# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 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_6
_database_code_depnum_ccdc_archive 'CCDC 2161450'
loop_
_audit_author_name
_audit_author_address
'Hua Xiang'
;Guangdong Industry Polytechnic
China
;
_audit_update_record             
;
2022-05-08 deposited with the CCDC.	2022-05-10 downloaded from the CCDC.
;
_audit_creation_date             2022-04-05
_audit_creation_method           
;
Olex2 1.5-dev
(compiled 2022.03.10 svn.r54f81f84 for OlexSys, GUI svn.r6444)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        
;
 ? 
;
_chemical_formula_moiety         '3(C6 H16 N), C21 H16 N6 O27 Tb2'
_chemical_formula_sum            'C39 H64 N9 O27 Tb2'
_chemical_formula_weight         1408.83
_chemical_absolute_configuration ?
_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 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Tb Tb -9.1472 9.1891 '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      monoclinic
_space_group_IT_number           5
_space_group_name_H-M_alt        'C 1 2 1'
_space_group_name_Hall           'C 2y'
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'

_cell_length_a                   19.3502(3)
_cell_length_b                   11.14440(10)
_cell_length_c                   14.4386(2)
_cell_angle_alpha                90
_cell_angle_beta                 120.5930(10)
_cell_angle_gamma                90
_cell_volume                     2680.23(7)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    4093
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      73.758
_cell_measurement_theta_min      3.556
_shelx_estimated_absorpt_T_max   0.685
_shelx_estimated_absorpt_T_min   0.343
_exptl_absorpt_coefficient_mu    13.634
_exptl_absorpt_correction_T_max  0.6852
_exptl_absorpt_correction_T_min  0.3426
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.746
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1414
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.03
_exptl_special_details           
;
 ? 
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0251
_diffrn_reflns_av_unetI/netI     0.0278
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.983
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            8333
_diffrn_reflns_point_group_measured_fraction_full 0.785
_diffrn_reflns_point_group_measured_fraction_max 0.756
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         73.758
_diffrn_reflns_theta_min         3.556
_diffrn_ambient_temperature      150.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_measurement_method       'Omega scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_reflns_Friedel_coverage         0.460
_reflns_Friedel_fraction_full    0.546
_reflns_Friedel_fraction_max     0.504
_reflns_number_gt                4028
_reflns_number_total             4093
_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       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_molecular_graphics    'Olex2 1.5-dev (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5-dev (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.5-dev (Bourhis et al., 2015)'
_refine_diff_density_max         0.801
_refine_diff_density_min         -0.903
_refine_diff_density_rms         0.075
_refine_ls_abs_structure_details 
;
 Flack x determined using 1242 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.011(4)
_refine_ls_extinction_coef       0.00044(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.054
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     441
_refine_ls_number_reflns         4093
_refine_ls_number_restraints     198
_refine_ls_R_factor_all          0.0254
_refine_ls_R_factor_gt           0.0251
_refine_ls_restrained_S_all      1.061
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0453P)²+2.6677P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0669
_refine_ls_wR_factor_ref         0.0673
_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, All O(H) groups
2. Restrained distances
 N5-C41
 1.5 with sigma of 0.005
 N5-C39
 1.5 with sigma of 0.005
 N5-C14 = N5-C41 = N5-C39
 1.5 with sigma of 0.01
 N5-C13
 2.533 with sigma of 0.01
 C42-N5 = N5-C40
 2.533 with sigma of 0.01
 N4-C37
 1.5 with sigma of 0.005
 N4-C33
 1.5 with sigma of 0.005
 N4-C31
 1.5 with sigma of 0.005
 C37-C38A
 1.53 with sigma of 0.001
 C31-C32
 1.53 with sigma of 0.005
 C33-C34
 1.53 with sigma of 0.005
 C39-C40
 1.53 with sigma of 0.005
 C41-C42
 1.53 with sigma of 0.005
 C41-C39
 2.55 with sigma of 0.005
 C38A-N4
 2.533 with sigma of 0.01
 C14-C41
 2.533 with sigma of 0.01
 C14-C39 = C39-C41
 2.533 with sigma of 0.01
 C42-C41 = C13-C14 = C40-C39
 1.52 with sigma of 0.01
 N5-C42 \\sim N5-C40
 with sigma of 0.005
 N4-C37 \\sim N4A-C37A
 with sigma of 0.02
 N4-C33 \\sim N4A-C33A
 with sigma of 0.02
 C34-C33 \\sim C34A-C33A
 with sigma of 0.02
 C33-C31 \\sim C33A-C31A
 with sigma of 0.04
 C33-C37 \\sim C33A-C37A
 with sigma of 0.04
 C31-C37 \\sim C31A-C37A
 with sigma of 0.04
 N4-C31 \\sim N4A-C31A
 with sigma of 0.02
 C38A-C37 \\sim C38B-C37A
 with sigma of 0.02
 C34-N4 \\sim C34A-N4A
 with sigma of 0.04
 N4-C32 \\sim N4A-C32A
 with sigma of 0.04
 N4-C38A \\sim N4A-C38B
 with sigma of 0.04
 C32-C31 \\sim C32A-C31A
 with sigma of 0.02
3. Restrained planarity
 C10, C9, C11, C12
 with sigma of 0.005
4. Rigid bond restraints
 C10, O7
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.005
 C33, C34
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.005
 C31, C32
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.005
 C37
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.005
 N4, C37
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.005
5. Uiso/Uaniso restraints and constraints
C10 \\sim O7: within 2A with sigma of 0.02 and sigma for terminal atoms of 0.01
within 2A
C33 \\sim C34: within 2A with sigma of 0.02 and sigma for terminal atoms of
0.01 within 2A
C31 \\sim C32: within 2A with sigma of 0.02 and sigma for terminal atoms of
0.01 within 2A
C38B \\sim C38A: within 2A with sigma of 0.01 and sigma for terminal atoms of
0.02 within 2A
Uanis(C39) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(C37) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(C42) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(C10) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(C39) = Uanis(N5)
Uanis(C42) = Uanis(C41)
Uanis(C10) = Uanis(O7)
6. Rigid body (RIGU) restrains
 C14, C40, C39, N5, C41, C42, C13
 with sigma for 1-2 distances of 0.0005 and sigma for 1-3 distances of 0.0005
 C38A, C34, C33, N4, C37, C31, C32
 with sigma for 1-2 distances of 0.0005 and sigma for 1-3 distances of 0.0005
 N4A, C33A, C31A, C37A, C34A, C32A, C38B
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
 C38A, C34, C33, N4, C31, C37, C32
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
7. Others
 Sof(N4A)=Sof(H4AA)=Sof(C34A)=Sof(H34D)=Sof(H34E)=Sof(H34F)=Sof(C33A)=
 Sof(H33C)=Sof(H33D)=Sof(C31A)=Sof(H31C)=Sof(H31D)=Sof(C37A)=Sof(H37C)=
 Sof(H37D)=Sof(C32A)=Sof(H32D)=Sof(H32E)=Sof(H32F)=Sof(C38B)=Sof(H38D)=
 Sof(H38E)=Sof(H38F)=1-FVAR(1)
 Sof(C34)=Sof(H34A)=Sof(H34B)=Sof(H34C)=Sof(N4)=Sof(H4A)=Sof(C32)=Sof(H32A)=
 Sof(H32B)=Sof(H32C)=Sof(C33)=Sof(H33A)=Sof(H33B)=Sof(C31)=Sof(H31A)=Sof(H31B)=
 Sof(C38A)=Sof(H38A)=Sof(H38B)=Sof(H38C)=Sof(C37)=Sof(H37A)=Sof(H37B)=FVAR(1)
 Fixed Sof: C40(0.5) H40A(0.5) H40B(0.5) H40C(0.5) N5(0.5) H5(0.5) C41(0.5)
 H41A(0.5) H41B(0.5) C42(0.5) H42A(0.5) H42B(0.5) H42C(0.5) C39(0.5) H39A(0.5)
 H39B(0.5) O7(0.5) H10(0.5) C13(0.5) H13A(0.5) H13B(0.5) H13C(0.5) C14(0.5)
 H14A(0.5) H14B(0.5)
8.a Riding coordinates:
 O7(H7), C10(H10), C13(H13A,H13B,H13C)
8.b Ternary CH refined with riding coordinates:
 N5(H5), N4(H4A), N4A(H4AA)
8.c Secondary CH2 refined with riding coordinates:
 C41(H41A,H41B), C33(H33A,H33B), C31(H31A,H31B), C39(H39A,H39B), C37(H37A,
 H37B), C14(H14A,H14B), C33A(H33C,H33D), C31A(H31C,H31D), C37A(H37C,H37D)
8.d Aromatic/amide H refined with riding coordinates:
 C3(H3), C4(H4), C15(H15), C6(H6), C11(H11), C12(H12)
8.e Idealised Me refined as rotating group:
 C40(H40A,H40B,H40C), C42(H42A,H42B,H42C), C34(H34A,H34B,H34C), C32(H32A,H32B,
 H32C), C38A(H38A,H38B,H38C), C34A(H34D,H34E,H34F), C32A(H32D,H32E,H32F),
 C38B(H38D,H38E,H38F)
8.f Idealised tetrahedral OH refined as rotating group:
 O14(H14)
;
_atom_sites_solution_hydrogens   mixed
_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
C40 C 1.0603(9) 0.124(2) 1.1613(12) 0.073(5) Uani 0.5 1 d D . P A -1
H40A H 1.095972 0.155293 1.137586 0.109 Uiso 0.5 1 calc R U P A -1
H40B H 1.082015 0.047711 1.199695 0.109 Uiso 0.5 1 calc R U P A -1
H40C H 1.056312 0.181486 1.209445 0.109 Uiso 0.5 1 calc R U P A -1
N5 N 0.9753(7) 0.0023(7) 0.9921(7) 0.059(2) Uani 0.5 1 d D . P A -1
H5 H 0.916767 -0.012446 0.941711 0.071 Uiso 0.5 1 calc R U P A -1
C41 C 1.0065(8) -0.1166(7) 1.0484(8) 0.052(2) Uani 0.5 1 d D . P A -1
H41A H 0.989040 -0.127717 1.101481 0.062 Uiso 0.5 1 calc R U P A -1
H41B H 1.065941 -0.114993 1.088314 0.062 Uiso 0.5 1 calc R U P A -1
C1 C 0.6054(3) 0.2181(5) 0.4949(4) 0.0219(9) Uani 1 1 d . . . . .
C42 C 0.9776(8) -0.2230(9) 0.9713(10) 0.052(2) Uani 0.5 1 d D U P A -1
H42A H 1.005118 -0.223048 0.930090 0.078 Uiso 0.5 1 calc R U P A -1
H42B H 0.919547 -0.216486 0.921868 0.078 Uiso 0.5 1 calc R U P A -1
H42C H 0.989534 -0.297762 1.012390 0.078 Uiso 0.5 1 calc R U P A -1
C2 C 0.6734(3) 0.2823(5) 0.4977(4) 0.0241(10) Uani 1 1 d . . . . .
C3 C 0.7503(3) 0.2733(6) 0.5892(5) 0.0297(11) Uani 1 1 d . . . . .
H3 H 0.758172 0.225565 0.648351 0.036 Uiso 1 1 calc R U . . .
C4 C 0.8146(4) 0.3331(7) 0.5941(6) 0.0456(16) Uani 1 1 d . . . . .
H4 H 0.866417 0.325923 0.656316 0.055 Uiso 1 1 calc R U . . .
C15 C 0.8041(4) 0.4024(7) 0.5101(7) 0.0483(17) Uani 1 1 d . . . . .
H15 H 0.848773 0.443184 0.514468 0.058 Uiso 1 1 calc R U . . .
C6 C 0.7295(5) 0.4142(7) 0.4187(6) 0.0434(16) Uani 1 1 d . . . . .
H6 H 0.722652 0.463951 0.361245 0.052 Uiso 1 1 calc R U . . .
C7 C 0.6637(4) 0.3521(6) 0.4112(5) 0.0337(13) Uani 1 1 d . . . . .
C8 C 0.500000 -0.1011(6) 0.500000 0.0201(13) Uani 1 2 d S T P D .
C9 C 0.500000 -0.2358(8) 0.500000 0.0246(16) Uani 1 2 d S T P . .
C11 C 0.4964(3) -0.4248(7) 0.4160(7) 0.053(2) Uani 1 1 d . . . . .
H11 H 0.493867 -0.468175 0.357736 0.063 Uiso 1 1 calc R U . D .
C12 C 0.500000 -0.4851(9) 0.500000 0.061(4) Uani 1 2 d S T P D .
H12 H 0.500001 -0.570304 0.500001 0.073 Uiso 1 2 calc R U P . .
O14 O 0.5939(3) 0.3650(6) 0.3193(4) 0.0580(14) Uani 1 1 d . . . . .
H14 H 0.557947 0.327069 0.323152 0.087 Uiso 1 1 calc R U . . .
N1 N 0.6196(3) 0.3384(6) 0.8090(5) 0.0522(17) Uani 1 1 d . . . . .
N2 N 0.7362(3) 0.0115(5) 0.8064(4) 0.0327(10) Uani 1 1 d . . . . .
N3 N 0.5162(3) -0.0044(6) 0.8166(4) 0.0435(13) Uani 1 1 d . . . . .
O1 O 0.6268(3) 0.3247(4) 0.7285(4) 0.0431(11) Uani 1 1 d . . . . .
O2 O 0.5873(3) 0.2523(6) 0.8326(5) 0.0495(15) Uani 1 1 d . . . . .
O3 O 0.6417(4) 0.4317(6) 0.8634(6) 0.080(2) Uani 1 1 d . . . . .
O4 O 0.6182(2) 0.1556(4) 0.5747(3) 0.0279(8) Uani 1 1 d . . . . .
O5 O 0.5362(2) 0.2300(4) 0.4117(3) 0.0299(8) Uani 1 1 d . . . . .
O6 O 0.5091(2) -0.0482(4) 0.5828(3) 0.0244(7) Uani 1 1 d . . . . .
O8 O 0.72064(19) 0.1134(7) 0.8287(3) 0.0384(8) Uani 1 1 d . . . . .
O9 O 0.8032(3) -0.0330(5) 0.8552(5) 0.0599(14) Uani 1 1 d . . . . .
O10 O 0.6778(2) -0.0437(4) 0.7284(3) 0.0284(8) Uani 1 1 d . . . . .
O11 O 0.5879(3) -0.0197(6) 0.8350(4) 0.0410(14) Uani 1 1 d . . . . .
O12 O 0.4934(4) -0.0480(8) 0.8730(5) 0.085(2) Uani 1 1 d . . . . .
O13 O 0.4716(2) 0.0607(5) 0.7376(3) 0.0398(10) Uani 1 1 d . . . . .
C34 C 0.836(2) -0.6100(12) 0.894(3) 0.039(5) Uani 0.524(11) 1 d D U P B 1
H34A H 0.841673 -0.622623 0.831326 0.059 Uiso 0.524(11) 1 calc R U P B 1
H34B H 0.791911 -0.659706 0.887774 0.059 Uiso 0.524(11) 1 calc R U P B 1
H34C H 0.885988 -0.632307 0.959610 0.059 Uiso 0.524(11) 1 calc R U P B 1
N4 N 0.7382(7) -0.4357(11) 0.8090(8) 0.049(3) Uani 0.524(11) 1 d D U P B 1
H4A H 0.696751 -0.480466 0.816903 0.059 Uiso 0.524(11) 1 calc R U P B 1
C32 C 0.698(2) -0.304(2) 0.907(2) 0.069(5) Uani 0.524(11) 1 d D U P B 1
H32A H 0.678409 -0.223221 0.908362 0.104 Uiso 0.524(11) 1 calc R U P B 1
H32B H 0.743846 -0.323074 0.978413 0.104 Uiso 0.524(11) 1 calc R U P B 1
H32C H 0.655532 -0.362482 0.886873 0.104 Uiso 0.524(11) 1 calc R U P B 1
C33 C 0.8176(7) -0.4780(10) 0.9005(10) 0.045(3) Uani 0.524(11) 1 d D U P B 1
H33A H 0.818380 -0.464433 0.968850 0.054 Uiso 0.524(11) 1 calc R U P B 1
H33B H 0.860763 -0.428467 0.902453 0.054 Uiso 0.524(11) 1 calc R U P B 1
C31 C 0.7259(12) -0.3065(11) 0.8248(13) 0.066(4) Uani 0.524(11) 1 d D U P B 1
H31A H 0.684635 -0.270256 0.756032 0.079 Uiso 0.524(11) 1 calc R U P B 1
H31B H 0.776603 -0.261107 0.851910 0.079 Uiso 0.524(11) 1 calc R U P B 1
C39 C 0.9771(7) 0.1018(9) 1.0636(9) 0.059(2) Uani 0.5 1 d D U P A -1
H39A H 0.939362 0.082220 1.088645 0.071 Uiso 0.5 1 calc R U P A -1
H39B H 0.958119 0.176728 1.020959 0.071 Uiso 0.5 1 calc R U P A -1
C38A C 0.7736(11) -0.389(2) 0.6683(13) 0.088(5) Uani 0.524(11) 1 d D U P B 1
H38A H 0.742477 -0.331448 0.610317 0.132 Uiso 0.524(11) 1 calc R U P B 1
H38B H 0.800335 -0.445928 0.645076 0.132 Uiso 0.524(11) 1 calc R U P B 1
H38C H 0.814046 -0.345752 0.732249 0.132 Uiso 0.524(11) 1 calc R U P B 1
C37 C 0.7174(8) -0.4569(12) 0.6953(9) 0.054(3) Uani 0.524(11) 1 d D U P B 1
H37A H 0.661428 -0.430771 0.645839 0.065 Uiso 0.524(11) 1 calc R U P B 1
H37B H 0.720708 -0.543834 0.684077 0.065 Uiso 0.524(11) 1 calc R U P B 1
Tb1 Tb 0.57581(2) 0.11202(14) 0.69191(2) 0.01967(11) Uani 1 1 d . . . . .
O7 O 0.4884(5) -0.2549(8) 0.3274(6) 0.0374(11) Uani 0.5 1 d . U P C -2
H7 H 0.491411 -0.179874 0.333306 0.056 Uiso 1 1 d R U . C -2
C10 C 0.4962(3) -0.2998(6) 0.4144(5) 0.0374(11) Uani 1 1 d . U . D -1
H10 H 0.493510 -0.258256 0.355169 0.045 Uiso 0.5 1 d R U P D -1
C13 C 0.9762(11) 0.1427(16) 0.8529(15) 0.076(5) Uani 0.5 1 d D . P A -1
H13A H 0.928203 0.123823 0.783745 0.114 Uiso 0.5 1 d R U P A -1
H13B H 0.962333 0.200373 0.892134 0.114 Uiso 0.5 1 d R U P A -1
H13C H 1.017253 0.177493 0.840365 0.114 Uiso 0.5 1 d R U P A -1
C14 C 1.0070(11) 0.0324(12) 0.9197(12) 0.064(3) Uani 0.5 1 d D . P A -1
H14A H 1.066060 0.039653 0.964717 0.077 Uiso 0.5 1 calc R U P A -1
H14B H 0.995590 -0.036364 0.870556 0.077 Uiso 0.5 1 calc R U P A -1
N4A N 0.7667(7) -0.4125(11) 0.8211(7) 0.034(3) Uani 0.476(11) 1 d D . P B 2
H4AA H 0.718631 -0.465205 0.796785 0.041 Uiso 0.476(11) 1 calc R U P B 2
C34A C 0.7114(13) -0.2789(18) 0.9107(19) 0.044(4) Uani 0.476(11) 1 d D . P B 2
H34D H 0.675986 -0.254607 0.835636 0.066 Uiso 0.476(11) 1 calc R U P B 2
H34E H 0.731560 -0.207286 0.956248 0.066 Uiso 0.476(11) 1 calc R U P B 2
H34F H 0.681339 -0.328710 0.934025 0.066 Uiso 0.476(11) 1 calc R U P B 2
C33A C 0.7801(12) -0.3486(19) 0.9199(11) 0.078(7) Uani 0.476(11) 1 d D . P B 2
H33C H 0.796091 -0.408794 0.977704 0.094 Uiso 0.476(11) 1 calc R U P B 2
H33D H 0.825968 -0.293098 0.942983 0.094 Uiso 0.476(11) 1 calc R U P B 2
C31A C 0.8338(10) -0.4904(14) 0.8429(16) 0.057(4) Uani 0.476(11) 1 d D . P B 2
H31C H 0.884542 -0.449202 0.893844 0.069 Uiso 0.476(11) 1 calc R U P B 2
H31D H 0.833806 -0.503578 0.775128 0.069 Uiso 0.476(11) 1 calc R U P B 2
C37A C 0.7502(16) -0.3348(15) 0.7298(11) 0.080(6) Uani 0.476(11) 1 d D . P B 2
H37C H 0.801658 -0.299767 0.743547 0.096 Uiso 0.476(11) 1 calc R U P B 2
H37D H 0.715661 -0.267695 0.726912 0.096 Uiso 0.476(11) 1 calc R U P B 2
C32A C 0.832(2) -0.611(2) 0.890(4) 0.049(7) Uani 0.476(11) 1 d D . P B 2
H32D H 0.795482 -0.664943 0.831351 0.073 Uiso 0.476(11) 1 calc R U P B 2
H32E H 0.811893 -0.600334 0.939702 0.073 Uiso 0.476(11) 1 calc R U P B 2
H32F H 0.885643 -0.645176 0.927969 0.073 Uiso 0.476(11) 1 calc R U P B 2
C38B C 0.7105(7) -0.3947(16) 0.6217(7) 0.036(3) Uani 0.476(11) 1 d D U P B 2
H38D H 0.664578 -0.346439 0.570088 0.054 Uiso 0.476(11) 1 calc R U P B 2
H38E H 0.691950 -0.474653 0.627414 0.054 Uiso 0.476(11) 1 calc R U P B 2
H38F H 0.749073 -0.402069 0.597067 0.054 Uiso 0.476(11) 1 calc R U P B 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
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C40 C39 1.526(6) . ?
N5 H5 1.0000 . ?
N5 C41 1.510(5) . ?
N5 C39 1.503(5) . ?
N5 C14 1.496(10) . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C41 C42 1.524(6) . ?
C1 C2 1.482(7) . ?
C1 O4 1.258(6) . ?
C1 O5 1.271(6) . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C2 C3 1.402(7) . ?
C2 C7 1.400(8) . ?
C3 H3 0.9500 . ?
C3 C4 1.382(9) . ?
C4 H4 0.9500 . ?
C4 C15 1.363(11) . ?
C15 H15 0.9500 . ?
C15 C6 1.379(11) . ?
C6 H6 0.9500 . ?
C6 C7 1.404(9) . ?
C7 O14 1.334(8) . ?
C8 C9 1.501(11) . ?
C8 O6 1.263(5) 2_656 ?
C8 O6 1.263(5) . ?
C9 C10 1.397(8) . ?
C11 H11 0.9500 . ?
C11 C12 1.357(10) . ?
C11 C10 1.392(11) . ?
C12 H12 0.9500 . ?
O14 H14 0.8400 . ?
N1 O1 1.250(8) . ?
N1 O2 1.281(10) . ?
N1 O3 1.240(8) . ?
N1 Tb1 2.913(6) . y
N2 O8 1.258(8) . ?
N2 O9 1.222(6) . ?
N2 O10 1.276(6) . ?
N2 Tb1 2.898(5) . y
N3 O11 1.285(7) . ?
N3 O12 1.208(7) . ?
N3 O13 1.254(7) . ?
N3 Tb1 2.893(5) . y
O1 Tb1 2.518(4) . y
O2 Tb1 2.482(5) . y
O4 Tb1 2.277(3) . y
O5 Tb1 2.316(3) 2_656 y
O6 Tb1 2.295(3) . y
O8 Tb1 2.474(3) . y
O10 Tb1 2.475(4) . y
O11 Tb1 2.446(5) . y
O13 Tb1 2.486(4) . y
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C34 C33 1.527(6) . ?
N4 H4A 1.0000 . ?
N4 C33 1.503(6) . ?
N4 C31 1.496(6) . ?
N4 C37 1.497(6) . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C32 C31 1.527(6) . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C31 H31A 0.9900 . ?
C31 H31B 0.9900 . ?
C39 H39A 0.9900 . ?
C39 H39B 0.9900 . ?
C38A H38A 0.9800 . ?
C38A H38B 0.9800 . ?
C38A H38C 0.9800 . ?
C38A C37 1.5297(13) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
O7 H7 0.8400 . ?
O7 H7 0.8400 . ?
C10 H10 0.9499 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9801 . ?
C13 H13C 0.9801 . ?
C13 C14 1.486(11) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
N4A H4AA 1.0000 . ?
N4A C33A 1.494(15) . ?
N4A C31A 1.457(15) . ?
N4A C37A 1.471(15) . ?
C34A H34D 0.9800 . ?
C34A H34E 0.9800 . ?
C34A H34F 0.9800 . ?
C34A C33A 1.49(2) . ?
C33A H33C 0.9900 . ?
C33A H33D 0.9900 . ?
C31A H31C 0.9900 . ?
C31A H31D 0.9900 . ?
C31A C32A 1.51(2) . ?
C37A H37C 0.9900 . ?
C37A H37D 0.9900 . ?
C37A C38B 1.500(16) . ?
C32A H32D 0.9800 . ?
C32A H32E 0.9800 . ?
C32A H32F 0.9800 . ?
C38B H38D 0.9800 . ?
C38B H38E 0.9800 . ?
C38B H38F 0.9800 . ?

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
H40A C40 H40B 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
C41 N5 H5 104.0 . . ?
C39 N5 H5 104.0 . . ?
C39 N5 C41 114.5(5) . . ?
C14 N5 H5 104.0 . . ?
C14 N5 C41 112.3(7) . . ?
C14 N5 C39 116.1(8) . . ?
N5 C41 H41A 109.0 . . ?
N5 C41 H41B 109.0 . . ?
N5 C41 C42 113.0(6) . . ?
H41A C41 H41B 107.8 . . ?
C42 C41 H41A 109.0 . . ?
C42 C41 H41B 109.0 . . ?
O4 C1 C2 118.9(4) . . ?
O4 C1 O5 123.1(4) . . ?
O5 C1 C2 118.0(4) . . ?
C41 C42 H42A 109.5 . . ?
C41 C42 H42B 109.5 . . ?
C41 C42 H42C 109.5 . . ?
H42A C42 H42B 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C3 C2 C1 119.5(5) . . ?
C7 C2 C1 121.9(5) . . ?
C7 C2 C3 118.5(5) . . ?
C2 C3 H3 119.7 . . ?
C4 C3 C2 120.6(6) . . ?
C4 C3 H3 119.7 . . ?
C3 C4 H4 119.8 . . ?
C15 C4 C3 120.4(6) . . ?
C15 C4 H4 119.8 . . ?
C4 C15 H15 119.5 . . ?
C4 C15 C6 120.9(6) . . ?
C6 C15 H15 119.5 . . ?
C15 C6 H6 120.2 . . ?
C15 C6 C7 119.6(6) . . ?
C7 C6 H6 120.2 . . ?
C2 C7 C6 119.9(6) . . ?
O14 C7 C2 123.8(5) . . ?
O14 C7 C6 116.2(6) . . ?
O6 C8 C9 117.8(3) 2_656 . ?
O6 C8 C9 117.8(3) . . ?
O6 C8 O6 124.3(7) 2_656 . ?
C10 C9 C8 120.7(4) . . ?
C12 C11 H11 119.7 . . ?
C12 C11 C10 120.6(8) . . ?
C10 C11 H11 119.7 . . ?
C11 C12 C11 120.6(10) 2_656 . ?
C11 C12 H12 119.7 2_656 . ?
C11 C12 H12 119.7 . . ?
C7 O14 H14 109.5 . . ?
O1 N1 O2 117.2(5) . . ?
O1 N1 Tb1 59.4(3) . . ?
O2 N1 Tb1 57.9(3) . . ?
O3 N1 O1 121.6(8) . . ?
O3 N1 O2 121.2(7) . . ?
O3 N1 Tb1 176.6(5) . . ?
O8 N2 O10 116.2(4) . . ?
O8 N2 Tb1 58.0(2) . . ?
O9 N2 O8 122.7(5) . . ?
O9 N2 O10 121.1(5) . . ?
O9 N2 Tb1 178.6(5) . . ?
O10 N2 Tb1 58.2(2) . . ?
O11 N3 Tb1 57.1(3) . . ?
O12 N3 O11 122.3(6) . . ?
O12 N3 O13 121.9(6) . . ?
O12 N3 Tb1 176.3(6) . . ?
O13 N3 O11 115.8(5) . . ?
O13 N3 Tb1 58.7(3) . . ?
N1 O1 Tb1 95.3(4) . . ?
N1 O2 Tb1 96.1(4) . . ?
C1 O4 Tb1 145.2(3) . . ?
C1 O5 Tb1 137.8(3) . 2_656 ?
C8 O6 Tb1 140.5(3) . . ?
N2 O8 Tb1 96.4(3) . . ?
N2 O10 Tb1 95.8(3) . . ?
N3 O11 Tb1 96.7(4) . . ?
N3 O13 Tb1 95.7(3) . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C33 C34 H34A 109.5 . . ?
C33 C34 H34B 109.5 . . ?
C33 C34 H34C 109.5 . . ?
C33 N4 H4A 105.2 . . ?
C31 N4 H4A 105.2 . . ?
C31 N4 C33 109.8(11) . . ?
C31 N4 C37 110.2(10) . . ?
C37 N4 H4A 105.2 . . ?
C37 N4 C33 120.0(10) . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
C34 C33 H33A 108.6 . . ?
C34 C33 H33B 108.6 . . ?
N4 C33 C34 114.5(17) . . ?
N4 C33 H33A 108.6 . . ?
N4 C33 H33B 108.6 . . ?
H33A C33 H33B 107.6 . . ?
N4 C31 C32 106.6(13) . . ?
N4 C31 H31A 110.4 . . ?
N4 C31 H31B 110.4 . . ?
C32 C31 H31A 110.4 . . ?
C32 C31 H31B 110.4 . . ?
H31A C31 H31B 108.6 . . ?
C40 C39 H39A 108.9 . . ?
C40 C39 H39B 108.9 . . ?
N5 C39 C40 113.3(7) . . ?
N5 C39 H39A 108.9 . . ?
N5 C39 H39B 108.9 . . ?
H39A C39 H39B 107.7 . . ?
H38A C38A H38B 109.5 . . ?
H38A C38A H38C 109.5 . . ?
H38B C38A H38C 109.5 . . ?
C37 C38A H38A 109.5 . . ?
C37 C38A H38B 109.5 . . ?
C37 C38A H38C 109.5 . . ?
N4 C37 C38A 111.8(7) . . ?
N4 C37 H37A 109.3 . . ?
N4 C37 H37B 109.3 . . ?
C38A C37 H37A 109.3 . . ?
C38A C37 H37B 109.3 . . ?
H37A C37 H37B 107.9 . . ?
O2 Tb1 O1 51.20(19) . . y
O2 Tb1 O13 71.02(18) . . y
O4 Tb1 O1 72.77(15) . . y
O4 Tb1 O2 123.90(19) . . y
O4 Tb1 O5 88.39(13) . 2_656 y
O4 Tb1 O6 86.89(13) . . y
O4 Tb1 O8 84.37(13) . . y
O4 Tb1 O10 75.99(13) . . y
O4 Tb1 O11 147.10(15) . . y
O4 Tb1 O13 153.34(13) . . y
O5 Tb1 O1 74.89(14) 2_656 . y
O5 Tb1 O2 80.54(18) 2_656 . y
O5 Tb1 O8 145.05(19) 2_656 . y
O5 Tb1 O10 156.69(13) 2_656 . y
O5 Tb1 O11 122.80(15) 2_656 . y
O5 Tb1 O13 71.51(14) 2_656 . y
O6 Tb1 O1 154.14(14) . . y
O6 Tb1 O2 146.77(17) . . y
O6 Tb1 O5 89.05(13) . 2_656 y
O6 Tb1 O8 124.48(18) . . y
O6 Tb1 O10 73.14(12) . . y
O6 Tb1 O11 83.77(17) . . y
O6 Tb1 O13 75.75(14) . . y
O8 Tb1 O1 70.29(19) . . y
O8 Tb1 O2 75.47(19) . . y
O8 Tb1 O10 51.53(18) . . y
O8 Tb1 O13 122.12(13) . . y
O10 Tb1 O1 115.48(14) . . y
O10 Tb1 O2 122.52(17) . . y
O10 Tb1 O13 116.66(14) . . y
O11 Tb1 O1 121.93(18) . . y
O11 Tb1 O2 75.90(15) . . y
O11 Tb1 O8 75.33(18) . . y
O11 Tb1 O10 71.11(15) . . y
O11 Tb1 O13 51.69(15) . . y
O13 Tb1 O1 116.44(16) . . y
H7 O7 H7 0.0 . . ?
C9 C10 H10 120.1 . . ?
C11 C10 C9 119.8(8) . . ?
C11 C10 H10 120.1 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C14 C13 H13A 110.0 . . ?
C14 C13 H13B 107.7 . . ?
C14 C13 H13C 110.6 . . ?
N5 C14 H14A 107.8 . . ?
N5 C14 H14B 107.8 . . ?
C13 C14 N5 117.9(11) . . ?
C13 C14 H14A 107.8 . . ?
C13 C14 H14B 107.8 . . ?
H14A C14 H14B 107.2 . . ?
C33A N4A H4AA 107.1 . . ?
C31A N4A H4AA 107.1 . . ?
C31A N4A C33A 112.0(12) . . ?
C31A N4A C37A 107.9(14) . . ?
C37A N4A H4AA 107.1 . . ?
C37A N4A C33A 115.4(13) . . ?
H34D C34A H34E 109.5 . . ?
H34D C34A H34F 109.5 . . ?
H34E C34A H34F 109.5 . . ?
C33A C34A H34D 109.5 . . ?
C33A C34A H34E 109.5 . . ?
C33A C34A H34F 109.5 . . ?
N4A C33A H33C 108.1 . . ?
N4A C33A H33D 108.1 . . ?
C34A C33A N4A 116.8(14) . . ?
C34A C33A H33C 108.1 . . ?
C34A C33A H33D 108.1 . . ?
H33C C33A H33D 107.3 . . ?
N4A C31A H31C 108.9 . . ?
N4A C31A H31D 108.9 . . ?
N4A C31A C32A 113.6(15) . . ?
H31C C31A H31D 107.7 . . ?
C32A C31A H31C 108.9 . . ?
C32A C31A H31D 108.9 . . ?
N4A C37A H37C 108.4 . . ?
N4A C37A H37D 108.4 . . ?
N4A C37A C38B 115.6(13) . . ?
H37C C37A H37D 107.4 . . ?
C38B C37A H37C 108.4 . . ?
C38B C37A H37D 108.4 . . ?
C31A C32A H32D 109.5 . . ?
C31A C32A H32E 109.5 . . ?
C31A C32A H32F 109.5 . . ?
H32D C32A H32E 109.5 . . ?
H32D C32A H32F 109.5 . . ?
H32E C32A H32F 109.5 . . ?
C37A C38B H38D 109.5 . . ?
C37A C38B H38E 109.5 . . ?
C37A C38B H38F 109.5 . . ?
H38D C38B H38E 109.5 . . ?
H38D C38B H38F 109.5 . . ?
H38E C38B H38F 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
C41 N5 C39 C40 55.9(17) . . . . ?
C41 N5 C14 C13 175.5(14) . . . . ?
C1 C2 C3 C4 -179.5(6) . . . . ?
C1 C2 C7 C6 178.2(6) . . . . ?
C1 C2 C7 O14 -1.4(10) . . . . ?
C2 C1 O4 Tb1 132.4(5) . . . . ?
C2 C1 O5 Tb1 142.6(4) . . . 2_656 ?
C2 C3 C4 C15 0.3(10) . . . . ?
C3 C2 C7 C6 -2.1(9) . . . . ?
C3 C2 C7 O14 178.4(6) . . . . ?
C3 C4 C15 C6 -0.1(12) . . . . ?
C4 C15 C6 C7 -1.2(12) . . . . ?
C15 C6 C7 C2 2.3(11) . . . . ?
C15 C6 C7 O14 -178.1(7) . . . . ?
C7 C2 C3 C4 0.8(9) . . . . ?
C8 C9 C10 C11 179.96(9) . . . . ?
C9 C8 O6 Tb1 138.0(4) . . . . ?
C12 C11 C10 C9 0.09(19) . . . . ?
O1 N1 O2 Tb1 4.7(6) . . . . ?
O2 N1 O1 Tb1 -4.6(6) . . . . ?
O3 N1 O1 Tb1 176.2(5) . . . . ?
O3 N1 O2 Tb1 -176.1(5) . . . . ?
O4 C1 C2 C3 -0.6(8) . . . . ?
O4 C1 C2 C7 179.1(5) . . . . ?
O4 C1 O5 Tb1 -38.1(8) . . . 2_656 ?
O5 C1 C2 C3 178.7(5) . . . . ?
O5 C1 C2 C7 -1.6(8) . . . . ?
O5 C1 O4 Tb1 -46.9(8) . . . . ?
O6 C8 C9 C10 -175.2(3) . . . . ?
O6 C8 C9 C10 4.8(3) 2_656 . . . ?
O6 C8 O6 Tb1 -42.1(4) 2_656 . . . ?
O8 N2 O10 Tb1 -1.9(5) . . . . ?
O9 N2 O8 Tb1 -178.6(5) . . . . ?
O9 N2 O10 Tb1 178.6(5) . . . . ?
O10 N2 O8 Tb1 1.9(5) . . . . ?
O11 N3 O13 Tb1 -2.9(6) . . . . ?
O12 N3 O11 Tb1 -175.6(7) . . . . ?
O12 N3 O13 Tb1 175.7(7) . . . . ?
O13 N3 O11 Tb1 3.0(6) . . . . ?
C33 N4 C31 C32 -79(2) . . . . ?
C33 N4 C37 C38A -64.4(17) . . . . ?
C31 N4 C33 C34 178.7(16) . . . . ?
C31 N4 C37 C38A 64.4(18) . . . . ?
C39 N5 C41 C42 159.5(11) . . . . ?
C39 N5 C14 C13 -50.1(19) . . . . ?
C37 N4 C33 C34 -52(2) . . . . ?
C37 N4 C31 C32 146.6(17) . . . . ?
C10 C11 C12 C11 -0.04(9) . . . 2_656 ?
C14 N5 C41 C42 -65.3(15) . . . . ?
C14 N5 C39 C40 -77.5(15) . . . . ?
C33A N4A C31A C32A 82(3) . . . . ?
C33A N4A C37A C38B -160.5(17) . . . . ?
C31A N4A C33A C34A -172.3(16) . . . . ?
C31A N4A C37A C38B 73(2) . . . . ?
C37A N4A C33A C34A 64(2) . . . . ?
C37A N4A C31A C32A -150(2) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
