# Supplementary Information (SI) for Chemical Communications.
# This journal is © The Royal Society of Chemistry 2025

####################################################################### 
# 
# 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_KB1471_0m
_database_code_depnum_ccdc_archive 'CCDC 2422565'
loop_
_audit_author_name
_audit_author_address
'Balasubramanian Sridhar'
;CSIR Indian Institute of Chemical Technology
India
;
_audit_update_record             
;
2025-02-10 deposited with the CCDC.	2025-03-25 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2019/3
_shelx_SHELXL_version_number     2019/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C27 H26 N O3 P'
_chemical_formula_sum            'C27 H26 N O3 P'
_chemical_formula_weight         443.46

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'
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           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   10.0643(19)
_cell_length_b                   8.1662(15)
_cell_length_c                   28.399(5)
_cell_angle_alpha                90
_cell_angle_beta                 99.579(5)
_cell_angle_gamma                90
_cell_volume                     2301.5(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    294(2)
_cell_measurement_reflns_used    9918
_cell_measurement_theta_min      2.3095
_cell_measurement_theta_max      23.8795

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.280
_exptl_crystal_F_000             936
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.220
_exptl_crystal_size_mid          0.180
_exptl_crystal_size_min          0.140
_exptl_absorpt_coefficient_mu    0.148
_shelx_estimated_absorpt_T_min   0.968
_shelx_estimated_absorpt_T_max   0.980
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6867
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_process_details   
;
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D.,
 J. Appl. Cryst. 48 (2015) 3-10
;
_diffrn_ambient_temperature      294(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker D8 QUEST PHOTON-100'
_diffrn_measurement_method       'ω and φ'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            41168
_diffrn_reflns_av_unetI/netI     0.0361
_diffrn_reflns_av_R_equivalents  0.0480
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_theta_min         2.310
_diffrn_reflns_theta_max         28.340
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             5732
_reflns_number_gt                4068
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'APEX3 (Bruker, 2016)'
_computing_cell_refinement       'SAINT (Bruker, 2016)'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0426P)²+0.7343P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         5732
_refine_ls_number_parameters     291
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0724
_refine_ls_R_factor_gt           0.0439
_refine_ls_wR_factor_ref         0.1133
_refine_ls_wR_factor_gt          0.0993
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_restrained_S_all      1.020
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C -0.00732(17) 0.5392(2) 0.65203(7) 0.0498(4) Uani 1 1 d . . . . .
H1 H -0.069055 0.596956 0.630193 0.060 Uiso 1 1 calc R U . . .
C2 C -0.03928(19) 0.4918(2) 0.69531(7) 0.0578(5) Uani 1 1 d . . . . .
H2 H -0.122946 0.519926 0.702730 0.069 Uiso 1 1 calc R U . . .
C3 C 0.0507(2) 0.4028(3) 0.72831(7) 0.0592(5) Uani 1 1 d . . . . .
H3 H 0.024877 0.370448 0.756853 0.071 Uiso 1 1 calc R U . . .
C4 C 0.17673(19) 0.3620(2) 0.71956(6) 0.0521(4) Uani 1 1 d . . . . .
H4 H 0.237238 0.303388 0.741610 0.062 Uiso 1 1 calc R U . . .
C5 C 0.20948(16) 0.4124(2) 0.67614(6) 0.0414(4) Uani 1 1 d . . . . .
C6 C 0.12030(16) 0.49868(19) 0.64137(6) 0.0403(4) Uani 1 1 d . . . . .
C7 C 0.19024(16) 0.52696(19) 0.60149(6) 0.0398(4) Uani 1 1 d . . . . .
C8 C 0.31730(16) 0.45819(19) 0.61411(5) 0.0382(4) Uani 1 1 d . . . . .
C9 C 0.44532(16) 0.4316(2) 0.59399(6) 0.0399(4) Uani 1 1 d . . . . .
C10 C 0.52844(18) 0.3203(2) 0.63292(6) 0.0478(4) Uani 1 1 d . . . . .
H10A H 0.533545 0.209904 0.620775 0.057 Uiso 1 1 calc R U . . .
H10B H 0.619351 0.362508 0.641493 0.057 Uiso 1 1 calc R U . . .
C11 C 0.45805(17) 0.3193(2) 0.67670(6) 0.0492(4) Uani 1 1 d . . . . .
H11A H 0.449089 0.208834 0.688325 0.059 Uiso 1 1 calc R U . . .
H11B H 0.506350 0.385759 0.702284 0.059 Uiso 1 1 calc R U . . .
C12 C 0.14509(17) 0.6174(2) 0.55795(6) 0.0441(4) Uani 1 1 d . . . . .
C13 C -0.0383(2) 0.7567(3) 0.51256(8) 0.0778(7) Uani 1 1 d . . . . .
H13A H -0.032474 0.694840 0.484234 0.117 Uiso 1 1 calc R U . . .
H13B H 0.012768 0.855964 0.512411 0.117 Uiso 1 1 calc R U . . .
H13C H -0.130846 0.783067 0.513389 0.117 Uiso 1 1 calc R U . . .
C14 C 0.4164(2) 0.3416(2) 0.54585(6) 0.0534(5) Uani 1 1 d . . . . .
H14A H 0.361155 0.409220 0.522815 0.080 Uiso 1 1 calc R U . . .
H14B H 0.370220 0.240813 0.549658 0.080 Uiso 1 1 calc R U . . .
H14C H 0.499861 0.318421 0.535013 0.080 Uiso 1 1 calc R U . . .
C15 C 0.51859(16) 0.5937(2) 0.58585(6) 0.0417(4) Uani 1 1 d . . . . .
H15A H 0.460546 0.654856 0.561323 0.050 Uiso 1 1 calc R U . . .
H15B H 0.599137 0.565591 0.573018 0.050 Uiso 1 1 calc R U . . .
C16 C 0.41654(16) 0.8256(2) 0.64869(6) 0.0422(4) Uani 1 1 d . . . . .
C17 C 0.3826(2) 0.7990(3) 0.69340(7) 0.0601(5) Uani 1 1 d . . . . .
H17 H 0.437903 0.734695 0.715566 0.072 Uiso 1 1 calc R U . . .
C18 C 0.2668(2) 0.8676(3) 0.70523(9) 0.0787(7) Uani 1 1 d . . . . .
H18 H 0.244178 0.849126 0.735233 0.094 Uiso 1 1 calc R U . . .
C19 C 0.1862(2) 0.9619(3) 0.67295(10) 0.0776(7) Uani 1 1 d . . . . .
H19 H 0.108878 1.008378 0.681196 0.093 Uiso 1 1 calc R U . . .
C20 C 0.21700(19) 0.9897(3) 0.62838(9) 0.0684(6) Uani 1 1 d . . . . .
H20 H 0.160520 1.053667 0.606486 0.082 Uiso 1 1 calc R U . . .
C21 C 0.33310(18) 0.9217(2) 0.61612(7) 0.0528(5) Uani 1 1 d . . . . .
H21 H 0.354804 0.940741 0.586014 0.063 Uiso 1 1 calc R U . . .
C22 C 0.66302(16) 0.8902(2) 0.61240(6) 0.0445(4) Uani 1 1 d . . . . .
C23 C 0.6439(2) 0.9392(2) 0.56480(7) 0.0548(5) Uani 1 1 d . . . . .
H23 H 0.581208 0.885078 0.542391 0.066 Uiso 1 1 calc R U . . .
C24 C 0.7179(2) 1.0682(3) 0.55051(8) 0.0677(6) Uani 1 1 d . . . . .
H24 H 0.704465 1.099516 0.518585 0.081 Uiso 1 1 calc R U . . .
C25 C 0.8099(2) 1.1495(3) 0.58288(10) 0.0715(6) Uani 1 1 d . . . . .
H25 H 0.858149 1.236681 0.573108 0.086 Uiso 1 1 calc R U . . .
C26 C 0.8312(2) 1.1022(3) 0.63000(10) 0.0715(6) Uani 1 1 d . . . . .
H26 H 0.894368 1.157092 0.652043 0.086 Uiso 1 1 calc R U . . .
C27 C 0.75855(18) 0.9724(2) 0.64484(8) 0.0584(5) Uani 1 1 d . . . . .
H27 H 0.774111 0.940516 0.676722 0.070 Uiso 1 1 calc R U . . .
N1 N 0.32708(13) 0.38994(17) 0.65788(5) 0.0417(3) Uani 1 1 d . . . . .
O1 O 0.01505(12) 0.66142(17) 0.55393(5) 0.0609(4) Uani 1 1 d . . . . .
O2 O 0.21277(13) 0.65193(17) 0.52772(5) 0.0593(4) Uani 1 1 d . . . . .
O3 O 0.64470(12) 0.65207(15) 0.67931(4) 0.0528(3) Uani 1 1 d . . . . .
P1 P 0.56820(4) 0.72990(5) 0.63592(2) 0.04004(12) Uani 1 1 d . . . . .


_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
C1 C2 1.377(3) . ?
C1 C6 1.407(2) . ?
C1 H1 0.9300 . ?
C2 C3 1.394(3) . ?
C2 H2 0.9300 . ?
C3 C4 1.373(3) . ?
C3 H3 0.9300 . ?
C4 C5 1.391(2) . ?
C4 H4 0.9300 . ?
C5 N1 1.381(2) . ?
C5 C6 1.408(2) . ?
C6 C7 1.448(2) . ?
C7 C8 1.388(2) . ?
C7 C12 1.447(2) . ?
C8 N1 1.351(2) . ?
C8 C9 1.510(2) . ?
C9 C14 1.537(2) . ?
C9 C15 1.551(2) . ?
C9 C10 1.562(2) . ?
C10 C11 1.530(2) . ?
C10 H10A 0.9700 . ?
C10 H10B 0.9700 . ?
C11 N1 1.457(2) . ?
C11 H11A 0.9700 . ?
C11 H11B 0.9700 . ?
C12 O2 1.214(2) . ?
C12 O1 1.344(2) . ?
C13 O1 1.437(2) . ?
C13 H13A 0.9600 . ?
C13 H13B 0.9600 . ?
C13 H13C 0.9600 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 P1 1.8091(17) . ?
C15 H15A 0.9700 . ?
C15 H15B 0.9700 . ?
C16 C21 1.385(2) . ?
C16 C17 1.386(3) . ?
C16 P1 1.8043(17) . ?
C17 C18 1.384(3) . ?
C17 H17 0.9300 . ?
C18 C19 1.358(3) . ?
C18 H18 0.9300 . ?
C19 C20 1.371(3) . ?
C19 H19 0.9300 . ?
C20 C21 1.389(3) . ?
C20 H20 0.9300 . ?
C21 H21 0.9300 . ?
C22 C27 1.389(2) . ?
C22 C23 1.392(3) . ?
C22 P1 1.8119(18) . ?
C23 C24 1.389(3) . ?
C23 H23 0.9300 . ?
C24 C25 1.364(3) . ?
C24 H24 0.9300 . ?
C25 C26 1.375(3) . ?
C25 H25 0.9300 . ?
C26 C27 1.392(3) . ?
C26 H26 0.9300 . ?
C27 H27 0.9300 . ?
O3 P1 1.4830(12) . ?

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
C2 C1 C6 118.91(17) . . ?
C2 C1 H1 120.5 . . ?
C6 C1 H1 120.5 . . ?
C1 C2 C3 121.61(17) . . ?
C1 C2 H2 119.2 . . ?
C3 C2 H2 119.2 . . ?
C4 C3 C2 121.42(18) . . ?
C4 C3 H3 119.3 . . ?
C2 C3 H3 119.3 . . ?
C3 C4 C5 116.79(17) . . ?
C3 C4 H4 121.6 . . ?
C5 C4 H4 121.6 . . ?
N1 C5 C4 129.64(16) . . ?
N1 C5 C6 106.82(14) . . ?
C4 C5 C6 123.54(16) . . ?
C1 C6 C5 117.71(15) . . ?
C1 C6 C7 135.29(15) . . ?
C5 C6 C7 106.99(14) . . ?
C8 C7 C12 124.89(15) . . ?
C8 C7 C6 106.28(14) . . ?
C12 C7 C6 128.70(15) . . ?
N1 C8 C7 109.12(14) . . ?
N1 C8 C9 110.66(13) . . ?
C7 C8 C9 140.18(15) . . ?
C8 C9 C14 111.01(14) . . ?
C8 C9 C15 112.99(13) . . ?
C14 C9 C15 107.45(14) . . ?
C8 C9 C10 101.89(13) . . ?
C14 C9 C10 110.56(13) . . ?
C15 C9 C10 112.94(13) . . ?
C11 C10 C9 108.21(13) . . ?
C11 C10 H10A 110.1 . . ?
C9 C10 H10A 110.1 . . ?
C11 C10 H10B 110.1 . . ?
C9 C10 H10B 110.1 . . ?
H10A C10 H10B 108.4 . . ?
N1 C11 C10 102.28(13) . . ?
N1 C11 H11A 111.3 . . ?
C10 C11 H11A 111.3 . . ?
N1 C11 H11B 111.3 . . ?
C10 C11 H11B 111.3 . . ?
H11A C11 H11B 109.2 . . ?
O2 C12 O1 122.07(15) . . ?
O2 C12 C7 126.10(16) . . ?
O1 C12 C7 111.84(16) . . ?
O1 C13 H13A 109.5 . . ?
O1 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
O1 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C9 C14 H14A 109.5 . . ?
C9 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C9 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C9 C15 P1 118.92(11) . . ?
C9 C15 H15A 107.6 . . ?
P1 C15 H15A 107.6 . . ?
C9 C15 H15B 107.6 . . ?
P1 C15 H15B 107.6 . . ?
H15A C15 H15B 107.0 . . ?
C21 C16 C17 119.09(17) . . ?
C21 C16 P1 123.39(14) . . ?
C17 C16 P1 117.51(14) . . ?
C18 C17 C16 120.3(2) . . ?
C18 C17 H17 119.8 . . ?
C16 C17 H17 119.8 . . ?
C19 C18 C17 119.9(2) . . ?
C19 C18 H18 120.1 . . ?
C17 C18 H18 120.1 . . ?
C18 C19 C20 121.0(2) . . ?
C18 C19 H19 119.5 . . ?
C20 C19 H19 119.5 . . ?
C19 C20 C21 119.6(2) . . ?
C19 C20 H20 120.2 . . ?
C21 C20 H20 120.2 . . ?
C16 C21 C20 120.06(19) . . ?
C16 C21 H21 120.0 . . ?
C20 C21 H21 120.0 . . ?
C27 C22 C23 118.28(18) . . ?
C27 C22 P1 116.97(15) . . ?
C23 C22 P1 124.72(14) . . ?
C24 C23 C22 120.50(19) . . ?
C24 C23 H23 119.8 . . ?
C22 C23 H23 119.8 . . ?
C25 C24 C23 120.6(2) . . ?
C25 C24 H24 119.7 . . ?
C23 C24 H24 119.7 . . ?
C24 C25 C26 119.8(2) . . ?
C24 C25 H25 120.1 . . ?
C26 C25 H25 120.1 . . ?
C25 C26 C27 120.3(2) . . ?
C25 C26 H26 119.9 . . ?
C27 C26 H26 119.9 . . ?
C22 C27 C26 120.5(2) . . ?
C22 C27 H27 119.8 . . ?
C26 C27 H27 119.8 . . ?
C8 N1 C5 110.78(13) . . ?
C8 N1 C11 115.09(14) . . ?
C5 N1 C11 133.99(14) . . ?
C12 O1 C13 116.13(15) . . ?
O3 P1 C16 110.99(8) . . ?
O3 P1 C15 115.26(8) . . ?
C16 P1 C15 106.99(7) . . ?
O3 P1 C22 112.55(8) . . ?
C16 P1 C22 106.04(8) . . ?
C15 P1 C22 104.35(8) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 -1.1(3) . . . . ?
C1 C2 C3 C4 1.7(3) . . . . ?
C2 C3 C4 C5 -0.5(3) . . . . ?
C3 C4 C5 N1 179.72(18) . . . . ?
C3 C4 C5 C6 -1.2(3) . . . . ?
C2 C1 C6 C5 -0.6(2) . . . . ?
C2 C1 C6 C7 -179.09(18) . . . . ?
N1 C5 C6 C1 -178.99(14) . . . . ?
C4 C5 C6 C1 1.7(3) . . . . ?
N1 C5 C6 C7 -0.08(18) . . . . ?
C4 C5 C6 C7 -179.37(16) . . . . ?
C1 C6 C7 C8 178.20(18) . . . . ?
C5 C6 C7 C8 -0.44(18) . . . . ?
C1 C6 C7 C12 2.1(3) . . . . ?
C5 C6 C7 C12 -176.51(16) . . . . ?
C12 C7 C8 N1 177.06(15) . . . . ?
C6 C7 C8 N1 0.81(18) . . . . ?
C12 C7 C8 C9 -5.3(3) . . . . ?
C6 C7 C8 C9 178.44(19) . . . . ?
N1 C8 C9 C14 122.45(15) . . . . ?
C7 C8 C9 C14 -55.2(3) . . . . ?
N1 C8 C9 C15 -116.75(15) . . . . ?
C7 C8 C9 C15 65.6(3) . . . . ?
N1 C8 C9 C10 4.72(17) . . . . ?
C7 C8 C9 C10 -172.9(2) . . . . ?
C8 C9 C10 C11 -11.46(18) . . . . ?
C14 C9 C10 C11 -129.51(16) . . . . ?
C15 C9 C10 C11 110.05(16) . . . . ?
C9 C10 C11 N1 13.64(19) . . . . ?
C8 C7 C12 O2 -3.5(3) . . . . ?
C6 C7 C12 O2 171.91(17) . . . . ?
C8 C7 C12 O1 176.39(15) . . . . ?
C6 C7 C12 O1 -8.2(2) . . . . ?
C8 C9 C15 P1 57.45(17) . . . . ?
C14 C9 C15 P1 -179.76(11) . . . . ?
C10 C9 C15 P1 -57.56(16) . . . . ?
C21 C16 C17 C18 0.0(3) . . . . ?
P1 C16 C17 C18 -179.35(17) . . . . ?
C16 C17 C18 C19 -0.2(4) . . . . ?
C17 C18 C19 C20 0.5(4) . . . . ?
C18 C19 C20 C21 -0.6(4) . . . . ?
C17 C16 C21 C20 -0.1(3) . . . . ?
P1 C16 C21 C20 179.21(15) . . . . ?
C19 C20 C21 C16 0.4(3) . . . . ?
C27 C22 C23 C24 -0.7(3) . . . . ?
P1 C22 C23 C24 177.26(14) . . . . ?
C22 C23 C24 C25 -0.3(3) . . . . ?
C23 C24 C25 C26 0.8(3) . . . . ?
C24 C25 C26 C27 -0.4(3) . . . . ?
C23 C22 C27 C26 1.1(3) . . . . ?
P1 C22 C27 C26 -177.01(15) . . . . ?
C25 C26 C27 C22 -0.6(3) . . . . ?
C7 C8 N1 C5 -0.89(19) . . . . ?
C9 C8 N1 C5 -179.28(13) . . . . ?
C7 C8 N1 C11 -177.30(14) . . . . ?
C9 C8 N1 C11 4.32(19) . . . . ?
C4 C5 N1 C8 179.82(17) . . . . ?
C6 C5 N1 C8 0.59(18) . . . . ?
C4 C5 N1 C11 -4.7(3) . . . . ?
C6 C5 N1 C11 176.07(17) . . . . ?
C10 C11 N1 C8 -11.4(2) . . . . ?
C10 C11 N1 C5 173.30(17) . . . . ?
O2 C12 O1 C13 -2.1(3) . . . . ?
C7 C12 O1 C13 178.02(16) . . . . ?
C21 C16 P1 O3 173.09(14) . . . . ?
C17 C16 P1 O3 -7.54(17) . . . . ?
C21 C16 P1 C15 -60.39(16) . . . . ?
C17 C16 P1 C15 118.98(15) . . . . ?
C21 C16 P1 C22 50.56(16) . . . . ?
C17 C16 P1 C22 -130.08(15) . . . . ?
C9 C15 P1 O3 50.66(14) . . . . ?
C9 C15 P1 C16 -73.28(14) . . . . ?
C9 C15 P1 C22 174.61(12) . . . . ?
C27 C22 P1 O3 -28.35(16) . . . . ?
C23 C22 P1 O3 153.65(14) . . . . ?
C27 C22 P1 C16 93.18(14) . . . . ?
C23 C22 P1 C16 -84.82(16) . . . . ?
C27 C22 P1 C15 -154.03(13) . . . . ?
C23 C22 P1 C15 27.97(17) . . . . ?

_refine_diff_density_max         0.226
_refine_diff_density_min         -0.308
_refine_diff_density_rms         0.037



