) 0.1809(3) 0.9469(3) 0.0545(18) Uani 1 d . . 1 . . .
H25 H 0.9174 0.1926 0.9934 0.065 Uiso 1 calc . . 1 R . .
C24 C 0.8300(4) 0.1431(3) 0.9471(3) 0.0573(18) Uani 1 d . . 1 . . .
H24 H 0.8232 0.1289 0.9935 0.069 Uiso 1 calc . . 1 R . .


_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
Dy1 O1 2.343(3) 2_756 ?
Dy1 O1 2.343(3) . ?
Dy1 O2 2.208(3) 2_756 ?
Dy1 O2 2.208(3) . ?
Dy1 N1 2.689(3) . ?
Dy1 N1 2.689(3) 2_756 ?
Dy1 N2 2.598(3) . ?
Dy1 N2 2.598(3) 2_756 ?
P1 O1 1.495(3) . ?
P1 C27 1.799(4) . ?
P1 C15 1.796(4) . ?
P1 C21 1.801(4) . ?
O2 C1 1.313(5) . ?
N1 C8 1.495(5) . ?
N1 C7 1.495(5) . ?
N1 C9 1.468(5) . ?
N2 C10 1.343(5) . ?
N2 C14 1.347(5) . ?
C28 C27 1.397(6) . ?
C28 C29 1.393(6) . ?
C27 C32 1.380(6) . ?
C20 C15 1.389(6) . ?
C20 C19 1.396(6) . ?
C33 C38 1.401(6) . ?
C33 C34 1.410(6) . ?
C33 B1 1.644(5) . ?
C38 C37 1.399(6) . ?
C41 C40 1.387(6) . ?
C41 C42 1.393(6) . ?
C15 C16 1.401(6) . ?
C32 C31 1.397(7) . ?
C39 C40 1.406(5) . ?
C39 C44 1.402(5) . ?
C39 B1 1.647(5) . ?
C34 C35 1.396(6) . ?
C8 C8 1.519(8) 2_756 ?
C11 C12 1.390(6) . ?
C11 C10 1.380(6) . ?
C21 C22 1.392(6) . ?
C21 C26 1.395(6) . ?
C44 C43 1.392(6) . ?
C19 C18 1.393(6) . ?
C35 C36 1.386(7) . ?
C12 C13 1.378(6) . ?
C43 C42 1.384(6) . ?
C18 C17 1.382(6) . ?
C36 C37 1.384(7) . ?
C22 C23 1.394(6) . ?
C10 C9 1.506(6) . ?
C7 C6 1.509(6) . ?
C13 C14 1.380(6) . ?
C29 C30 1.375(7) . ?
C16 C17 1.381(6) . ?
C1 C6 1.425(6) . ?
C1 C2 1.405(6) . ?
C5 C6 1.394(6) . ?
C5 C4 1.376(7) . ?
C31 C30 1.373(8) . ?
B1 C33 1.644(5) 2_656 ?
B1 C39 1.647(5) 2_656 ?
C3 C2 1.391(6) . ?
C3 C4 1.386(7) . ?
C26 C25 1.406(8) . ?
C23 C24 1.377(9) . ?
C25 C24 1.374(9) . ?

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
O1 Dy1 O1 76.17(14) . 2_756 ?
O1 Dy1 N1 116.68(10) 2_756 2_756 ?
O1 Dy1 N1 149.30(11) 2_756 . ?
O1 Dy1 N1 149.30(11) . 2_756 ?
O1 Dy1 N1 116.68(10) . . ?
O1 Dy1 N2 73.69(11) . . ?
O1 Dy1 N2 145.92(11) . 2_756 ?
O1 Dy1 N2 145.92(11) 2_756 . ?
O1 Dy1 N2 73.69(11) 2_756 2_756 ?
O2 Dy1 O1 81.94(11) . . ?
O2 Dy1 O1 81.94(11) 2_756 2_756 ?
O2 Dy1 O1 83.63(10) 2_756 . ?
O2 Dy1 O1 83.63(10) . 2_756 ?
O2 Dy1 O2 161.64(15) . 2_756 ?
O2 Dy1 N1 125.41(10) 2_756 . ?
O2 Dy1 N1 71.69(10) 2_756 2_756 ?
O2 Dy1 N1 71.69(10) . . ?
O2 Dy1 N1 125.41(11) . 2_756 ?
O2 Dy1 N2 107.27(10) . . ?
O2 Dy1 N2 79.29(11) . 2_756 ?
O2 Dy1 N2 107.27(10) 2_756 2_756 ?
O2 Dy1 N2 79.29(11) 2_756 . ?
N1 Dy1 N1 67.49(14) 2_756 . ?
N2 Dy1 N1 83.79(10) 2_756 . ?
N2 Dy1 N1 61.95(10) . . ?
N2 Dy1 N1 61.95(10) 2_756 2_756 ?
N2 Dy1 N1 83.79(10) . 2_756 ?
N2 Dy1 N2 139.29(15) . 2_756 ?
O1 P1 C27 111.11(18) . . ?
O1 P1 C15 112.68(18) . . ?
O1 P1 C21 109.92(19) . . ?
C27 P1 C21 108.27(18) . . ?
C15 P1 C27 104.89(18) . . ?
C15 P1 C21 109.78(19) . . ?
P1 O1 Dy1 158.16(18) . . ?
C1 O2 Dy1 147.8(3) . . ?
C8 N1 Dy1 110.4(2) . . ?
C7 N1 Dy1 112.0(2) . . ?
C7 N1 C8 108.4(3) . . ?
C9 N1 Dy1 107.5(2) . . ?
C9 N1 C8 108.3(3) . . ?
C9 N1 C7 110.2(3) . . ?
C10 N2 Dy1 120.1(3) . . ?
C10 N2 C14 118.0(4) . . ?
C14 N2 Dy1 121.3(3) . . ?
C29 C28 C27 119.9(4) . . ?
C28 C27 P1 121.4(3) . . ?
C32 C27 P1 118.9(3) . . ?
C32 C27 C28 119.6(4) . . ?
C15 C20 C19 119.6(4) . . ?
C38 C33 C34 115.7(4) . . ?
C38 C33 B1 125.4(4) . . ?
C34 C33 B1 118.8(4) . . ?
C37 C38 C33 122.2(4) . . ?
C40 C41 C42 120.4(4) . . ?
C20 C15 P1 125.6(3) . . ?
C20 C15 C16 119.9(4) . . ?
C16 C15 P1 114.5(3) . . ?
C27 C32 C31 119.9(4) . . ?
C40 C39 B1 120.5(3) . . ?
C44 C39 C40 115.1(4) . . ?
C44 C39 B1 124.3(3) . . ?
C35 C34 C33 122.7(4) . . ?
N1 C8 C8 111.1(3) . 2_756 ?
C10 C11 C12 119.3(4) . . ?
C41 C40 C39 122.8(4) . . ?
C22 C21 P1 123.5(3) . . ?
C22 C21 C26 119.6(4) . . ?
C26 C21 P1 116.9(4) . . ?
C43 C44 C39 122.7(4) . . ?
C18 C19 C20 119.9(4) . . ?
C36 C35 C34 119.6(4) . . ?
C13 C12 C11 118.8(4) . . ?
C42 C43 C44 120.6(4) . . ?
C17 C18 C19 120.6(4) . . ?
C37 C36 C35 119.6(4) . . ?
C21 C22 C23 120.5(5) . . ?
N2 C10 C11 122.2(4) . . ?
N2 C10 C9 115.8(4) . . ?
C11 C10 C9 122.0(4) . . ?
N1 C7 C6 115.4(3) . . ?
C43 C42 C41 118.3(4) . . ?
C12 C13 C14 118.7(4) . . ?
C36 C37 C38 120.2(5) . . ?
C30 C29 C28 119.9(4) . . ?
N2 C14 C13 123.0(4) . . ?
N1 C9 C10 111.7(3) . . ?
C17 C16 C15 120.4(4) . . ?
O2 C1 C6 120.6(4) . . ?
O2 C1 C2 122.0(4) . . ?
C2 C1 C6 117.3(4) . . ?
C4 C5 C6 122.0(4) . . ?
C30 C31 C32 120.1(4) . . ?
C33 B1 C33 107.8(5) 2_656 . ?
C33 B1 C39 112.9(2) 2_656 . ?
C33 B1 C39 108.64(19) . . ?
C33 B1 C39 108.64(19) 2_656 2_656 ?
C33 B1 C39 112.9(2) . 2_656 ?
C39 B1 C39 106.1(4) . 2_656 ?
C1 C6 C7 120.6(4) . . ?
C5 C6 C7 119.5(4) . . ?
C5 C6 C1 119.7(4) . . ?
C4 C3 C2 120.9(4) . . ?
C16 C17 C18 119.7(4) . . ?
C21 C26 C25 118.8(5) . . ?
C3 C2 C1 121.3(4) . . ?
C31 C30 C29 120.6(4) . . ?
C24 C23 C22 119.9(6) . . ?
C5 C4 C3 118.8(4) . . ?
C24 C25 C26 121.0(5) . . ?
C25 C24 C23 120.1(5) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
