# Electronic Supplementary Material (ESI) for Organic & Biomolecular Chemistry.
# This journal is © The Royal Society of Chemistry 2022

####################################################################### 
# 
# 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_111
_database_code_depnum_ccdc_archive 'CCDC 2159691'
loop_
_audit_author_name
_audit_author_address
'Ting Xiong'
;Guangxi University
China
;
_audit_update_record             
;
2022-03-17 deposited with the CCDC.	2022-07-11 downloaded from the CCDC.
;
_audit_creation_date             2021-12-22
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C18 H20 N O4 P'
_chemical_formula_sum            'C18 H20 N O4 P'
_chemical_formula_weight         345.32
_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'
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'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.8688(7)
_cell_length_b                   9.9088(7)
_cell_length_c                   10.7278(8)
_cell_angle_alpha                73.336(2)
_cell_angle_beta                 75.766(2)
_cell_angle_gamma                60.403(2)
_cell_volume                     866.99(11)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9925
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.516
_cell_measurement_theta_min      3.304
_shelx_estimated_absorpt_T_max   0.972
_shelx_estimated_absorpt_T_min   0.938
_exptl_absorpt_coefficient_mu    0.180
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.6891
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0740 before and 0.0452 after correction.
The Ratio of minimum to maximum transmission is 0.9242.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.323
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             364
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.16
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0253
_diffrn_reflns_av_unetI/netI     0.0224
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            18052
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.551
_diffrn_reflns_theta_min         3.655
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                3309
_reflns_number_total             3970
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.38A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.38A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    
;
Superflip (Palatinus & Chapuis, 2007;Palatinus & van der Lee, 2008;
Palatinus et al., 2012)
;
_refine_diff_density_max         0.586
_refine_diff_density_min         -0.499
_refine_diff_density_rms         0.054
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     221
_refine_ls_number_reflns         3970
_refine_ls_number_restraints     24
_refine_ls_R_factor_all          0.0695
_refine_ls_R_factor_gt           0.0589
_refine_ls_restrained_S_all      1.039
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0879P)²+0.4677P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1580
_refine_ls_wR_factor_ref         0.1673
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(C17B) \\sim Ueq, Uanis(C18A) \\sim Ueq, Uanis(C18B) \\sim Ueq,
Uanis(C17A) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C17B) = Uanis(C18B) = Uanis(C18A) = Uanis(C17A)
3. Others
 Sof(C17B)=Sof(H17C)=Sof(H17D)=Sof(C18B)=Sof(H18D)=Sof(H18E)=Sof(H18F)=1-FVAR(1)
 Sof(C18A)=Sof(H18A)=Sof(H18B)=Sof(H18C)=Sof(C17A)=Sof(H17A)=Sof(H17B)=FVAR(1)
4.a Secondary CH2 refined with riding coordinates:
 C15(H15A,H15B), C17A(H17A,H17B), C17B(H17C,H17D)
4.b Aromatic/amide H refined with riding coordinates:
 N10(H10), C1(H1), C14(H14), C10(H10A), C4(H4), C3(H3), C2(H2), C11(H11),
 C13(H13), C12(H12)
4.c Idealised Me refined as rotating group:
 C18A(H18A,H18B,H18C), C16(H16A,H16B,H16C), C18B(H18D,H18E,H18F)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
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
P2 P 0.07275(6) 0.72434(6) 0.61691(5) 0.04155(18) Uani 1 1 d . . . . .
O2 O -0.05267(19) 0.85310(19) 0.54300(15) 0.0529(4) Uani 1 1 d . . . . .
O3 O 0.2391(2) 0.6556(2) 0.53668(17) 0.0616(5) Uani 1 1 d . . . . .
O5 O 0.2323(2) 0.5374(2) 0.90199(19) 0.0705(5) Uani 1 1 d . . . . .
O7 O 0.0370(2) 0.5811(2) 0.68065(18) 0.0664(5) Uani 1 1 d . . . . .
N10 N 0.16775(19) 0.8986(2) 0.68168(17) 0.0435(4) Uani 1 1 d . . . . .
H10 H 0.115940 0.991065 0.636576 0.052 Uiso 1 1 calc R . . . .
C7 C 0.1043(2) 0.7879(2) 0.74806(18) 0.0373(4) Uani 1 1 d . . . . .
C6 C 0.3214(2) 0.8353(3) 0.70088(19) 0.0431(4) Uani 1 1 d . . . . .
C9 C -0.0441(2) 0.8566(2) 0.84276(19) 0.0421(4) Uani 1 1 d . . . . .
C5 C 0.3701(2) 0.6889(3) 0.7861(2) 0.0448(5) Uani 1 1 d . . . . .
C8 C 0.2407(2) 0.6491(2) 0.8245(2) 0.0442(5) Uani 1 1 d . . . . .
C1 C 0.4241(3) 0.9023(4) 0.6494(2) 0.0592(6) Uani 1 1 d . . . . .
H1 H 0.393456 0.999787 0.591996 0.071 Uiso 1 1 calc R . . . .
C14 C -0.1282(3) 0.7728(4) 0.9056(3) 0.0617(6) Uani 1 1 d . . . . .
H14 H -0.094424 0.672951 0.889452 0.074 Uiso 1 1 calc R . . . .
C10 C -0.0945(3) 1.0026(3) 0.8711(2) 0.0569(6) Uani 1 1 d . . . . .
H10A H -0.038585 1.060101 0.831554 0.068 Uiso 1 1 calc R . . . .
C4 C 0.5212(3) 0.6071(3) 0.8225(3) 0.0635(7) Uani 1 1 d . . . . .
H4 H 0.553596 0.509260 0.879464 0.076 Uiso 1 1 calc R . . . .
C3 C 0.6207(3) 0.6738(4) 0.7727(3) 0.0790(9) Uani 1 1 d . . . . .
H3 H 0.721496 0.621605 0.796684 0.095 Uiso 1 1 calc R . . . .
C2 C 0.5729(3) 0.8180(5) 0.6871(3) 0.0771(9) Uani 1 1 d . . . . .
H2 H 0.643491 0.859870 0.653478 0.093 Uiso 1 1 calc R . . . .
C11 C -0.2286(4) 1.0638(4) 0.9587(3) 0.0788(9) Uani 1 1 d . . . . .
H11 H -0.261919 1.162384 0.977363 0.095 Uiso 1 1 calc R . . . .
C13 C -0.2617(4) 0.8363(5) 0.9921(3) 0.0825(9) Uani 1 1 d . . . . .
H13 H -0.317729 0.779277 1.033179 0.099 Uiso 1 1 calc R . . . .
C18A C 0.0489(7) 0.3264(5) 0.7295(7) 0.0930(12) Uani 0.738(5) 1 d . U P A 1
H18A H -0.017671 0.357413 0.664148 0.140 Uiso 0.738(5) 1 calc GR . P A 1
H18B H -0.014180 0.344849 0.812470 0.140 Uiso 0.738(5) 1 calc GR . P A 1
H18C H 0.121628 0.215928 0.736693 0.140 Uiso 0.738(5) 1 calc GR . P A 1
C15 C 0.2725(4) 0.7264(6) 0.4009(3) 0.1097(15) Uani 1 1 d . . . . .
H15A H 0.263169 0.672510 0.343372 0.132 Uiso 1 1 calc R . . . .
H15B H 0.194108 0.836337 0.383812 0.132 Uiso 1 1 calc R . . . .
C12 C -0.3117(3) 0.9819(5) 1.0175(3) 0.0842(10) Uani 1 1 d . . . . .
H12 H -0.402443 1.024984 1.074932 0.101 Uiso 1 1 calc R . . . .
C16 C 0.4195(5) 0.7197(6) 0.3710(4) 0.1099(14) Uani 1 1 d . . . . .
H16A H 0.432709 0.770880 0.281429 0.165 Uiso 1 1 calc GR . . . .
H16B H 0.498163 0.611099 0.382994 0.165 Uiso 1 1 calc GR . . . .
H16C H 0.430091 0.772425 0.427729 0.165 Uiso 1 1 calc GR . . . .
C17A C 0.1349(6) 0.4183(5) 0.6922(7) 0.0930(12) Uani 0.738(5) 1 d . U P A 1
H17A H 0.204392 0.383903 0.757188 0.112 Uiso 0.738(5) 1 calc R . P A 1
H17B H 0.199514 0.397828 0.608929 0.112 Uiso 0.738(5) 1 calc R . P A 1
C17B C 0.0671(18) 0.4645(14) 0.6154(18) 0.0930(12) Uani 0.262(5) 1 d . U P A 2
H17C H -0.031260 0.493648 0.586456 0.112 Uiso 0.262(5) 1 calc R . P A 2
H17D H 0.138008 0.474177 0.536692 0.112 Uiso 0.262(5) 1 calc R . P A 2
C18B C 0.1208(19) 0.3231(15) 0.665(2) 0.0930(12) Uani 0.262(5) 1 d . U P A 2
H18D H 0.233470 0.275053 0.649610 0.140 Uiso 0.262(5) 1 calc GR . P A 2
H18E H 0.083806 0.273057 0.626315 0.140 Uiso 0.262(5) 1 calc GR . P A 2
H18F H 0.087297 0.310429 0.757603 0.140 Uiso 0.262(5) 1 calc GR . P A 2


_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
P2 O2 1.4598(16) . ?
P2 O3 1.5613(17) . ?
P2 O7 1.5574(17) . ?
P2 C7 1.841(2) . ?
O3 C15 1.459(4) . ?
O5 C8 1.205(3) . ?
O7 C17A 1.399(5) . ?
O7 C17B 1.392(14) . ?
N10 H10 0.8600 . ?
N10 C7 1.454(2) . ?
N10 C6 1.369(3) . ?
C7 C9 1.523(3) . ?
C7 C8 1.563(3) . ?
C6 C5 1.392(3) . ?
C6 C1 1.397(3) . ?
C9 C14 1.384(3) . ?
C9 C10 1.379(3) . ?
C5 C8 1.450(3) . ?
C5 C4 1.395(3) . ?
C1 H1 0.9300 . ?
C1 C2 1.380(4) . ?
C14 H14 0.9300 . ?
C14 C13 1.381(4) . ?
C10 H10A 0.9300 . ?
C10 C11 1.387(4) . ?
C4 H4 0.9300 . ?
C4 C3 1.366(4) . ?
C3 H3 0.9300 . ?
C3 C2 1.379(5) . ?
C2 H2 0.9300 . ?
C11 H11 0.9300 . ?
C11 C12 1.356(5) . ?
C13 H13 0.9300 . ?
C13 C12 1.363(5) . ?
C18A H18A 0.9600 . ?
C18A H18B 0.9600 . ?
C18A H18C 0.9600 . ?
C18A C17A 1.448(7) . ?
C15 H15A 0.9700 . ?
C15 H15B 0.9700 . ?
C15 C16 1.379(5) . ?
C12 H12 0.9300 . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C17A H17A 0.9700 . ?
C17A H17B 0.9700 . ?
C17B H17C 0.9700 . ?
C17B H17D 0.9700 . ?
C17B C18B 1.227(18) . ?
C18B H18D 0.9600 . ?
C18B H18E 0.9600 . ?
C18B H18F 0.9600 . ?

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
O2 P2 O3 115.64(10) . . ?
O2 P2 O7 111.61(11) . . ?
O2 P2 C7 111.92(9) . . ?
O3 P2 C7 103.10(9) . . ?
O7 P2 O3 105.89(10) . . ?
O7 P2 C7 108.04(10) . . ?
C15 O3 P2 122.6(2) . . ?
C17A O7 P2 130.7(3) . . ?
C17B O7 P2 124.2(7) . . ?
C7 N10 H10 124.7 . . ?
C6 N10 H10 124.7 . . ?
C6 N10 C7 110.64(16) . . ?
N10 C7 P2 105.68(13) . . ?
N10 C7 C9 113.51(16) . . ?
N10 C7 C8 103.11(15) . . ?
C9 C7 P2 112.67(13) . . ?
C9 C7 C8 110.30(15) . . ?
C8 C7 P2 111.11(13) . . ?
N10 C6 C5 111.75(18) . . ?
N10 C6 C1 127.8(2) . . ?
C5 C6 C1 120.4(2) . . ?
C14 C9 C7 121.3(2) . . ?
C10 C9 C7 120.16(19) . . ?
C10 C9 C14 118.5(2) . . ?
C6 C5 C8 108.60(17) . . ?
C6 C5 C4 120.9(2) . . ?
C4 C5 C8 130.5(2) . . ?
O5 C8 C7 125.10(19) . . ?
O5 C8 C5 129.2(2) . . ?
C5 C8 C7 105.62(16) . . ?
C6 C1 H1 121.4 . . ?
C2 C1 C6 117.3(3) . . ?
C2 C1 H1 121.4 . . ?
C9 C14 H14 119.7 . . ?
C13 C14 C9 120.6(3) . . ?
C13 C14 H14 119.7 . . ?
C9 C10 H10A 120.0 . . ?
C9 C10 C11 119.9(3) . . ?
C11 C10 H10A 120.0 . . ?
C5 C4 H4 120.8 . . ?
C3 C4 C5 118.5(3) . . ?
C3 C4 H4 120.8 . . ?
C4 C3 H3 119.7 . . ?
C4 C3 C2 120.6(2) . . ?
C2 C3 H3 119.7 . . ?
C1 C2 H2 118.8 . . ?
C3 C2 C1 122.5(3) . . ?
C3 C2 H2 118.8 . . ?
C10 C11 H11 119.5 . . ?
C12 C11 C10 121.0(3) . . ?
C12 C11 H11 119.5 . . ?
C14 C13 H13 119.8 . . ?
C12 C13 C14 120.3(3) . . ?
C12 C13 H13 119.8 . . ?
H18A C18A H18B 109.5 . . ?
H18A C18A H18C 109.5 . . ?
H18B C18A H18C 109.5 . . ?
C17A C18A H18A 109.5 . . ?
C17A C18A H18B 109.5 . . ?
C17A C18A H18C 109.5 . . ?
O3 C15 H15A 108.8 . . ?
O3 C15 H15B 108.8 . . ?
H15A C15 H15B 107.7 . . ?
C16 C15 O3 113.7(3) . . ?
C16 C15 H15A 108.8 . . ?
C16 C15 H15B 108.8 . . ?
C11 C12 C13 119.7(3) . . ?
C11 C12 H12 120.2 . . ?
C13 C12 H12 120.2 . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
O7 C17A C18A 113.0(4) . . ?
O7 C17A H17A 109.0 . . ?
O7 C17A H17B 109.0 . . ?
C18A C17A H17A 109.0 . . ?
C18A C17A H17B 109.0 . . ?
H17A C17A H17B 107.8 . . ?
O7 C17B H17C 106.4 . . ?
O7 C17B H17D 106.4 . . ?
H17C C17B H17D 106.5 . . ?
C18B C17B O7 123.8(16) . . ?
C18B C17B H17C 106.4 . . ?
C18B C17B H17D 106.4 . . ?
C17B C18B H18D 109.5 . . ?
C17B C18B H18E 109.5 . . ?
C17B C18B H18F 109.5 . . ?
H18D C18B H18E 109.5 . . ?
H18D C18B H18F 109.5 . . ?
H18E C18B H18F 109.5 . . ?

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
P2 O3 C15 C16 143.7(3) . . . . ?
P2 O7 C17A C18A -165.8(4) . . . . ?
P2 O7 C17B C18B 139.1(15) . . . . ?
P2 C7 C9 C14 54.1(2) . . . . ?
P2 C7 C9 C10 -128.14(18) . . . . ?
P2 C7 C8 O5 -73.9(3) . . . . ?
P2 C7 C8 C5 108.45(16) . . . . ?
O2 P2 O3 C15 7.1(3) . . . . ?
O2 P2 O7 C17A 138.7(4) . . . . ?
O2 P2 O7 C17B 83.0(8) . . . . ?
O2 P2 C7 N10 -67.95(15) . . . . ?
O2 P2 C7 C9 56.54(16) . . . . ?
O2 P2 C7 C8 -179.11(13) . . . . ?
O3 P2 O7 C17A 12.1(4) . . . . ?
O3 P2 O7 C17B -43.6(8) . . . . ?
O3 P2 C7 N10 56.98(14) . . . . ?
O3 P2 C7 C9 -178.53(13) . . . . ?
O3 P2 C7 C8 -54.18(15) . . . . ?
O7 P2 O3 C15 131.3(3) . . . . ?
O7 P2 C7 N10 168.78(13) . . . . ?
O7 P2 C7 C9 -66.73(16) . . . . ?
O7 P2 C7 C8 57.62(16) . . . . ?
N10 C7 C9 C14 174.20(19) . . . . ?
N10 C7 C9 C10 -8.1(3) . . . . ?
N10 C7 C8 O5 173.4(2) . . . . ?
N10 C7 C8 C5 -4.3(2) . . . . ?
N10 C6 C5 C8 1.4(2) . . . . ?
N10 C6 C5 C4 -177.6(2) . . . . ?
N10 C6 C1 C2 177.5(2) . . . . ?
C7 P2 O3 C15 -115.3(3) . . . . ?
C7 P2 O7 C17A -97.8(4) . . . . ?
C7 P2 O7 C17B -153.5(8) . . . . ?
C7 N10 C6 C5 -4.6(2) . . . . ?
C7 N10 C6 C1 177.5(2) . . . . ?
C7 C9 C14 C13 179.4(2) . . . . ?
C7 C9 C10 C11 -179.2(2) . . . . ?
C6 N10 C7 P2 -111.33(15) . . . . ?
C6 N10 C7 C9 124.71(18) . . . . ?
C6 N10 C7 C8 5.4(2) . . . . ?
C6 C5 C8 O5 -175.6(2) . . . . ?
C6 C5 C8 C7 2.0(2) . . . . ?
C6 C5 C4 C3 0.0(4) . . . . ?
C6 C1 C2 C3 -0.5(4) . . . . ?
C9 C7 C8 O5 51.8(3) . . . . ?
C9 C7 C8 C5 -125.87(18) . . . . ?
C9 C14 C13 C12 -0.6(5) . . . . ?
C9 C10 C11 C12 0.0(4) . . . . ?
C5 C6 C1 C2 -0.3(3) . . . . ?
C5 C4 C3 C2 -0.8(4) . . . . ?
C8 C7 C9 C14 -70.7(2) . . . . ?
C8 C7 C9 C10 107.1(2) . . . . ?
C8 C5 C4 C3 -178.8(2) . . . . ?
C1 C6 C5 C8 179.6(2) . . . . ?
C1 C6 C5 C4 0.6(3) . . . . ?
C14 C9 C10 C11 -1.4(3) . . . . ?
C14 C13 C12 C11 -0.8(5) . . . . ?
C10 C9 C14 C13 1.7(4) . . . . ?
C10 C11 C12 C13 1.1(5) . . . . ?
C4 C5 C8 O5 3.3(4) . . . . ?
C4 C5 C8 C7 -179.1(2) . . . . ?
C4 C3 C2 C1 1.0(5) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
