# Supplementary Information (SI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 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_exp_336_auto
_database_code_depnum_ccdc_archive 'CCDC 2395042'
loop_
_audit_author_name
_audit_author_address
'Marzio Rancan'
;ICMATE CNR
Italy
;
_audit_update_record             
;
2025-04-02 deposited with the CCDC.	2025-05-30 downloaded from the CCDC.
;
_audit_creation_date             2025-04-01
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.03.04 svn.red2d20d0 for OlexSys, GUI svn.r7188)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'C92 H62 Cl4 Eu2 F18 N4 O14 P2 Pt2 S6, 2(C H Cl3), 2[CHCl3]'
_chemical_formula_sum            'C96 H66 Cl16 Eu2 F18 N4 O14 P2 Pt2 S6'
_chemical_formula_weight         3357.12
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Eu2 Pt2 Cl2 S6 F18 O14 N4 P2 C30'
_chemical_oxdiff_usercomment     'MB198 CHCl3/C6 150K '
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'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -8.9294 11.1857 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 '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'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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           14
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   12.5622(3)
_cell_length_b                   34.5447(7)
_cell_length_c                   13.9645(4)
_cell_angle_alpha                90
_cell_angle_beta                 98.839(3)
_cell_angle_gamma                90
_cell_volume                     5988.0(2)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    5681
_cell_measurement_temperature    150(3)
_cell_measurement_theta_max      68.6160
_cell_measurement_theta_min      4.0770
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    16.927
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.26895
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.41.103a (Rigaku Oxford Diffraction, 2021)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.862
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             3248
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.05
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0515
_diffrn_reflns_av_unetI/netI     0.0527
_diffrn_reflns_Laue_measured_fraction_full 0.986
_diffrn_reflns_Laue_measured_fraction_max 0.975
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       40
_diffrn_reflns_limit_k_min       -41
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            28202
_diffrn_reflns_point_group_measured_fraction_full 0.986
_diffrn_reflns_point_group_measured_fraction_max 0.975
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         68.701
_diffrn_reflns_theta_min         3.449
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      150(3)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.1274
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.975
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -21.00   5.00   0.50    2.00    --  -34.12 114.00  80.00   52
  2  ω    -75.00 -26.00   0.50    2.00    --  -34.12 114.00  80.00   98
  3  ω     59.00  84.00   0.50    2.00    --   34.12-114.00  -9.00   50
  4  ω    103.00 143.00   0.50    8.50    --  103.52 114.00  80.00   80
  5  ω    -43.00 -17.00   0.50    2.00    --  -34.12 -57.00-180.00   52
  6  ω   -107.00 -27.00   0.50    2.00    --  -34.12 -38.00 120.00  160
  7  ω    -31.00  32.00   0.50    2.00    --  -34.12  57.00-120.00  126
  8  ω    -83.00 -57.00   0.50    2.00    --  -34.12 -57.00-180.00   52
  9  ω     34.00  98.00   0.50    2.00    --   34.12  57.00 -90.00  128
 10  ω     21.00  63.00   0.50    2.00    --   34.12 -77.00 150.00   84
 11  ω     60.00 107.00   0.50    2.00    --   34.12-178.00  60.00   94
 12  ω     65.00 110.00   0.50    2.00    --   34.12 178.00 -60.00   90
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0726422000
_diffrn_orient_matrix_UB_12      0.0358035000
_diffrn_orient_matrix_UB_13      0.0246332000
_diffrn_orient_matrix_UB_21      -0.1004301000
_diffrn_orient_matrix_UB_22      0.0256295000
_diffrn_orient_matrix_UB_23      -0.0007528000
_diffrn_orient_matrix_UB_31      0.0024026000
_diffrn_orient_matrix_UB_32      -0.0075448000
_diffrn_orient_matrix_UB_33      0.1090322000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9789
_reflns_number_total             10788
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _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 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_collection       'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_reduction        'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         1.798
_refine_diff_density_min         -1.169
_refine_diff_density_rms         0.171
_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     732
_refine_ls_number_reflns         10788
_refine_ls_number_restraints     126
_refine_ls_R_factor_all          0.0515
_refine_ls_R_factor_gt           0.0462
_refine_ls_restrained_S_all      1.069
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0763P)²+11.2361P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1227
_refine_ls_wR_factor_ref         0.1293
_refine_special_details          ?
_olex2_refinement_description    
;
1. Restrained distances
 S2A-C5 \\sim S2A-C8 \\sim S2B-C7 \\sim S2B-C5
 with sigma of 0.02
 C1-F3B \\sim C1-F1B \\sim C1-F2B \\sim C1-F3A \\sim C1-F1A \\sim C1-F2A
 with sigma of 0.02
 F3B-F1B \\sim F3B-F2B \\sim F1B-F2B \\sim F3A-F1A \\sim F3A-F2A \\sim F1A-F2A
 with sigma of 0.04
 C6B-S2B \\sim S2B-C8 \\sim C6A-S2A \\sim S2A-C7
 with sigma of 0.02
 C6B-C5 \\sim C8-C7 \\sim C6A-C5
 with sigma of 0.02
2. Restrained planarity
 S2B, C7, C8, C6B, C5
 with sigma of 0.1
3. Rigid body (RIGU) restrains
 O6, O3, O7, O2, O1, O4, O5
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
 F2B, F3B, F1B, C1, F3A, F1A, F2A
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
 C6B, S2B, C5, C8, C7, C6A, S2A
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
4. Others
 Sof(C6B)=Sof(H6B)=Sof(S2B)=Sof(H8B)=Sof(H7B)=1-FVAR(1)
 Sof(H8A)=Sof(H7A)=Sof(C6A)=Sof(H6A)=Sof(S2A)=FVAR(1)
 Sof(F2B)=Sof(F3B)=Sof(F1B)=1-FVAR(2)
 Sof(F3A)=Sof(F1A)=Sof(F2A)=FVAR(2)
5.a Ternary CH refined with riding coordinates:
 C47(H47)
5.b Aromatic/amide H refined with riding coordinates:
 C6B(H6B), C26(H26), C28(H28), C27(H27), C19(H19), C36(H36), C25(H25),
 C22(H22), C40(H40), C11(H11), C10(H10), C30(H30), C3(H3), C14(H14), C39(H39),
 C23(H23), C38(H38), C34(H34), C9(H9), C42(H42), C8(H8A), C8(H8B), C37(H37),
 C24(H24), C32(H32), C31(H31), C46(H46), C45(H45), C43(H43), C7(H7B), C7(H7A),
 C33(H33), C44(H44), C6A(H6A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Pt1 Pt 0.74427(2) 0.69019(2) 0.39430(2) 0.01599(9) Uani 1 1 d . . . . .
Eu1 Eu 0.61307(3) 0.49226(2) 0.62633(2) 0.01486(10) Uani 1 1 d . . . . .
Cl2 Cl 0.74488(13) 0.66593(4) 0.24073(11) 0.0287(3) Uani 1 1 d . . . . .
Cl1 Cl 0.74614(12) 0.71109(4) 0.54947(11) 0.0285(3) Uani 1 1 d . . . . .
P1 P 0.79931(11) 0.74678(4) 0.34248(11) 0.0179(3) Uani 1 1 d . . . . .
S1 S 0.39897(17) 0.41477(4) 0.83502(14) 0.0381(4) Uani 1 1 d . . . . .
S3 S 0.75042(17) 0.44016(5) 0.95155(14) 0.0389(4) Uani 1 1 d . . . . .
C6B C 0.619(4) 0.3466(11) 0.656(2) 0.031(8) Uani 0.209(9) 1 d D . P A 2
H6B H 0.594018 0.362249 0.703701 0.037 Uiso 0.209(9) 1 calc R U P A 2
Cl5 Cl 0.9000(2) 0.56437(9) 0.2308(3) 0.0807(8) Uani 1 1 d . . . . .
Cl3 Cl 0.9982(2) 0.60964(10) 0.3992(2) 0.0809(8) Uani 1 1 d . . . . .
Cl4 Cl 1.1121(2) 0.59781(11) 0.2405(2) 0.0863(9) Uani 1 1 d . . . . .
O6 O 0.4881(4) 0.47409(12) 0.7271(3) 0.0247(9) Uani 1 1 d . . . . .
F2B F 0.788(3) 0.4908(5) 0.327(2) 0.046(4) Uani 0.44(6) 1 d D . P B 2
O3 O 0.7190(4) 0.48163(12) 0.7735(3) 0.0263(9) Uani 1 1 d . . . . .
O7 O 0.7169(4) 0.48066(12) 0.5005(3) 0.0260(9) Uani 1 1 d . . . . .
N1 N 0.6870(4) 0.63580(13) 0.4370(4) 0.0177(10) Uani 1 1 d . . . . .
O2 O 0.7492(4) 0.53976(12) 0.6442(3) 0.0281(10) Uani 1 1 d . . . . .
F6 F 0.4356(5) 0.61787(13) 0.7087(4) 0.0616(15) Uani 1 1 d . . . . .
F4 F 0.4359(5) 0.60630(13) 0.8590(4) 0.0648(17) Uani 1 1 d . . . . .
F5 F 0.5820(5) 0.61571(13) 0.8049(4) 0.0614(15) Uani 1 1 d . . . . .
O1 O 0.5441(3) 0.53419(11) 0.4890(3) 0.0206(9) Uani 1 1 d . . . . .
O4 O 0.6424(4) 0.42477(11) 0.6179(3) 0.0241(9) Uani 1 1 d . . . . .
F8 F 0.9539(5) 0.59704(17) 0.7624(4) 0.0720(18) Uani 1 1 d . . . . .
O5 O 0.5405(4) 0.54948(12) 0.6878(3) 0.0289(10) Uani 1 1 d . . . . .
F7 F 0.8984(5) 0.59057(17) 0.6136(4) 0.0721(18) Uani 1 1 d . . . . .
F9 F 0.8013(5) 0.61874(14) 0.7002(6) 0.0766(19) Uani 1 1 d . . . . .
F3B F 0.799(3) 0.4298(4) 0.3157(13) 0.056(5) Uani 0.44(6) 1 d D . P B 2
N2 N 0.5936(4) 0.56705(13) 0.4742(4) 0.0181(10) Uani 1 1 d . . . . .
F1B F 0.9176(9) 0.4607(12) 0.4121(17) 0.071(5) Uani 0.44(6) 1 d D . P B 2
S2B S 0.699(2) 0.3257(3) 0.5082(13) 0.059(6) Uani 0.209(9) 1 d D . P A 2
C26 C 0.5651(5) 0.59973(16) 0.5161(4) 0.0196(11) Uani 1 1 d . . . . .
H26 H 0.512743 0.599153 0.558509 0.024 Uiso 1 1 calc R U . . .
C28 C 0.7157(5) 0.60233(16) 0.3998(5) 0.0247(13) Uani 1 1 d . . . . .
H28 H 0.769603 0.602698 0.359001 0.030 Uiso 1 1 calc R U . . .
C27 C 0.6132(5) 0.63403(16) 0.4964(4) 0.0205(12) Uani 1 1 d . . . . .
H27 H 0.593419 0.657164 0.525948 0.025 Uiso 1 1 calc R U . . .
C35 C 0.6959(5) 0.77242(17) 0.2615(5) 0.0233(13) Uani 1 1 d . . . . .
C19 C 0.8345(5) 0.5352(2) 0.8084(5) 0.0279(13) Uani 1 1 d . . . . .
H19 H 0.883478 0.548007 0.856725 0.033 Uiso 1 1 calc R U . . .
C5 C 0.6665(5) 0.35960(17) 0.5813(5) 0.0261(13) Uani 1 1 d D . . . .
C2 C 0.7503(5) 0.45087(18) 0.4623(5) 0.0247(13) Uani 1 1 d . . . . .
C36 C 0.6049(5) 0.75323(19) 0.2148(6) 0.0320(15) Uani 1 1 d . . . . .
H36 H 0.597340 0.726179 0.224013 0.038 Uiso 1 1 calc R U . . .
C41 C 0.8429(6) 0.78283(18) 0.4352(5) 0.0311(15) Uani 1 1 d . . . . .
C25 C 0.6706(5) 0.56771(17) 0.4183(5) 0.0246(13) Uani 1 1 d . . . . .
H25 H 0.693648 0.544422 0.391670 0.030 Uiso 1 1 calc R U . . .
C13 C 0.4571(5) 0.48895(18) 0.8024(5) 0.0232(13) Uani 1 1 d . . . . .
C18 C 0.8122(5) 0.55125(17) 0.7169(5) 0.0233(13) Uani 1 1 d . . . . .
C12 C 0.4120(5) 0.46290(17) 0.8670(5) 0.0234(12) Uani 1 1 d . . . . .
C22 C 0.8718(6) 0.4975(2) 1.0138(5) 0.0362(16) Uani 1 1 d . . . . .
H22 H 0.910031 0.521311 1.017869 0.043 Uiso 1 1 calc R U . . .
C40 C 0.7057(6) 0.81212(18) 0.2464(6) 0.0324(16) Uani 1 1 d . . . . .
H40 H 0.767597 0.825675 0.276834 0.039 Uiso 1 1 calc R U . . .
C11 C 0.3726(5) 0.4698(2) 0.9509(5) 0.0296(14) Uani 1 1 d . . . . .
H11 H 0.371638 0.494622 0.979878 0.036 Uiso 1 1 calc R U . . .
C29 C 0.9148(5) 0.73998(17) 0.2807(5) 0.0254(13) Uani 1 1 d . . . . .
C10 C 0.3333(6) 0.4360(2) 0.9902(5) 0.0319(15) Uani 1 1 d . . . . .
H10 H 0.304237 0.435470 1.049125 0.038 Uiso 1 1 calc R U . . .
C30 C 0.9914(6) 0.7133(2) 0.3151(6) 0.0378(17) Uani 1 1 d . . . . .
H30 H 0.981504 0.697740 0.369106 0.045 Uiso 1 1 calc R U . . .
C20 C 0.7861(5) 0.50003(18) 0.8323(5) 0.0229(12) Uani 1 1 d . . . . .
C1 C 0.8148(6) 0.45977(18) 0.3807(5) 0.0438(13) Uani 1 1 d D . . . .
C3 C 0.7360(5) 0.41264(17) 0.4861(5) 0.0244(13) Uani 1 1 d . . . . .
H3 H 0.763973 0.393031 0.449265 0.029 Uiso 1 1 calc R U . . .
C21 C 0.8109(5) 0.4835(2) 0.9293(5) 0.0279(14) Uani 1 1 d . . . . .
C14 C 0.4604(5) 0.52906(18) 0.8225(5) 0.0271(13) Uani 1 1 d . . . . .
H14 H 0.436225 0.537855 0.879948 0.032 Uiso 1 1 calc R U . . .
C39 C 0.6235(7) 0.8320(2) 0.1860(6) 0.0406(18) Uani 1 1 d . . . . .
H39 H 0.629455 0.859085 0.176535 0.049 Uiso 1 1 calc R U . . .
C23 C 0.8700(6) 0.4725(3) 1.0920(6) 0.047(2) Uani 1 1 d . . . . .
H23 H 0.908772 0.477377 1.154788 0.056 Uiso 1 1 calc R U . . .
C38 C 0.5358(7) 0.8126(2) 0.1412(7) 0.047(2) Uani 1 1 d . . . . .
H38 H 0.480952 0.826181 0.100026 0.056 Uiso 1 1 calc R U . . .
C17 C 0.8685(6) 0.5899(2) 0.6985(5) 0.0339(16) Uani 1 1 d . . . . .
C34 C 0.9296(6) 0.7617(2) 0.2005(6) 0.0421(19) Uani 1 1 d . . . . .
H34 H 0.877067 0.780281 0.174871 0.051 Uiso 1 1 calc R U . . .
C9 C 0.3416(6) 0.4046(2) 0.9352(6) 0.0370(17) Uani 1 1 d . . . . .
H9 H 0.318047 0.379481 0.950268 0.044 Uiso 1 1 calc R U . . .
C42 C 0.9499(8) 0.7928(3) 0.4599(6) 0.048(2) Uani 1 1 d . . . . .
H42 H 1.003358 0.780362 0.429480 0.058 Uiso 1 1 calc R U . . .
C8 C 0.6125(7) 0.3002(2) 0.6496(7) 0.052(2) Uani 1 1 d D . . . .
H8A H 0.586258 0.280520 0.687374 0.063 Uiso 0.791(9) 1 calc R U P A 1
H8B H 0.585231 0.282677 0.692323 0.063 Uiso 0.209(9) 1 calc R U P A 2
C16 C 0.4867(7) 0.5991(2) 0.7853(6) 0.0369(17) Uani 1 1 d . . . . .
C37 C 0.5258(6) 0.7732(2) 0.1554(7) 0.046(2) Uani 1 1 d . . . . .
H37 H 0.464069 0.759846 0.124027 0.055 Uiso 1 1 calc R U . . .
C24 C 0.8092(7) 0.4411(3) 1.0707(6) 0.051(2) Uani 1 1 d . . . . .
H24 H 0.799493 0.421554 1.116375 0.061 Uiso 1 1 calc R U . . .
C15 C 0.4968(5) 0.55573(18) 0.7630(5) 0.0274(14) Uani 1 1 d . . . . .
C4 C 0.6816(5) 0.40147(16) 0.5630(4) 0.0206(12) Uani 1 1 d . . . . .
C32 C 1.0969(7) 0.7296(3) 0.1936(8) 0.058(3) Uani 1 1 d . . . . .
H32 H 1.158788 0.725751 0.163201 0.070 Uiso 1 1 calc R U . . .
C31 C 1.0836(7) 0.7084(3) 0.2726(8) 0.054(2) Uani 1 1 d . . . . .
H31 H 1.137096 0.690270 0.298945 0.065 Uiso 1 1 calc R U . . .
C46 C 0.7653(8) 0.8014(2) 0.4798(7) 0.050(2) Uani 1 1 d . . . . .
H46 H 0.691478 0.794564 0.463304 0.060 Uiso 1 1 calc R U . . .
C45 C 0.7963(11) 0.8297(3) 0.5483(8) 0.075(4) Uani 1 1 d . . . . .
H45 H 0.743296 0.842551 0.578363 0.090 Uiso 1 1 calc R U . . .
C43 C 0.9791(11) 0.8213(3) 0.5301(8) 0.077(4) Uani 1 1 d . . . . .
H43 H 1.052843 0.827926 0.547839 0.092 Uiso 1 1 calc R U . . .
C7 C 0.6546(9) 0.2923(2) 0.5700(7) 0.063(3) Uani 1 1 d D . . . .
H7B H 0.658361 0.266148 0.549633 0.075 Uiso 0.209(9) 1 calc R U P A 2
H7A H 0.660977 0.267184 0.543676 0.075 Uiso 0.791(9) 1 calc R U P A 1
C33 C 1.0209(7) 0.7565(3) 0.1575(7) 0.055(2) Uani 1 1 d . . . . .
H33 H 1.030887 0.771599 0.102746 0.066 Uiso 1 1 calc R U . . .
C47 C 0.9871(8) 0.6036(3) 0.2739(8) 0.064(3) Uani 1 1 d . . . . .
H47 H 0.954954 0.627851 0.242605 0.077 Uiso 1 1 calc R U . . .
C44 C 0.9029(11) 0.8396(3) 0.5734(8) 0.081(4) Uani 1 1 d . . . . .
H44 H 0.923402 0.859110 0.620571 0.097 Uiso 1 1 calc R U . . .
C6A C 0.6880(16) 0.3270(4) 0.5308(11) 0.036(3) Uani 0.791(9) 1 d D . P A 1
H6A H 0.722275 0.327811 0.474739 0.043 Uiso 0.791(9) 1 calc R U P A 1
S2A S 0.6090(3) 0.34662(8) 0.6784(2) 0.0338(9) Uani 0.791(9) 1 d D . P A 1
F3A F 0.844(3) 0.4312(4) 0.3301(19) 0.073(4) Uani 0.56(6) 1 d D . P B 1
F1A F 0.9091(10) 0.4774(8) 0.4195(11) 0.063(4) Uani 0.56(6) 1 d D . P B 1
F2A F 0.7622(16) 0.4869(5) 0.3245(17) 0.045(3) Uani 0.56(6) 1 d D . P B 1


_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
Pt1 Cl2 2.3036(15) . ?
Pt1 Cl1 2.2806(15) . ?
Pt1 P1 2.2309(13) . ?
Pt1 N1 2.130(4) . ?
Eu1 Eu1 4.2100(7) 3_666 ?
Eu1 O6 2.349(4) . ?
Eu1 O3 2.300(4) . ?
Eu1 O7 2.379(4) . ?
Eu1 O2 2.356(4) . ?
Eu1 O1 2.453(4) . ?
Eu1 O1 2.519(4) 3_666 ?
Eu1 O4 2.366(4) . ?
Eu1 O5 2.391(4) . ?
P1 C35 1.816(6) . ?
P1 C41 1.820(7) . ?
P1 C29 1.813(6) . ?
S1 C12 1.723(6) . ?
S1 C9 1.706(7) . ?
S3 C21 1.729(7) . ?
S3 C24 1.714(9) . ?
C6B H6B 0.9500 . ?
C6B C5 1.353(19) . ?
C6B C8 1.61(4) . ?
Cl5 C47 1.787(11) . ?
Cl3 C47 1.747(11) . ?
Cl4 C47 1.718(10) . ?
O6 C13 1.283(8) . ?
F2B C1 1.322(12) . ?
O3 C20 1.255(8) . ?
O7 C2 1.260(7) . ?
N1 C28 1.339(8) . ?
N1 C27 1.336(8) . ?
O2 C18 1.252(8) . ?
F6 C16 1.329(9) . ?
F4 C16 1.316(9) . ?
F5 C16 1.318(10) . ?
O1 N2 1.326(6) . ?
O4 C4 1.263(7) . ?
F8 C17 1.308(9) . ?
O5 C15 1.276(8) . ?
F7 C17 1.297(9) . ?
F9 C17 1.308(10) . ?
F3B C1 1.372(12) . ?
N2 C26 1.345(8) . ?
N2 C25 1.333(8) . ?
F1B C1 1.299(12) . ?
S2B C5 1.645(12) . ?
S2B C7 1.589(12) . ?
C26 H26 0.9500 . ?
C26 C27 1.378(8) . ?
C28 H28 0.9500 . ?
C28 C25 1.365(8) . ?
C27 H27 0.9500 . ?
C35 C36 1.394(9) . ?
C35 C40 1.396(9) . ?
C19 H19 0.9500 . ?
C19 C18 1.382(10) . ?
C19 C20 1.420(9) . ?
C5 C4 1.486(8) . ?
C5 C6A 1.378(14) . ?
C5 S2A 1.692(6) . ?
C2 C1 1.527(9) . ?
C2 C3 1.380(9) . ?
C36 H36 0.9500 . ?
C36 C37 1.377(11) . ?
C41 C42 1.379(11) . ?
C41 C46 1.390(11) . ?
C25 H25 0.9500 . ?
C13 C12 1.450(9) . ?
C13 C14 1.413(9) . ?
C18 C17 1.551(8) . ?
C12 C11 1.361(9) . ?
C22 H22 0.9500 . ?
C22 C21 1.390(10) . ?
C22 C23 1.395(11) . ?
C40 H40 0.9500 . ?
C40 C39 1.408(11) . ?
C11 H11 0.9500 . ?
C11 C10 1.411(9) . ?
C29 C30 1.366(10) . ?
C29 C34 1.384(10) . ?
C10 H10 0.9500 . ?
C10 C9 1.342(10) . ?
C30 H30 0.9500 . ?
C30 C31 1.390(11) . ?
C20 C21 1.459(9) . ?
C1 F3A 1.301(11) . ?
C1 F1A 1.368(11) . ?
C1 F2A 1.332(11) . ?
C3 H3 0.9500 . ?
C3 C4 1.412(9) . ?
C14 H14 0.9500 . ?
C14 C15 1.365(9) . ?
C39 H39 0.9500 . ?
C39 C38 1.357(12) . ?
C23 H23 0.9500 . ?
C23 C24 1.333(14) . ?
C38 H38 0.9500 . ?
C38 C37 1.385(11) . ?
C34 H34 0.9500 . ?
C34 C33 1.385(11) . ?
C9 H9 0.9500 . ?
C42 H42 0.9500 . ?
C42 C43 1.397(13) . ?
C8 H8A 0.9500 . ?
C8 H8B 0.9500 . ?
C8 C7 1.331(12) . ?
C8 S2A 1.656(8) . ?
C16 C15 1.538(9) . ?
C37 H37 0.9500 . ?
C24 H24 0.9500 . ?
C32 H32 0.9500 . ?
C32 C31 1.356(13) . ?
C32 C33 1.372(13) . ?
C31 H31 0.9500 . ?
C46 H46 0.9500 . ?
C46 C45 1.383(12) . ?
C45 H45 0.9500 . ?
C45 C44 1.373(18) . ?
C43 H43 0.9500 . ?
C43 C44 1.364(18) . ?
C7 H7B 0.9500 . ?
C7 H7A 0.9500 . ?
C7 C6A 1.408(19) . ?
C33 H33 0.9500 . ?
C47 H47 1.0000 . ?
C44 H44 0.9500 . ?
C6A H6A 0.9500 . ?

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
Cl1 Pt1 Cl2 177.02(5) . . ?
P1 Pt1 Cl2 88.36(5) . . ?
P1 Pt1 Cl1 94.15(5) . . ?
N1 Pt1 Cl2 89.38(14) . . ?
N1 Pt1 Cl1 88.16(14) . . ?
N1 Pt1 P1 177.18(14) . . ?
O6 Eu1 Eu1 96.26(12) . 3_666 ?
O6 Eu1 O7 152.96(14) . . ?
O6 Eu1 O2 131.60(16) . . ?
O6 Eu1 O1 115.98(15) . . ?
O6 Eu1 O1 75.86(15) . 3_666 ?
O6 Eu1 O4 83.68(14) . . ?
O6 Eu1 O5 71.28(14) . . ?
O3 Eu1 Eu1 172.97(11) . 3_666 ?
O3 Eu1 O6 76.72(16) . . ?
O3 Eu1 O7 109.01(16) . . ?
O3 Eu1 O2 72.87(15) . . ?
O3 Eu1 O1 151.58(14) . . ?
O3 Eu1 O1 143.34(14) . 3_666 ?
O3 Eu1 O4 79.27(15) . . ?
O3 Eu1 O5 90.64(16) . . ?
O7 Eu1 Eu1 77.18(12) . 3_666 ?
O7 Eu1 O1 86.08(15) . 3_666 ?
O7 Eu1 O1 71.91(15) . . ?
O7 Eu1 O5 133.42(14) . . ?
O2 Eu1 Eu1 112.69(11) . 3_666 ?
O2 Eu1 O7 73.97(16) . . ?
O2 Eu1 O1 80.51(14) . . ?
O2 Eu1 O1 143.63(14) . 3_666 ?
O2 Eu1 O4 125.14(16) . . ?
O2 Eu1 O5 72.34(16) . . ?
O1 Eu1 Eu1 32.64(9) . 3_666 ?
O1 Eu1 Eu1 31.67(8) 3_666 3_666 ?
O1 Eu1 O1 64.31(14) . 3_666 ?
O4 Eu1 Eu1 100.00(11) . 3_666 ?
O4 Eu1 O7 71.94(14) . . ?
O4 Eu1 O1 125.59(14) . . ?
O4 Eu1 O1 73.96(14) . 3_666 ?
O4 Eu1 O5 154.61(14) . . ?
O5 Eu1 Eu1 87.17(12) . 3_666 ?
O5 Eu1 O1 102.99(16) . 3_666 ?
O5 Eu1 O1 71.60(15) . . ?
C35 P1 Pt1 113.7(2) . . ?
C35 P1 C41 102.6(3) . . ?
C41 P1 Pt1 116.3(2) . . ?
C29 P1 Pt1 110.6(2) . . ?
C29 P1 C35 108.3(3) . . ?
C29 P1 C41 104.6(3) . . ?
C9 S1 C12 91.3(3) . . ?
C24 S3 C21 91.2(4) . . ?
C5 C6B H6B 125.8 . . ?
C5 C6B C8 108.3(17) . . ?
C8 C6B H6B 125.8 . . ?
C13 O6 Eu1 134.3(4) . . ?
C20 O3 Eu1 137.9(4) . . ?
C2 O7 Eu1 134.9(4) . . ?
C28 N1 Pt1 122.0(4) . . ?
C27 N1 Pt1 120.7(4) . . ?
C27 N1 C28 117.1(5) . . ?
C18 O2 Eu1 131.7(4) . . ?
Eu1 O1 Eu1 115.69(14) . 3_666 ?
N2 O1 Eu1 123.5(3) . 3_666 ?
N2 O1 Eu1 120.6(3) . . ?
C4 O4 Eu1 137.4(4) . . ?
C15 O5 Eu1 132.2(4) . . ?
O1 N2 C26 119.2(5) . . ?
O1 N2 C25 120.4(5) . . ?
C25 N2 C26 120.4(5) . . ?
C7 S2B C5 92.4(7) . . ?
N2 C26 H26 120.7 . . ?
N2 C26 C27 118.7(5) . . ?
C27 C26 H26 120.7 . . ?
N1 C28 H28 118.7 . . ?
N1 C28 C25 122.6(6) . . ?
C25 C28 H28 118.7 . . ?
N1 C27 C26 122.1(5) . . ?
N1 C27 H27 119.0 . . ?
C26 C27 H27 119.0 . . ?
C36 C35 P1 121.1(5) . . ?
C36 C35 C40 118.8(6) . . ?
C40 C35 P1 120.1(5) . . ?
C18 C19 H19 119.1 . . ?
C18 C19 C20 121.8(6) . . ?
C20 C19 H19 119.1 . . ?
C6B C5 S2B 114.8(15) . . ?
C6B C5 C4 122.5(16) . . ?
C4 C5 S2B 122.5(6) . . ?
C4 C5 S2A 118.5(4) . . ?
C6A C5 C4 131.9(8) . . ?
C6A C5 S2A 109.6(7) . . ?
O7 C2 C1 113.6(5) . . ?
O7 C2 C3 128.0(6) . . ?
C3 C2 C1 118.4(5) . . ?
C35 C36 H36 119.8 . . ?
C37 C36 C35 120.5(6) . . ?
C37 C36 H36 119.8 . . ?
C42 C41 P1 121.6(6) . . ?
C42 C41 C46 119.8(7) . . ?
C46 C41 P1 118.6(6) . . ?
N2 C25 C28 119.0(5) . . ?
N2 C25 H25 120.5 . . ?
C28 C25 H25 120.5 . . ?
O6 C13 C12 117.3(5) . . ?
O6 C13 C14 123.5(6) . . ?
C14 C13 C12 119.1(5) . . ?
O2 C18 C19 129.4(6) . . ?
O2 C18 C17 112.8(6) . . ?
C19 C18 C17 117.8(6) . . ?
C13 C12 S1 117.9(5) . . ?
C11 C12 S1 111.0(5) . . ?
C11 C12 C13 131.0(6) . . ?
C21 C22 H22 123.9 . . ?
C21 C22 C23 112.1(8) . . ?
C23 C22 H22 123.9 . . ?
C35 C40 H40 120.1 . . ?
C35 C40 C39 119.7(7) . . ?
C39 C40 H40 120.1 . . ?
C12 C11 H11 123.7 . . ?
C12 C11 C10 112.7(6) . . ?
C10 C11 H11 123.7 . . ?
C30 C29 P1 119.5(5) . . ?
C30 C29 C34 118.4(6) . . ?
C34 C29 P1 122.1(5) . . ?
C11 C10 H10 123.7 . . ?
C9 C10 C11 112.5(6) . . ?
C9 C10 H10 123.7 . . ?
C29 C30 H30 119.3 . . ?
C29 C30 C31 121.4(7) . . ?
C31 C30 H30 119.3 . . ?
O3 C20 C19 123.2(6) . . ?
O3 C20 C21 115.8(6) . . ?
C19 C20 C21 120.9(6) . . ?
F2B C1 F3B 103.7(14) . . ?
F2B C1 C2 118.2(15) . . ?
F3B C1 C2 107.8(12) . . ?
F1B C1 F2B 108.8(12) . . ?
F1B C1 F3B 105.9(11) . . ?
F1B C1 C2 111.5(11) . . ?
F3A C1 C2 118.7(9) . . ?
F3A C1 F1A 104.6(10) . . ?
F3A C1 F2A 111.8(15) . . ?
F1A C1 C2 108.7(8) . . ?
F2A C1 C2 108.1(11) . . ?
F2A C1 F1A 103.9(9) . . ?
C2 C3 H3 118.6 . . ?
C2 C3 C4 122.7(6) . . ?
C4 C3 H3 118.6 . . ?
C22 C21 S3 110.4(6) . . ?
C22 C21 C20 131.6(7) . . ?
C20 C21 S3 117.9(5) . . ?
C13 C14 H14 118.6 . . ?
C15 C14 C13 122.9(6) . . ?
C15 C14 H14 118.6 . . ?
C40 C39 H39 119.8 . . ?
C38 C39 C40 120.3(7) . . ?
C38 C39 H39 119.8 . . ?
C22 C23 H23 123.0 . . ?
C24 C23 C22 114.0(7) . . ?
C24 C23 H23 123.0 . . ?
C39 C38 H38 119.9 . . ?
C39 C38 C37 120.2(7) . . ?
C37 C38 H38 119.9 . . ?
F8 C17 C18 113.4(6) . . ?
F7 C17 F8 107.3(7) . . ?
F7 C17 F9 106.3(7) . . ?
F7 C17 C18 111.7(6) . . ?
F9 C17 F8 108.0(7) . . ?
F9 C17 C18 109.9(6) . . ?
C29 C34 H34 119.9 . . ?
C29 C34 C33 120.2(7) . . ?
C33 C34 H34 119.9 . . ?
S1 C9 H9 123.8 . . ?
C10 C9 S1 112.5(5) . . ?
C10 C9 H9 123.8 . . ?
C41 C42 H42 120.3 . . ?
C41 C42 C43 119.4(10) . . ?
C43 C42 H42 120.3 . . ?
C6B C8 H8B 128.5 . . ?
C7 C8 C6B 103.1(7) . . ?
C7 C8 H8A 122.2 . . ?
C7 C8 H8B 128.5 . . ?
C7 C8 S2A 115.5(6) . . ?
S2A C8 H8A 122.2 . . ?
F6 C16 C15 110.9(6) . . ?
F4 C16 F6 107.7(7) . . ?
F4 C16 F5 106.8(7) . . ?
F4 C16 C15 114.0(6) . . ?
F5 C16 F6 105.4(6) . . ?
F5 C16 C15 111.5(6) . . ?
C36 C37 C38 120.4(8) . . ?
C36 C37 H37 119.8 . . ?
C38 C37 H37 119.8 . . ?
S3 C24 H24 123.9 . . ?
C23 C24 S3 112.3(6) . . ?
C23 C24 H24 123.9 . . ?
O5 C15 C14 127.8(6) . . ?
O5 C15 C16 113.0(6) . . ?
C14 C15 C16 119.2(6) . . ?
O4 C4 C5 116.3(5) . . ?
O4 C4 C3 124.6(5) . . ?
C3 C4 C5 119.1(5) . . ?
C31 C32 H32 120.1 . . ?
C31 C32 C33 119.9(7) . . ?
C33 C32 H32 120.1 . . ?
C30 C31 H31 120.1 . . ?
C32 C31 C30 119.8(8) . . ?
C32 C31 H31 120.1 . . ?
C41 C46 H46 120.2 . . ?
C45 C46 C41 119.5(9) . . ?
C45 C46 H46 120.2 . . ?
C46 C45 H45 119.6 . . ?
C44 C45 C46 120.8(11) . . ?
C44 C45 H45 119.6 . . ?
C42 C43 H43 119.6 . . ?
C44 C43 C42 120.8(10) . . ?
C44 C43 H43 119.6 . . ?
S2B C7 H7B 119.3 . . ?
C8 C7 S2B 121.4(7) . . ?
C8 C7 H7B 119.3 . . ?
C8 C7 H7A 125.4 . . ?
C8 C7 C6A 109.3(7) . . ?
C6A C7 H7A 125.4 . . ?
C34 C33 H33 119.8 . . ?
C32 C33 C34 120.3(8) . . ?
C32 C33 H33 119.8 . . ?
Cl5 C47 H47 107.6 . . ?
Cl3 C47 Cl5 112.2(6) . . ?
Cl3 C47 H47 107.6 . . ?
Cl4 C47 Cl5 111.0(6) . . ?
Cl4 C47 Cl3 110.5(6) . . ?
Cl4 C47 H47 107.6 . . ?
C45 C44 H44 120.2 . . ?
C43 C44 C45 119.6(9) . . ?
C43 C44 H44 120.2 . . ?
C5 C6A C7 113.8(10) . . ?
C5 C6A H6A 123.1 . . ?
C7 C6A H6A 123.1 . . ?
C8 S2A C5 91.8(4) . . ?

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
Pt1 P1 C35 C36 -18.2(6) . . . . ?
Pt1 P1 C35 C40 160.6(5) . . . . ?
Pt1 P1 C41 C42 108.6(6) . . . . ?
Pt1 P1 C41 C46 -73.2(6) . . . . ?
Pt1 P1 C29 C30 -38.1(6) . . . . ?
Pt1 P1 C29 C34 143.5(6) . . . . ?
Pt1 N1 C28 C25 -172.6(5) . . . . ?
Pt1 N1 C27 C26 172.0(5) . . . . ?
Eu1 O6 C13 C12 -155.7(4) . . . . ?
Eu1 O6 C13 C14 27.3(10) . . . . ?
Eu1 O3 C20 C19 -14.6(10) . . . . ?
Eu1 O3 C20 C21 164.2(4) . . . . ?
Eu1 O7 C2 C1 179.4(4) . . . . ?
Eu1 O7 C2 C3 -1.2(11) . . . . ?
Eu1 O2 C18 C19 12.1(10) . . . . ?
Eu1 O2 C18 C17 -165.7(4) . . . . ?
Eu1 O1 N2 C26 -89.4(5) . . . . ?
Eu1 O1 N2 C26 96.1(6) 3_666 . . . ?
Eu1 O1 N2 C25 -83.6(6) 3_666 . . . ?
Eu1 O1 N2 C25 90.8(6) . . . . ?
Eu1 O4 C4 C5 -170.9(4) . . . . ?
Eu1 O4 C4 C3 7.9(10) . . . . ?
Eu1 O5 C15 C14 -13.4(11) . . . . ?
Eu1 O5 C15 C16 166.4(5) . . . . ?
P1 C35 C36 C37 178.4(6) . . . . ?
P1 C35 C40 C39 -177.9(6) . . . . ?
P1 C41 C42 C43 178.6(7) . . . . ?
P1 C41 C46 C45 -178.0(7) . . . . ?
P1 C29 C30 C31 -177.0(7) . . . . ?
P1 C29 C34 C33 177.8(7) . . . . ?
S1 C12 C11 C10 0.9(8) . . . . ?
C6B C5 C4 O4 -4(3) . . . . ?
C6B C5 C4 C3 177(3) . . . . ?
C6B C8 C7 S2B 1.2(17) . . . . ?
O6 C13 C12 S1 -2.4(8) . . . . ?
O6 C13 C12 C11 -179.9(7) . . . . ?
O6 C13 C14 C15 0.2(11) . . . . ?
O3 C20 C21 S3 2.4(8) . . . . ?
O3 C20 C21 C22 -172.9(7) . . . . ?
O7 C2 C1 F2B -32.6(18) . . . . ?
O7 C2 C1 F3B -149.5(15) . . . . ?
O7 C2 C1 F1B 95(2) . . . . ?
O7 C2 C1 F3A -173.5(18) . . . . ?
O7 C2 C1 F1A 67.3(15) . . . . ?
O7 C2 C1 F2A -44.9(15) . . . . ?
O7 C2 C3 C4 -2.1(11) . . . . ?
N1 C28 C25 N2 1.1(10) . . . . ?
O2 C18 C17 F8 -162.8(7) . . . . ?
O2 C18 C17 F7 -41.4(9) . . . . ?
O2 C18 C17 F9 76.3(8) . . . . ?
F6 C16 C15 O5 54.2(9) . . . . ?
F6 C16 C15 C14 -126.0(7) . . . . ?
F4 C16 C15 O5 176.1(7) . . . . ?
F4 C16 C15 C14 -4.2(11) . . . . ?
F5 C16 C15 O5 -62.9(9) . . . . ?
F5 C16 C15 C14 116.9(8) . . . . ?
O1 N2 C26 C27 -176.8(5) . . . . ?
O1 N2 C25 C28 176.2(6) . . . . ?
N2 C26 C27 N1 0.1(9) . . . . ?
S2B C5 C4 O4 171.9(12) . . . . ?
S2B C5 C4 C3 -7.0(13) . . . . ?
C26 N2 C25 C28 -3.6(9) . . . . ?
C28 N1 C27 C26 -2.5(9) . . . . ?
C27 N1 C28 C25 1.9(10) . . . . ?
C35 P1 C41 C42 -126.7(6) . . . . ?
C35 P1 C41 C46 51.5(6) . . . . ?
C35 P1 C29 C30 -163.2(6) . . . . ?
C35 P1 C29 C34 18.3(7) . . . . ?
C35 C36 C37 C38 0.1(13) . . . . ?
C35 C40 C39 C38 -1.0(12) . . . . ?
C19 C18 C17 F8 19.1(9) . . . . ?
C19 C18 C17 F7 140.5(7) . . . . ?
C19 C18 C17 F9 -101.8(8) . . . . ?
C19 C20 C21 S3 -178.8(5) . . . . ?
C19 C20 C21 C22 5.9(11) . . . . ?
C5 C6B C8 C7 -2(3) . . . . ?
C5 S2B C7 C8 -0.4(15) . . . . ?
C2 C3 C4 O4 -1.0(10) . . . . ?
C2 C3 C4 C5 177.8(6) . . . . ?
C36 C35 C40 C39 0.9(10) . . . . ?
C41 P1 C35 C36 -144.6(6) . . . . ?
C41 P1 C35 C40 34.2(6) . . . . ?
C41 P1 C29 C30 87.9(6) . . . . ?
C41 P1 C29 C34 -90.5(7) . . . . ?
C41 C42 C43 C44 -0.8(16) . . . . ?
C41 C46 C45 C44 -0.5(15) . . . . ?
C25 N2 C26 C27 3.0(9) . . . . ?
C13 C12 C11 C10 178.5(7) . . . . ?
C13 C14 C15 O5 -6.4(12) . . . . ?
C13 C14 C15 C16 173.9(7) . . . . ?
C18 C19 C20 O3 -1.4(10) . . . . ?
C18 C19 C20 C21 179.8(6) . . . . ?
C12 S1 C9 C10 -0.4(7) . . . . ?
C12 C13 C14 C15 -176.8(6) . . . . ?
C12 C11 C10 C9 -1.2(10) . . . . ?
C22 C23 C24 S3 0.5(10) . . . . ?
C40 C35 C36 C37 -0.4(11) . . . . ?
C40 C39 C38 C37 0.7(13) . . . . ?
C11 C10 C9 S1 0.9(9) . . . . ?
C29 P1 C35 C36 105.1(6) . . . . ?
C29 P1 C35 C40 -76.1(6) . . . . ?
C29 P1 C41 C42 -13.6(7) . . . . ?
C29 P1 C41 C46 164.5(6) . . . . ?
C29 C30 C31 C32 -2.1(15) . . . . ?
C29 C34 C33 C32 0.4(16) . . . . ?
C30 C29 C34 C33 -0.6(13) . . . . ?
C20 C19 C18 O2 1.8(11) . . . . ?
C20 C19 C18 C17 179.5(6) . . . . ?
C1 C2 C3 C4 177.3(6) . . . . ?
C3 C2 C1 F2B 147.9(16) . . . . ?
C3 C2 C1 F3B 30.9(15) . . . . ?
C3 C2 C1 F1B -85(2) . . . . ?
C3 C2 C1 F3A 7.0(19) . . . . ?
C3 C2 C1 F1A -112.2(14) . . . . ?
C3 C2 C1 F2A 135.6(14) . . . . ?
C21 S3 C24 C23 0.4(7) . . . . ?
C21 C22 C23 C24 -1.5(10) . . . . ?
C14 C13 C12 S1 174.7(5) . . . . ?
C14 C13 C12 C11 -2.7(11) . . . . ?
C39 C38 C37 C36 -0.2(14) . . . . ?
C23 C22 C21 S3 1.8(8) . . . . ?
C23 C22 C21 C20 177.3(7) . . . . ?
C34 C29 C30 C31 1.5(12) . . . . ?
C9 S1 C12 C13 -178.2(6) . . . . ?
C9 S1 C12 C11 -0.3(6) . . . . ?
C42 C41 C46 C45 0.3(13) . . . . ?
C42 C43 C44 C45 0.6(18) . . . . ?
C8 C6B C5 S2B 2(4) . . . . ?
C8 C6B C5 C4 177.6(13) . . . . ?
C8 C7 C6A C5 -2(2) . . . . ?
C24 S3 C21 C22 -1.2(5) . . . . ?
C24 S3 C21 C20 -177.5(5) . . . . ?
C4 C5 C6A C7 -175.9(10) . . . . ?
C4 C5 S2A C8 177.1(6) . . . . ?
C31 C32 C33 C34 -1.1(17) . . . . ?
C46 C41 C42 C43 0.4(12) . . . . ?
C46 C45 C44 C43 0.1(17) . . . . ?
C7 S2B C5 C6B -1(3) . . . . ?
C7 S2B C5 C4 -176.9(7) . . . . ?
C7 C8 S2A C5 -0.1(9) . . . . ?
C33 C32 C31 C30 1.9(17) . . . . ?
C6A C5 C4 O4 172.3(13) . . . . ?
C6A C5 C4 C3 -6.6(15) . . . . ?
C6A C5 S2A C8 -1.0(11) . . . . ?
S2A C5 C4 O4 -5.3(8) . . . . ?
S2A C5 C4 C3 175.8(5) . . . . ?
S2A C5 C6A C7 1.8(19) . . . . ?
S2A C8 C7 C6A 1.1(16) . . . . ?

_smtbx_masks_special_details     
;
A solvent mask was calculated and 236 electrons were 
found in a volume of 836Å³ in 4 voids per unit cell. 
This is consistent with the presence of 
4[CHCl3] per Unit Cell 
which account for 232 electrons 
per unit cell.
;
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.133 0.325 0.059 197.4 59.0 '1 CHCl3'
2 -0.089 0.479 0.638 12.1 0.0 ?
3 0.089 0.521 0.362 12.1 0.0 ?
4 -0.133 0.675 -0.059 197.4 63.9 '1 CHCl3'
5 0.367 0.825 0.441 197.4 60.4 '1 CHCl3'
6 0.411 0.021 0.138 12.1 0.0 ?
7 0.633 0.175 0.559 197.4 62.3 '1 CHCl3'
8 0.589 0.979 0.862 12.1 0.0 ?

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.694
_oxdiff_exptl_absorpt_empirical_full_min 0.634
####################################################################### 
# 
# 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_exp_236_auto
_database_code_depnum_ccdc_archive 'CCDC 2395089'
loop_
_audit_author_name
_audit_author_address
'Marzio Rancan'
;ICMATE CNR
Italy
;
_audit_update_record             
;
2025-04-02 deposited with the CCDC.	2025-05-30 downloaded from the CCDC.
;
_audit_creation_date             2025-04-01
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.03.04 svn.red2d20d0 for OlexSys, GUI svn.r7188)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C15 H12 Cl N3 O Pt'
_chemical_formula_sum            'C15 H12 Cl N3 O Pt'
_chemical_formula_weight         480.82
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Pt1 Cl1 N3 O1 C20 H20'
_chemical_oxdiff_usercomment     'MB149 da DCM vapori Et2O '
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'
Cl Cl 0.1484 0.1585 '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'
Pt Pt -1.7033 8.3905 '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           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
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                   5.8219(2)
_cell_length_b                   25.1197(9)
_cell_length_c                   10.1551(4)
_cell_angle_alpha                90
_cell_angle_beta                 105.406(4)
_cell_angle_gamma                90
_cell_volume                     1431.77(10)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    2302
_cell_measurement_temperature    295.8(3)
_cell_measurement_theta_max      27.7300
_cell_measurement_theta_min      4.0500
_shelx_estimated_absorpt_T_max   0.907
_shelx_estimated_absorpt_T_min   0.380
_exptl_absorpt_coefficient_mu    9.987
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.40434
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.41.103a (Rigaku Oxford Diffraction, 2021)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    2.231
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             904
_exptl_crystal_preparation       ?
_exptl_crystal_recrystallization_method 
'were obtained by slow diffusion of ethyl ether vapors into a dichloromethane solution'
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.01
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0465
_diffrn_reflns_av_unetI/netI     0.0370
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.918
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       -7
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            16230
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.918
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.225
_diffrn_reflns_theta_min         3.630
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      295.8(3)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 8.0637
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.918
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -66.00  -9.00   0.25   20.00    --  -18.52 109.00 137.00  228
  2  ω    -12.00  66.00   0.25   20.00    --   18.68-109.00  40.00  312
  3  ω    -87.00 -30.75   0.25   20.00    --  -18.52 -57.00 -30.00  225
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.1141025000
_diffrn_orient_matrix_UB_12      -0.0005306000
_diffrn_orient_matrix_UB_13      0.0473059000
_diffrn_orient_matrix_UB_21      0.0101924000
_diffrn_orient_matrix_UB_22      -0.0274694000
_diffrn_orient_matrix_UB_23      -0.0133359000
_diffrn_orient_matrix_UB_31      0.0532328000
_diffrn_orient_matrix_UB_32      0.0064069000
_diffrn_orient_matrix_UB_33      -0.0532522000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                3137
_reflns_number_total             3549
_reflns_odcompleteness_completeness 74.54
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_collection       'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_reduction        'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         0.959
_refine_diff_density_min         -1.031
_refine_diff_density_rms         0.124
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.082
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     190
_refine_ls_number_reflns         3549
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0433
_refine_ls_R_factor_gt           0.0344
_refine_ls_restrained_S_all      1.082
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0266P)²+1.3241P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0653
_refine_ls_wR_factor_ref         0.0687
_refine_special_details          ?
_olex2_refinement_description    
;
1.a Aromatic/amide H refined with riding coordinates:
 C2(H2), C15(H15), C14(H14), C3(H3), C12(H12), C9(H9), C13(H13), C10(H10),
 C11(H11), C5(H5), C8(H8), C4(H4)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Pt1 Pt 0.79979(3) 0.32993(2) 0.78960(2) 0.03323(8) Uani 1 1 d . . . . .
Cl1 Cl 1.1560(2) 0.30016(6) 0.95128(14) 0.0479(3) Uani 1 1 d . . . . .
N2 N 0.7020(7) 0.25273(16) 0.7563(4) 0.0342(9) Uani 1 1 d . . . . .
N1 N 0.8858(8) 0.40760(17) 0.8057(4) 0.0410(10) Uani 1 1 d . . . . .
N3 N 0.5943(8) 0.14557(18) 0.7115(5) 0.0459(11) Uani 1 1 d . . . . .
C2 C 0.2997(10) 0.3314(2) 0.6009(6) 0.0464(13) Uani 1 1 d . . . . .
H2 H 0.298409 0.294483 0.607732 0.056 Uiso 1 1 calc R U . . .
C16 C 0.5003(8) 0.3586(2) 0.6686(5) 0.0371(11) Uani 1 1 d . . . . .
O1 O 0.5453(9) 0.09660(16) 0.6897(5) 0.0704(13) Uani 1 1 d . . . . .
C15 C 0.7483(11) 0.17002(19) 0.6526(6) 0.0452(13) Uani 1 1 d . . . . .
H15 H 0.818397 0.150835 0.595193 0.054 Uiso 1 1 calc R U . . .
C7 C 0.7100(10) 0.4415(2) 0.7350(5) 0.0452(13) Uani 1 1 d . . . . .
C14 C 0.8021(9) 0.2227(2) 0.6766(5) 0.0418(12) Uani 1 1 d . . . . .
H14 H 0.911697 0.238367 0.636566 0.050 Uiso 1 1 calc R U . . .
C3 C 0.0984(10) 0.3569(3) 0.5227(6) 0.0560(15) Uani 1 1 d . . . . .
H3 H -0.034235 0.337244 0.477180 0.067 Uiso 1 1 calc R U . . .
C12 C 0.5494(8) 0.2280(2) 0.8135(5) 0.0411(12) Uani 1 1 d . . . . .
H12 H 0.477006 0.247428 0.869275 0.049 Uiso 1 1 calc R U . . .
C6 C 0.4955(10) 0.4145(2) 0.6591(5) 0.0436(12) Uani 1 1 d . . . . .
C9 C 0.9697(15) 0.5156(3) 0.8076(7) 0.073(2) Uani 1 1 d . . . . .
H9 H 0.997653 0.552039 0.809680 0.088 Uiso 1 1 calc R U . . .
C13 C 0.4958(10) 0.1752(2) 0.7930(6) 0.0469(13) Uani 1 1 d . . . . .
H13 H 0.390114 0.159522 0.835801 0.056 Uiso 1 1 calc R U . . .
C10 C 1.1434(13) 0.4811(3) 0.8739(7) 0.0674(18) Uani 1 1 d . . . . .
H10 H 1.293250 0.493962 0.919466 0.081 Uiso 1 1 calc R U . . .
C11 C 1.0969(11) 0.4276(2) 0.8732(6) 0.0525(14) Uani 1 1 d . . . . .
H11 H 1.215225 0.404656 0.920916 0.063 Uiso 1 1 calc R U . . .
C5 C 0.2926(12) 0.4405(3) 0.5801(6) 0.0601(17) Uani 1 1 d . . . . .
H5 H 0.291242 0.477471 0.573276 0.072 Uiso 1 1 calc R U . . .
C8 C 0.7548(13) 0.4953(3) 0.7385(7) 0.0625(17) Uani 1 1 d . . . . .
H8 H 0.635400 0.518391 0.692555 0.075 Uiso 1 1 calc R U . . .
C4 C 0.0957(11) 0.4118(3) 0.5127(7) 0.0661(18) Uani 1 1 d . . . . .
H4 H -0.038835 0.429169 0.460488 0.079 Uiso 1 1 calc R U . . .


_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
Pt1 Cl1 2.3972(13) . ?
Pt1 N2 2.024(4) . ?
Pt1 N1 2.010(4) . ?
Pt1 C16 1.982(5) . ?
N2 C14 1.347(6) . ?
N2 C12 1.337(6) . ?
N1 C7 1.378(7) . ?
N1 C11 1.336(7) . ?
N3 O1 1.269(5) . ?
N3 C15 1.350(7) . ?
N3 C13 1.350(7) . ?
C2 H2 0.9300 . ?
C2 C16 1.370(7) . ?
C2 C3 1.386(8) . ?
C16 C6 1.408(7) . ?
C15 H15 0.9300 . ?
C15 C14 1.367(7) . ?
C7 C6 1.450(8) . ?
C7 C8 1.375(8) . ?
C14 H14 0.9300 . ?
C3 H3 0.9300 . ?
C3 C4 1.381(9) . ?
C12 H12 0.9300 . ?
C12 C13 1.364(7) . ?
C6 C5 1.402(8) . ?
C9 H9 0.9300 . ?
C9 C10 1.364(10) . ?
C9 C8 1.360(10) . ?
C13 H13 0.9300 . ?
C10 H10 0.9300 . ?
C10 C11 1.371(8) . ?
C11 H11 0.9300 . ?
C5 H5 0.9300 . ?
C5 C4 1.374(9) . ?
C8 H8 0.9300 . ?
C4 H4 0.9300 . ?

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
N2 Pt1 Cl1 88.23(11) . . ?
N1 Pt1 Cl1 95.48(13) . . ?
N1 Pt1 N2 175.18(17) . . ?
C16 Pt1 Cl1 175.03(15) . . ?
C16 Pt1 N2 94.71(18) . . ?
C16 Pt1 N1 81.81(19) . . ?
C14 N2 Pt1 119.3(3) . . ?
C12 N2 Pt1 124.3(3) . . ?
C12 N2 C14 116.4(4) . . ?
C7 N1 Pt1 115.0(4) . . ?
C11 N1 Pt1 125.6(4) . . ?
C11 N1 C7 119.3(5) . . ?
O1 N3 C15 120.6(5) . . ?
O1 N3 C13 122.0(5) . . ?
C13 N3 C15 117.4(5) . . ?
C16 C2 H2 118.8 . . ?
C16 C2 C3 122.4(6) . . ?
C3 C2 H2 118.8 . . ?
C2 C16 Pt1 128.5(4) . . ?
C2 C16 C6 117.6(5) . . ?
C6 C16 Pt1 113.7(4) . . ?
N3 C15 H15 119.7 . . ?
N3 C15 C14 120.6(5) . . ?
C14 C15 H15 119.7 . . ?
N1 C7 C6 113.8(5) . . ?
C8 C7 N1 119.0(6) . . ?
C8 C7 C6 127.2(6) . . ?
N2 C14 C15 122.3(5) . . ?
N2 C14 H14 118.9 . . ?
C15 C14 H14 118.9 . . ?
C2 C3 H3 120.2 . . ?
C4 C3 C2 119.7(6) . . ?
C4 C3 H3 120.2 . . ?
N2 C12 H12 118.7 . . ?
N2 C12 C13 122.5(5) . . ?
C13 C12 H12 118.7 . . ?
C16 C6 C7 115.6(5) . . ?
C5 C6 C16 120.3(5) . . ?
C5 C6 C7 124.1(5) . . ?
C10 C9 H9 120.8 . . ?
C8 C9 H9 120.8 . . ?
C8 C9 C10 118.5(6) . . ?
N3 C13 C12 120.8(5) . . ?
N3 C13 H13 119.6 . . ?
C12 C13 H13 119.6 . . ?
C9 C10 H10 120.0 . . ?
C9 C10 C11 120.0(6) . . ?
C11 C10 H10 120.0 . . ?
N1 C11 C10 121.7(6) . . ?
N1 C11 H11 119.2 . . ?
C10 C11 H11 119.2 . . ?
C6 C5 H5 119.9 . . ?
C4 C5 C6 120.3(6) . . ?
C4 C5 H5 119.9 . . ?
C7 C8 H8 119.2 . . ?
C9 C8 C7 121.5(7) . . ?
C9 C8 H8 119.2 . . ?
C3 C4 C5 119.8(6) . . ?
C3 C4 H4 120.1 . . ?
C5 C4 H4 120.1 . . ?

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
Pt1 N2 C14 C15 178.4(4) . . . . ?
Pt1 N2 C12 C13 -177.1(4) . . . . ?
Pt1 N1 C7 C6 -1.3(6) . . . . ?
Pt1 N1 C7 C8 -179.0(4) . . . . ?
Pt1 N1 C11 C10 177.1(4) . . . . ?
Pt1 C16 C6 C7 1.7(6) . . . . ?
Pt1 C16 C6 C5 -178.3(4) . . . . ?
N2 C12 C13 N3 -0.8(9) . . . . ?
N1 C7 C6 C16 -0.3(6) . . . . ?
N1 C7 C6 C5 179.7(5) . . . . ?
N1 C7 C8 C9 1.4(9) . . . . ?
N3 C15 C14 N2 -1.5(9) . . . . ?
C2 C16 C6 C7 178.6(5) . . . . ?
C2 C16 C6 C5 -1.4(8) . . . . ?
C2 C3 C4 C5 0.1(9) . . . . ?
C16 C2 C3 C4 -0.8(9) . . . . ?
C16 C6 C5 C4 0.8(9) . . . . ?
O1 N3 C15 C14 -179.6(5) . . . . ?
O1 N3 C13 C12 -179.2(5) . . . . ?
C15 N3 C13 C12 0.6(8) . . . . ?
C7 N1 C11 C10 -0.1(8) . . . . ?
C7 C6 C5 C4 -179.2(5) . . . . ?
C14 N2 C12 C13 -0.1(7) . . . . ?
C3 C2 C16 Pt1 177.8(4) . . . . ?
C3 C2 C16 C6 1.4(8) . . . . ?
C12 N2 C14 C15 1.3(8) . . . . ?
C6 C7 C8 C9 -176.0(6) . . . . ?
C6 C5 C4 C3 -0.1(9) . . . . ?
C9 C10 C11 N1 1.9(10) . . . . ?
C13 N3 C15 C14 0.5(8) . . . . ?
C10 C9 C8 C7 0.4(10) . . . . ?
C11 N1 C7 C6 176.2(5) . . . . ?
C11 N1 C7 C8 -1.5(8) . . . . ?
C8 C7 C6 C16 177.2(5) . . . . ?
C8 C7 C6 C5 -2.8(9) . . . . ?
C8 C9 C10 C11 -1.9(10) . . . . ?

_olex2_exptl_crystal_mounting_method 
'The crystal was mounted on a nylon loop in perfluoroether oil'
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.131
_oxdiff_exptl_absorpt_empirical_full_min 0.611
####################################################################### 
# 
# 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_exp_332_auto
_database_code_depnum_ccdc_archive 'CCDC 2395044'
loop_
_audit_author_name
_audit_author_address
'Marzio Rancan'
;ICMATE CNR
Italy
;
_audit_update_record             
;
2025-04-02 deposited with the CCDC.	2025-05-30 downloaded from the CCDC.
;
_audit_creation_date             2025-04-01
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.03.04 svn.red2d20d0 for OlexSys, GUI svn.r7188)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'C92 H62 As2 Cl4 Eu2 F18 N4 O14 Pt2 S6, 2(C H2 Cl2), 2[CH2Cl2]'
_chemical_formula_sum            'C47 H33 As Cl4 Eu F9 N2 O7 Pt S3'
_chemical_formula_weight         1568.70
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Eu1 Pt1 O10 C20 F12 N4 As2 Cl2'
_chemical_oxdiff_usercomment     'MB206 LT'
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'
As As -0.9300 1.0051 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -8.9294 11.1857 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 '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'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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                   11.7915(4)
_cell_length_b                   14.0299(6)
_cell_length_c                   18.5196(4)
_cell_angle_alpha                103.579(3)
_cell_angle_beta                 90.735(2)
_cell_angle_gamma                114.440(4)
_cell_volume                     2690.25(18)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    15523
_cell_measurement_temperature    149(2)
_cell_measurement_theta_max      68.5910
_cell_measurement_theta_min      4.1400
_shelx_estimated_absorpt_T_max   0.251
_shelx_estimated_absorpt_T_min   0.085
_exptl_absorpt_coefficient_mu    17.379
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.24931
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.41.103a (Rigaku Oxford Diffraction, 2021)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.937
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       irregular
_exptl_crystal_F_000             1512
_exptl_crystal_size_max          0.28
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.11
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0513
_diffrn_reflns_av_unetI/netI     0.0536
_diffrn_reflns_Laue_measured_fraction_full 0.981
_diffrn_reflns_Laue_measured_fraction_max 0.972
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            20631
_diffrn_reflns_point_group_measured_fraction_full 0.981
_diffrn_reflns_point_group_measured_fraction_max 0.972
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         68.568
_diffrn_reflns_theta_min         3.587
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      149(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.1274
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.981
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -43.00 -18.00   0.50    1.00    --  -34.12 151.00 -81.00   50
  2  ω    -86.00   1.00   0.50    1.00    --  -34.12 122.00 117.00  174
  3  ω     39.00  75.00   0.50    1.00    --   34.12-122.00  35.00   72
  4  ω    113.00 138.00   0.50    7.50    --  103.52 122.00 117.00   50
  5  ω     97.00 129.00   0.50    7.50    --  103.52-151.00-124.00   64
  6  ω     37.00 108.00   0.50    7.50    --  103.52-122.00  35.00  142
  7  ω     99.00 124.00   0.50    7.50    --  103.52 151.00 -81.00   50
  8  ω   -106.00 -11.00   0.50    1.00    --  -34.12 -38.00-150.00  190
  9  ω    -95.00 -69.00   0.50    1.00    --  -34.12 178.00 120.00   52
 10  ω    -61.00 -36.00   0.50    1.00    --  -34.12  77.00  90.00   50
 11  ω    -27.00  -1.00   0.50    1.00    --  -34.12  77.00 120.00   52
 12  ω    -78.00 -44.00   0.50    1.00    --  -34.12-178.00  90.00   68
 13  ω   -103.00 -48.00   0.50    1.00    --  -34.12 -57.00   0.00  110
 14  ω    -57.00 -31.00   0.50    1.00    --  -34.12  77.00 120.00   52
 15  ω    -66.00 -41.00   0.50    1.00    --  -34.12 178.00 120.00   50
 16  ω     -7.00  34.00   0.50    1.00    --  -34.12  77.00  90.00   82
 17  ω     81.00 107.00   0.50    1.00    --   34.12 178.00 -30.00   52
 18  ω     -6.00  19.00   0.50    1.00    --   34.12 -77.00-150.00   50
 19  ω     15.00 100.00   0.50    1.00    --   34.12  57.00   0.00  170
 20  ω     39.00  64.00   0.50    1.00    --   34.12 -77.00-150.00   50
 21  ω     36.00 103.00   0.50    1.00    --   34.12  38.00 150.00  134
 22  ω    -29.00  34.00   0.50    1.00    --   34.12 -57.00  60.00  126
 23  ω     40.00  75.00   0.50    1.00    --   34.12 -99.00 -30.00   70
 24  ω     61.00  86.00   0.50    1.00    --   34.12 178.00 120.00   50
 25  ω     56.00  82.00   0.50    1.00    --   34.12-178.00  60.00   52
 26  ω      8.00  33.00   0.50    1.00    --   34.12 -99.00 -30.00   50
 27  ω    140.00 165.00   0.50    7.50    --  103.52  61.00-180.00   50
 28  ω     39.00 133.00   0.50    7.50    --  103.52 -77.00-180.00  188
 29  ω     83.00 121.00   0.50    7.50    --  103.52  61.00-180.00   76
 30  ω    107.00 133.00   0.50    7.50    --  103.52  30.00  60.00   52
 31  ω     75.00 105.00   0.50    7.50    --  103.52  30.00  60.00   60
 32  ω    140.00 166.00   0.50    7.50    --  103.52  30.00  60.00   52
 33  ω     87.00 163.00   0.50    7.50    --  103.52  61.00-120.00  152
 34  ω     81.00 169.00   0.50    7.50    --  103.52  45.00 150.00  176
 35  ω    114.00 166.00   0.50    7.50    --  103.52  77.00   0.00  104
 36  ω     60.00 114.00   0.50    7.50    --  103.52 -61.00  60.00  108
 37  ω     34.00  73.00   0.50    7.50    --  103.52 -95.00 -30.00   78
 38  ω     76.00 125.00   0.50    7.50    --  103.52 -61.00   0.00   98
 39  ω     32.00 103.00   0.50    7.50    --  103.52 -95.00  60.00  142
 40  ω    102.00 172.00   0.50    7.50    --  103.52  77.00  90.00  140
 41  ω     84.00 109.00   0.50    7.50    --  103.52-111.00 -60.00   50
 42  ω     37.00  63.00   0.50    7.50    --  103.52-111.00 -60.00   52
 43  ω     44.00  71.00   0.50    7.50    --  103.52 -61.00   0.00   54
 44  ω    145.00 157.50   0.50    7.50    --  103.52  61.00  60.00   25
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0521764000
_diffrn_orient_matrix_UB_12      0.0288990000
_diffrn_orient_matrix_UB_13      -0.0716978000
_diffrn_orient_matrix_UB_21      0.0643425000
_diffrn_orient_matrix_UB_22      0.1209628000
_diffrn_orient_matrix_UB_23      0.0429301000
_diffrn_orient_matrix_UB_31      0.1185581000
_diffrn_orient_matrix_UB_32      -0.0129604000
_diffrn_orient_matrix_UB_33      0.0213296000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9312
_reflns_number_total             9635
_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 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_collection       'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_reduction        'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         3.313
_refine_diff_density_min         -2.292
_refine_diff_density_rms         0.240
_refine_ls_extinction_coef       0.00108(7)
_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   1.028
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     670
_refine_ls_number_reflns         9635
_refine_ls_number_restraints     649
_refine_ls_R_factor_all          0.0639
_refine_ls_R_factor_gt           0.0624
_refine_ls_restrained_S_all      1.001
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1151P)²+14.1514P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1646
_refine_ls_wR_factor_ref         0.1662
_refine_special_details          ?
_olex2_refinement_description    
;
1. Restrained distances
 S3A-C3A \\sim S3A-C2
 with sigma of 0.02
 S3B-C3B \\sim S3B-C1
 with sigma of 0.02
 C2-C1 \\sim C3B-C4 \\sim C1-C2 \\sim C3A-C4
 with sigma of 0.02
 S3A-C4 \\sim S3A-C1 \\sim S3B-C4 \\sim S3B-C2
 with sigma of 0.02
 Cl4B-C47A \\sim Cl4A-C47B \\sim Cl3B-C47B \\sim Cl3A-C47A
 with sigma of 0.02
 Cl3B-Cl4A \\sim Cl3A-Cl4B
 with sigma of 0.02
2. Restrained planarity
 C3B, C4, S3B, C2, C1
 with sigma of 0.1
3. Uiso/Uaniso restraints and constraints
Uanis(C3B) = Uanis(C3A)
Uanis(C25) = Uanis(C26) = Uanis(C28) = Uanis(C27)
Uanis(C47B) = Uanis(C47A)
Uanis(Cl4A) = Uanis(Cl4B) = Uanis(Cl3B) = Uanis(Cl3A)
4. Rigid body (RIGU) restrains
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 C25, C26, C28, C27
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
5. Others
 Sof(Cl3B)=Sof(Cl4A)=Sof(C47B)=Sof(H47A)=Sof(H47B)=1-FVAR(1)
 Sof(C47A)=Sof(H47C)=Sof(H47D)=Sof(Cl4B)=Sof(Cl3A)=FVAR(1)
 Sof(C3B)=Sof(H3B)=Sof(S3B)=Sof(H2B)=Sof(H1B)=1-FVAR(2)
 Sof(H2A)=Sof(H1A)=Sof(S3A)=Sof(C3A)=Sof(H3A)=FVAR(2)
 Fixed U11: Eu1(0.022389)
 Fixed U12: Eu1(-0.001286)
 Fixed U13: Eu1(-0.000617)
 Fixed U22: Eu1(0.011003)
 Fixed U23: Eu1(-0.001971)
 Fixed U33: Eu1(0.011)
6.a Secondary CH2 refined with riding coordinates:
 C47B(H47A,H47B), C47A(H47C,H47D)
6.b Aromatic/amide H refined with riding coordinates:
 C3B(H3B), C22(H22), C27(H27), C26(H26), C28(H28), C25(H25), C6(H6), C36(H36),
 C14(H14), C29(H29), C46(H46), C18(H18), C42(H42), C40(H40), C2(H2B), C2(H2A),
 C44(H44), C11(H11), C37(H37), C45(H45), C1(H1A), C1(H1B), C43(H43), C17(H17),
 C39(H39), C32(H32), C30(H30), C38(H38), C33(H33), C10(H10), C9(H9), C31(H31),
 C3A(H3A), C19A(H19A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Pt1 Pt 0.56547(3) 0.31925(2) 0.15171(2) 0.01747(9) Uani 1 1 d . . . . .
Eu1 Eu 0.97684(4) 0.33632(3) 0.48669(2) 0.015 Uani 1 1 d . . . . .
As1 As 0.41408(8) 0.24812(7) 0.04667(4) 0.02003(17) Uani 1 1 d . . . . .
Cl2 Cl 0.41001(18) 0.23484(17) 0.21821(11) 0.0300(4) Uani 1 1 d . . . . .
Cl1 Cl 0.72350(18) 0.40504(17) 0.08686(11) 0.0311(4) Uani 1 1 d . . . . .
S1 S 0.6013(3) 0.1050(2) 0.29890(14) 0.0462(6) Uani 1 1 d . . . . .
C3B C 0.756(3) -0.061(3) 0.4565(12) 0.041(5) Uani 0.216(12) 1 d D . P A 2
H3B H 0.742619 -0.028096 0.420978 0.049 Uiso 0.216(12) 1 calc R U P A 2
F2 F 1.4026(5) 0.5741(4) 0.4421(3) 0.0397(13) Uani 1 1 d . . . . .
F3 F 1.4413(5) 0.4348(5) 0.4253(3) 0.0401(12) Uani 1 1 d . . . . .
O1 O 0.9391(5) 0.4709(4) 0.4348(3) 0.0180(10) Uani 1 1 d . . . . .
O2 O 0.7676(5) 0.2515(4) 0.4298(3) 0.0224(11) Uani 1 1 d . . . . .
F1 F 1.4095(5) 0.4872(5) 0.3309(3) 0.0421(13) Uani 1 1 d . . . . .
O4 O 0.9097(5) 0.1566(4) 0.4911(3) 0.0236(11) Uani 1 1 d . . . . .
O5 O 1.0996(5) 0.3369(4) 0.5863(3) 0.0239(11) Uani 1 1 d . . . . .
F4 F 1.2991(6) 0.3736(5) 0.6807(4) 0.0514(15) Uani 1 1 d . . . . .
O6 O 1.1817(5) 0.4200(4) 0.4505(3) 0.0233(11) Uani 1 1 d . . . . .
F7 F 0.7656(7) 0.2637(6) 0.7064(4) 0.0580(16) Uani 1 1 d . . . . .
S3B S 0.8439(16) -0.0906(10) 0.5702(9) 0.027(4) Uani 0.216(12) 1 d D . P A 2
O3 O 0.8480(5) 0.3389(5) 0.5814(3) 0.0274(12) Uani 1 1 d . . . . .
N1 N 0.6943(6) 0.3726(5) 0.2467(3) 0.0152(11) Uani 1 1 d . . . . .
F5 F 1.1496(8) 0.3794(5) 0.7442(3) 0.0595(17) Uani 1 1 d . . . . .
O7 O 0.9780(5) 0.2432(4) 0.3642(3) 0.0276(12) Uani 1 1 d . . . . .
F9 F 0.5792(7) 0.2335(8) 0.6674(4) 0.074(2) Uani 1 1 d . . . . .
Cl3B Cl 0.030(2) 0.7642(16) 0.1418(15) 0.127(2) Uani 0.313(9) 1 d D . P B 2
F6 F 1.1875(8) 0.2391(5) 0.7247(4) 0.071(2) Uani 1 1 d . . . . .
F8 F 0.7288(8) 0.3949(6) 0.6952(4) 0.0631(18) Uani 1 1 d . . . . .
N2 N 0.8589(6) 0.4389(5) 0.3735(3) 0.0179(11) Uani 1 1 d . . . . .
Cl4A Cl 0.121(2) 0.6108(15) 0.0704(14) 0.127(2) Uani 0.313(9) 1 d D . P B 2
C35 C 0.4521(8) 0.3055(7) -0.0401(4) 0.0258(15) Uani 1 1 d . . . . .
C13 C 0.6664(7) 0.1941(6) 0.4494(5) 0.0220(14) Uani 1 1 d . . . . .
C23 C 1.2318(7) 0.4008(6) 0.3919(4) 0.0200(14) Uani 1 1 d . . . . .
C22 C 1.1796(8) 0.3169(6) 0.3279(4) 0.0260(16) Uani 1 1 d . . . . .
H22 H 1.226852 0.314654 0.288235 0.031 Uiso 1 1 calc R U . . .
C27 C 0.8985(7) 0.4179(6) 0.3066(4) 0.0202(7) Uani 1 1 d . . . . .
H27 H 0.979942 0.424813 0.302572 0.024 Uiso 1 1 calc R U . . .
C5 C 0.9225(7) 0.1069(6) 0.5370(5) 0.0220(14) Uani 1 1 d . . . . .
C26 C 0.7440(7) 0.4289(6) 0.3808(4) 0.0202(7) Uani 1 1 d . . . . .
H26 H 0.718845 0.443974 0.427913 0.024 Uiso 1 1 calc R U . . .
C28 C 0.8131(7) 0.3855(6) 0.2435(4) 0.0202(7) Uani 1 1 d . . . . .
H28 H 0.839627 0.372088 0.196668 0.024 Uiso 1 1 calc R U . . .
C25 C 0.6608(7) 0.3949(6) 0.3159(4) 0.0202(7) Uani 1 1 d . . . . .
H25 H 0.579313 0.387384 0.320521 0.024 Uiso 1 1 calc R U . . .
C41 C 0.3639(7) 0.0932(6) 0.0040(5) 0.0261(15) Uani 1 1 d . . . . .
C21 C 1.0569(7) 0.2345(6) 0.3206(4) 0.0195(14) Uani 1 1 d . . . . .
C6 C 1.0096(8) 0.1575(6) 0.6028(5) 0.0268(16) Uani 1 1 d . . . . .
H6 H 1.012278 0.116076 0.634776 0.032 Uiso 1 1 calc R U . . .
C7 C 1.0901(8) 0.2657(6) 0.6209(5) 0.0250(15) Uani 1 1 d . . . . .
C24 C 1.3713(8) 0.4754(6) 0.3970(5) 0.0288(15) Uani 1 1 d . . . . .
C36 C 0.3885(9) 0.3592(7) -0.0620(5) 0.0327(18) Uani 1 1 d . . . . .
H36 H 0.331448 0.374281 -0.032731 0.039 Uiso 1 1 calc R U . . .
C16 C 0.7008(9) 0.2911(9) 0.6632(6) 0.0398(19) Uani 1 1 d . . . . .
C34 C 0.2587(7) 0.2583(7) 0.0686(4) 0.0240(15) Uani 1 1 d . . . . .
C14 C 0.6452(8) 0.2011(7) 0.5249(5) 0.0302(17) Uani 1 1 d . . . . .
H14 H 0.568530 0.153794 0.535394 0.036 Uiso 1 1 calc R U . . .
C12 C 0.5663(8) 0.1190(7) 0.3895(5) 0.0287(16) Uani 1 1 d . . . . .
C20 C 1.0173(7) 0.1339(6) 0.2615(4) 0.0209(14) Uani 1 1 d . . . . .
C4 C 0.8411(7) -0.0111(6) 0.5178(4) 0.0239(15) Uani 1 1 d D . . . .
C29 C 0.2660(9) 0.3476(8) 0.1220(5) 0.0348(19) Uani 1 1 d . . . . .
H29 H 0.343037 0.399633 0.147994 0.042 Uiso 1 1 calc R U . . .
C46 C 0.3321(10) 0.0475(9) -0.0718(6) 0.043(2) Uani 1 1 d . . . . .
H46 H 0.332994 0.089238 -0.104271 0.052 Uiso 1 1 calc R U . . .
C18 C 1.0129(10) -0.0046(8) 0.1632(6) 0.044(2) Uani 1 1 d . . . . .
H18 H 1.041247 -0.036899 0.122124 0.053 Uiso 1 1 calc R U . . .
C42 C 0.3624(10) 0.0309(8) 0.0520(6) 0.041(2) Uani 1 1 d . . . . .
H42 H 0.386099 0.063176 0.103049 0.049 Uiso 1 1 calc R U . . .
C40 C 0.5429(9) 0.2876(9) -0.0825(5) 0.039(2) Uani 1 1 d . . . . .
H40 H 0.588212 0.253740 -0.066868 0.047 Uiso 1 1 calc R U . . .
C15 C 0.7332(8) 0.2751(7) 0.5832(5) 0.0286(16) Uani 1 1 d . . . . .
C2 C 0.7358(10) -0.1951(7) 0.5160(7) 0.048(2) Uani 1 1 d D . . . .
H2B H 0.710554 -0.261839 0.526854 0.058 Uiso 0.216(12) 1 calc R U P A 2
H2A H 0.717013 -0.257834 0.531496 0.058 Uiso 0.784(12) 1 calc R U P A 1
C44 C 0.2957(10) -0.1253(9) -0.0514(8) 0.053(2) Uani 1 1 d . . . . .
H44 H 0.273408 -0.199084 -0.070310 0.064 Uiso 1 1 calc R U . . .
C11 C 0.4422(9) 0.0535(8) 0.3919(7) 0.046(2) Uani 1 1 d . . . . .
H11 H 0.405809 0.047891 0.435856 0.056 Uiso 1 1 calc R U . . .
C8 C 1.1821(10) 0.3134(7) 0.6922(5) 0.0386(19) Uani 1 1 d . . . . .
C37 C 0.4107(11) 0.3911(8) -0.1295(6) 0.044(2) Uani 1 1 d . . . . .
H37 H 0.366816 0.425673 -0.145707 0.053 Uiso 1 1 calc R U . . .
C45 C 0.2980(11) -0.0646(10) -0.0989(7) 0.055(3) Uani 1 1 d . . . . .
H45 H 0.276931 -0.097220 -0.150063 0.066 Uiso 1 1 calc R U . . .
C1 C 0.6809(9) -0.1891(7) 0.4557(6) 0.046(2) Uani 1 1 d D . . . .
H1A H 0.615841 -0.249319 0.424107 0.055 Uiso 0.784(12) 1 calc R U P A 1
H1B H 0.615442 -0.244234 0.421131 0.055 Uiso 0.216(12) 1 calc R U P A 2
C43 C 0.3256(11) -0.0793(9) 0.0242(8) 0.052(3) Uani 1 1 d . . . . .
H43 H 0.321349 -0.121966 0.056559 0.062 Uiso 1 1 calc R U . . .
C17 C 0.9064(11) -0.0567(8) 0.1899(6) 0.045(2) Uani 1 1 d . . . . .
H17 H 0.852718 -0.129592 0.169865 0.054 Uiso 1 1 calc R U . . .
C39 C 0.5640(11) 0.3202(11) -0.1468(6) 0.049(2) Uani 1 1 d . . . . .
H39 H 0.624060 0.308437 -0.174941 0.059 Uiso 1 1 calc R U . . .
C32 C 0.0351(9) 0.1899(9) 0.0439(6) 0.047(3) Uani 1 1 d . . . . .
H32 H -0.041921 0.137492 0.018159 0.056 Uiso 1 1 calc R U . . .
C30 C 0.1553(11) 0.3593(9) 0.1368(6) 0.049(3) Uani 1 1 d . . . . .
H30 H 0.158076 0.419252 0.172713 0.059 Uiso 1 1 calc R U . . .
C38 C 0.4975(10) 0.3704(9) -0.1707(6) 0.044(2) Uani 1 1 d . . . . .
H38 H 0.511805 0.390465 -0.215364 0.053 Uiso 1 1 calc R U . . .
C33 C 0.1454(8) 0.1792(8) 0.0301(5) 0.037(2) Uani 1 1 d . . . . .
H33 H 0.142746 0.118675 -0.005127 0.045 Uiso 1 1 calc R U . . .
C10 C 0.3764(11) -0.0047(9) 0.3189(8) 0.057(3) Uani 1 1 d . . . . .
H10 H 0.291070 -0.050614 0.309906 0.068 Uiso 1 1 calc R U . . .
C9 C 0.4492(12) 0.0133(10) 0.2648(7) 0.057(3) Uani 1 1 d . . . . .
H9 H 0.421038 -0.019942 0.214246 0.068 Uiso 1 1 calc R U . . .
C31 C 0.0435(10) 0.2818(11) 0.0978(7) 0.057(3) Uani 1 1 d . . . . .
H31 H -0.029402 0.290392 0.107307 0.069 Uiso 1 1 calc R U . . .
C47B C -0.006(4) 0.633(6) 0.095(10) 0.131(11) Uani 0.313(9) 1 d D . P B 2
H47A H -0.049078 0.586352 0.126994 0.158 Uiso 0.313(9) 1 calc R U P B 2
H47B H -0.063354 0.612531 0.050610 0.158 Uiso 0.313(9) 1 calc R U P B 2
C47A C 0.022(3) 0.6420(14) 0.093(5) 0.131(11) Uani 0.687(9) 1 d D . P B 1
H47C H -0.064697 0.613983 0.103834 0.158 Uiso 0.687(9) 1 calc R U P B 1
H47D H 0.019934 0.641819 0.040618 0.158 Uiso 0.687(9) 1 calc R U P B 1
Cl4B Cl 0.0814(9) 0.5548(7) 0.1054(7) 0.127(2) Uani 0.687(9) 1 d D . P B 1
Cl3A Cl 0.0983(11) 0.7736(7) 0.1454(7) 0.127(2) Uani 0.687(9) 1 d D . P B 1
S3A S 0.7351(2) -0.0680(2) 0.44000(17) 0.0279(10) Uani 0.784(12) 1 d D . P A 1
C3A C 0.828(2) -0.0897(16) 0.5532(13) 0.041(5) Uani 0.784(12) 1 d D . P A 1
H3A H 0.876278 -0.075204 0.598096 0.049 Uiso 0.784(12) 1 calc R U P A 1
S2A S 0.8797(2) 0.02539(17) 0.26467(13) 0.0422(6) Uani 1 1 d . . . . .
C19A C 1.0779(10) 0.1057(8) 0.2046(5) 0.040(2) Uani 1 1 d . . . . .
H19A H 1.153975 0.153530 0.193791 0.048 Uiso 1 1 calc R U . . .


_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
Pt1 As1 2.3435(8) . ?
Pt1 Cl2 2.2860(19) . ?
Pt1 Cl1 2.2899(19) . ?
Pt1 N1 2.081(6) . ?
Eu1 Eu1 4.2999(8) 2_766 ?
Eu1 O1 2.494(5) . ?
Eu1 O1 2.512(5) 2_766 ?
Eu1 O2 2.352(5) . ?
Eu1 O4 2.332(5) . ?
Eu1 O5 2.327(6) . ?
Eu1 O6 2.394(5) . ?
Eu1 O3 2.338(5) . ?
Eu1 O7 2.340(5) . ?
As1 C35 1.939(8) . ?
As1 C41 1.954(8) . ?
As1 C34 1.937(7) . ?
S1 C12 1.719(9) . ?
S1 C9 1.717(12) . ?
C3B H3B 0.9300 . ?
C3B C4 1.34(2) . ?
C3B C1 1.64(5) . ?
F2 C24 1.333(10) . ?
F3 C24 1.342(11) . ?
O1 N2 1.329(8) . ?
O2 C13 1.248(9) . ?
F1 C24 1.333(10) . ?
O4 C5 1.263(10) . ?
O5 C7 1.276(10) . ?
F4 C8 1.338(13) . ?
O6 C23 1.268(9) . ?
F7 C16 1.320(13) . ?
S3B C4 1.650(11) . ?
S3B C2 1.585(13) . ?
O3 C15 1.283(11) . ?
N1 C28 1.340(10) . ?
N1 C25 1.351(9) . ?
F5 C8 1.347(13) . ?
O7 C21 1.265(10) . ?
F9 C16 1.338(12) . ?
Cl3B C47B 1.71(3) . ?
F6 C8 1.344(11) . ?
F8 C16 1.333(13) . ?
N2 C27 1.342(10) . ?
N2 C26 1.315(10) . ?
Cl4A C47B 1.70(3) . ?
C35 C36 1.377(13) . ?
C35 C40 1.407(13) . ?
C13 C14 1.411(12) . ?
C13 C12 1.456(12) . ?
C23 C22 1.377(11) . ?
C23 C24 1.528(11) . ?
C22 H22 0.9300 . ?
C22 C21 1.410(11) . ?
C27 H27 0.9300 . ?
C27 C28 1.389(11) . ?
C5 C6 1.414(12) . ?
C5 C4 1.480(10) . ?
C26 H26 0.9300 . ?
C26 C25 1.396(11) . ?
C28 H28 0.9300 . ?
C25 H25 0.9300 . ?
C41 C46 1.374(13) . ?
C41 C42 1.379(14) . ?
C21 C20 1.457(10) . ?
C6 H6 0.9300 . ?
C6 C7 1.371(12) . ?
C7 C8 1.521(12) . ?
C36 H36 0.9300 . ?
C36 C37 1.417(14) . ?
C16 C15 1.525(12) . ?
C34 C29 1.372(12) . ?
C34 C33 1.380(12) . ?
C14 H14 0.9300 . ?
C14 C15 1.369(13) . ?
C12 C11 1.377(13) . ?
C20 S2A 1.719(8) . ?
C20 C19A 1.354(12) . ?
C4 S3A 1.692(8) . ?
C4 C3A 1.369(17) . ?
C29 H29 0.9300 . ?
C29 C30 1.404(14) . ?
C46 H46 0.9300 . ?
C46 C45 1.410(16) . ?
C18 H18 0.9300 . ?
C18 C17 1.334(16) . ?
C18 C19A 1.420(13) . ?
C42 H42 0.9300 . ?
C42 C43 1.383(14) . ?
C40 H40 0.9300 . ?
C40 C39 1.363(15) . ?
C2 H2B 0.9300 . ?
C2 H2A 0.9300 . ?
C2 C1 1.320(15) . ?
C2 C3A 1.42(2) . ?
C44 H44 0.9300 . ?
C44 C45 1.35(2) . ?
C44 C43 1.369(19) . ?
C11 H11 0.9300 . ?
C11 C10 1.424(16) . ?
C37 H37 0.9300 . ?
C37 C38 1.370(16) . ?
C45 H45 0.9300 . ?
C1 H1A 0.9300 . ?
C1 H1B 0.9300 . ?
C1 S3A 1.649(9) . ?
C43 H43 0.9300 . ?
C17 H17 0.9300 . ?
C17 S2A 1.705(10) . ?
C39 H39 0.9300 . ?
C39 C38 1.379(17) . ?
C32 H32 0.9300 . ?
C32 C33 1.389(13) . ?
C32 C31 1.398(15) . ?
C30 H30 0.9300 . ?
C30 C31 1.364(17) . ?
C38 H38 0.9300 . ?
C33 H33 0.9300 . ?
C10 H10 0.9300 . ?
C10 C9 1.328(19) . ?
C9 H9 0.9300 . ?
C31 H31 0.9300 . ?
C47B H47A 0.9700 . ?
C47B H47B 0.9700 . ?
C47A H47C 0.9700 . ?
C47A H47D 0.9700 . ?
C47A Cl4B 1.70(3) . ?
C47A Cl3A 1.71(3) . ?
C3A H3A 0.9300 . ?
C19A H19A 0.9300 . ?

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
Cl2 Pt1 As1 88.32(5) . . ?
Cl2 Pt1 Cl1 179.06(7) . . ?
Cl1 Pt1 As1 92.62(5) . . ?
N1 Pt1 As1 176.23(16) . . ?
N1 Pt1 Cl2 88.84(17) . . ?
N1 Pt1 Cl1 90.23(17) . . ?
O1 Eu1 Eu1 30.69(11) 2_766 2_766 ?
O1 Eu1 Eu1 30.93(11) . 2_766 ?
O1 Eu1 O1 61.63(19) . 2_766 ?
O2 Eu1 Eu1 96.12(13) . 2_766 ?
O2 Eu1 O1 118.43(17) . 2_766 ?
O2 Eu1 O1 72.80(18) . . ?
O2 Eu1 O6 137.49(19) . . ?
O4 Eu1 Eu1 165.12(14) . 2_766 ?
O4 Eu1 O1 148.24(18) . . ?
O4 Eu1 O1 144.09(18) . 2_766 ?
O4 Eu1 O2 76.33(19) . . ?
O4 Eu1 O6 116.06(19) . . ?
O4 Eu1 O3 82.2(2) . . ?
O4 Eu1 O7 75.7(2) . . ?
O5 Eu1 Eu1 107.63(13) . 2_766 ?
O5 Eu1 O1 77.25(17) . 2_766 ?
O5 Eu1 O1 138.10(17) . . ?
O5 Eu1 O2 140.26(19) . . ?
O5 Eu1 O4 72.78(18) . . ?
O5 Eu1 O6 79.6(2) . . ?
O5 Eu1 O3 79.3(2) . . ?
O5 Eu1 O7 120.7(2) . . ?
O6 Eu1 Eu1 78.21(13) . 2_766 ?
O6 Eu1 O1 76.54(17) . 2_766 ?
O6 Eu1 O1 83.23(18) . . ?
O3 Eu1 Eu1 83.27(14) . 2_766 ?
O3 Eu1 O1 95.18(19) . . ?
O3 Eu1 O1 73.12(18) . 2_766 ?
O3 Eu1 O2 72.20(19) . . ?
O3 Eu1 O6 146.13(19) . . ?
O3 Eu1 O7 142.7(2) . . ?
O7 Eu1 Eu1 114.87(15) . 2_766 ?
O7 Eu1 O1 138.21(18) . 2_766 ?
O7 Eu1 O1 88.51(19) . . ?
O7 Eu1 O2 73.60(19) . . ?
O7 Eu1 O6 71.14(19) . . ?
C35 As1 Pt1 119.9(2) . . ?
C35 As1 C41 102.6(4) . . ?
C41 As1 Pt1 111.8(3) . . ?
C34 As1 Pt1 113.5(2) . . ?
C34 As1 C35 102.9(4) . . ?
C34 As1 C41 104.4(3) . . ?
C12 S1 C9 91.5(6) . . ?
C4 C3B H3B 126.3 . . ?
C4 C3B C1 107(2) . . ?
C1 C3B H3B 126.3 . . ?
Eu1 O1 Eu1 118.37(19) . 2_766 ?
N2 O1 Eu1 119.7(4) . 2_766 ?
N2 O1 Eu1 120.9(4) . . ?
C13 O2 Eu1 133.2(5) . . ?
C5 O4 Eu1 137.2(5) . . ?
C7 O5 Eu1 133.2(5) . . ?
C23 O6 Eu1 134.2(5) . . ?
C2 S3B C4 93.1(8) . . ?
C15 O3 Eu1 130.3(5) . . ?
C28 N1 Pt1 123.0(5) . . ?
C28 N1 C25 116.1(6) . . ?
C25 N1 Pt1 121.0(5) . . ?
C21 O7 Eu1 138.7(5) . . ?
O1 N2 C27 118.5(6) . . ?
C26 N2 O1 118.9(6) . . ?
C26 N2 C27 122.6(6) . . ?
C36 C35 As1 121.1(7) . . ?
C36 C35 C40 120.1(8) . . ?
C40 C35 As1 118.7(7) . . ?
O2 C13 C14 123.4(8) . . ?
O2 C13 C12 116.4(7) . . ?
C14 C13 C12 120.1(7) . . ?
O6 C23 C22 128.4(7) . . ?
O6 C23 C24 114.7(7) . . ?
C22 C23 C24 116.7(7) . . ?
C23 C22 H22 119.0 . . ?
C23 C22 C21 122.1(7) . . ?
C21 C22 H22 119.0 . . ?
N2 C27 H27 121.4 . . ?
N2 C27 C28 117.3(7) . . ?
C28 C27 H27 121.4 . . ?
O4 C5 C6 123.8(7) . . ?
O4 C5 C4 115.8(7) . . ?
C6 C5 C4 120.3(7) . . ?
N2 C26 H26 120.9 . . ?
N2 C26 C25 118.1(7) . . ?
C25 C26 H26 120.9 . . ?
N1 C28 C27 123.4(7) . . ?
N1 C28 H28 118.3 . . ?
C27 C28 H28 118.3 . . ?
N1 C25 C26 122.5(7) . . ?
N1 C25 H25 118.7 . . ?
C26 C25 H25 118.7 . . ?
C46 C41 As1 120.9(8) . . ?
C42 C41 As1 118.2(6) . . ?
C42 C41 C46 120.8(9) . . ?
O7 C21 C22 122.5(7) . . ?
O7 C21 C20 117.5(7) . . ?
C22 C21 C20 119.9(7) . . ?
C5 C6 H6 119.0 . . ?
C7 C6 C5 122.0(8) . . ?
C7 C6 H6 119.0 . . ?
O5 C7 C6 129.1(8) . . ?
O5 C7 C8 112.3(7) . . ?
C6 C7 C8 118.6(7) . . ?
F2 C24 F3 106.3(7) . . ?
F2 C24 C23 112.5(7) . . ?
F3 C24 C23 110.3(7) . . ?
F1 C24 F2 107.8(7) . . ?
F1 C24 F3 105.9(7) . . ?
F1 C24 C23 113.6(7) . . ?
C35 C36 H36 120.3 . . ?
C35 C36 C37 119.4(9) . . ?
C37 C36 H36 120.3 . . ?
F7 C16 F9 107.3(9) . . ?
F7 C16 F8 105.6(9) . . ?
F7 C16 C15 112.1(8) . . ?
F9 C16 F8 107.3(9) . . ?
F9 C16 C15 112.9(8) . . ?
F8 C16 C15 111.2(8) . . ?
C29 C34 As1 117.8(6) . . ?
C29 C34 C33 121.7(7) . . ?
C33 C34 As1 120.5(6) . . ?
C13 C14 H14 118.8 . . ?
C15 C14 C13 122.5(7) . . ?
C15 C14 H14 118.8 . . ?
C13 C12 S1 118.1(6) . . ?
C11 C12 S1 111.1(8) . . ?
C11 C12 C13 130.8(9) . . ?
C21 C20 S2A 118.8(6) . . ?
C19A C20 C21 130.1(8) . . ?
C19A C20 S2A 110.9(6) . . ?
C3B C4 S3B 115.1(19) . . ?
C3B C4 C5 121(2) . . ?
C5 C4 S3B 123.4(7) . . ?
C5 C4 S3A 118.9(5) . . ?
C3A C4 C5 132.4(10) . . ?
C3A C4 S3A 108.6(10) . . ?
C34 C29 H29 120.5 . . ?
C34 C29 C30 119.0(9) . . ?
C30 C29 H29 120.5 . . ?
C41 C46 H46 121.0 . . ?
C41 C46 C45 118.0(11) . . ?
C45 C46 H46 121.0 . . ?
C17 C18 H18 123.9 . . ?
C17 C18 C19A 112.3(9) . . ?
C19A C18 H18 123.9 . . ?
C41 C42 H42 120.0 . . ?
C41 C42 C43 120.0(10) . . ?
C43 C42 H42 120.0 . . ?
C35 C40 H40 120.3 . . ?
C39 C40 C35 119.4(10) . . ?
C39 C40 H40 120.3 . . ?
O3 C15 C16 110.5(8) . . ?
O3 C15 C14 128.6(8) . . ?
C14 C15 C16 120.9(8) . . ?
S3B C2 H2B 119.4 . . ?
C1 C2 S3B 121.1(8) . . ?
C1 C2 H2B 119.4 . . ?
C1 C2 H2A 125.7 . . ?
C1 C2 C3A 108.6(8) . . ?
C3A C2 H2A 125.7 . . ?
C45 C44 H44 119.7 . . ?
C45 C44 C43 120.7(10) . . ?
C43 C44 H44 119.7 . . ?
C12 C11 H11 124.1 . . ?
C12 C11 C10 111.8(10) . . ?
C10 C11 H11 124.1 . . ?
F4 C8 F5 106.4(8) . . ?
F4 C8 F6 107.1(9) . . ?
F4 C8 C7 112.3(8) . . ?
F5 C8 C7 110.6(8) . . ?
F6 C8 F5 105.8(8) . . ?
F6 C8 C7 114.2(7) . . ?
C36 C37 H37 120.4 . . ?
C38 C37 C36 119.2(10) . . ?
C38 C37 H37 120.4 . . ?
C46 C45 H45 119.6 . . ?
C44 C45 C46 120.8(11) . . ?
C44 C45 H45 119.6 . . ?
C3B C1 H1B 128.4 . . ?
C2 C1 C3B 103.3(8) . . ?
C2 C1 H1A 122.1 . . ?
C2 C1 H1B 128.4 . . ?
C2 C1 S3A 115.7(7) . . ?
S3A C1 H1A 122.1 . . ?
C42 C43 H43 120.2 . . ?
C44 C43 C42 119.6(12) . . ?
C44 C43 H43 120.2 . . ?
C18 C17 H17 123.7 . . ?
C18 C17 S2A 112.5(7) . . ?
S2A C17 H17 123.7 . . ?
C40 C39 H39 119.6 . . ?
C40 C39 C38 120.9(10) . . ?
C38 C39 H39 119.6 . . ?
C33 C32 H32 121.0 . . ?
C33 C32 C31 118.0(9) . . ?
C31 C32 H32 121.0 . . ?
C29 C30 H30 120.4 . . ?
C31 C30 C29 119.3(9) . . ?
C31 C30 H30 120.4 . . ?
C37 C38 H38 119.6 . . ?
C39 C38 C37 120.8(9) . . ?
C39 C38 H38 119.6 . . ?
C34 C33 C32 120.0(8) . . ?
C34 C33 H33 120.0 . . ?
C32 C33 H33 120.0 . . ?
C11 C10 H10 123.4 . . ?
C9 C10 C11 113.2(10) . . ?
C9 C10 H10 123.4 . . ?
S1 C9 H9 123.8 . . ?
C10 C9 S1 112.4(9) . . ?
C10 C9 H9 123.8 . . ?
C32 C31 H31 118.9 . . ?
C30 C31 C32 122.1(9) . . ?
C30 C31 H31 118.9 . . ?
Cl3B C47B H47A 108.8 . . ?
Cl3B C47B H47B 108.8 . . ?
Cl4A C47B Cl3B 114(3) . . ?
Cl4A C47B H47A 108.8 . . ?
Cl4A C47B H47B 108.8 . . ?
H47A C47B H47B 107.7 . . ?
H47C C47A H47D 107.3 . . ?
Cl4B C47A H47C 108.1 . . ?
Cl4B C47A H47D 108.1 . . ?
Cl4B C47A Cl3A 117(3) . . ?
Cl3A C47A H47C 108.1 . . ?
Cl3A C47A H47D 108.1 . . ?
C1 S3A C4 92.4(5) . . ?
C4 C3A C2 114.6(12) . . ?
C4 C3A H3A 122.7 . . ?
C2 C3A H3A 122.7 . . ?
C17 S2A C20 91.5(5) . . ?
C20 C19A C18 112.9(9) . . ?
C20 C19A H19A 123.6 . . ?
C18 C19A H19A 123.6 . . ?

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
Pt1 N1 C28 C27 -178.0(6) . . . . ?
Pt1 N1 C25 C26 178.8(6) . . . . ?
Eu1 O1 N2 C27 109.2(6) 2_766 . . . ?
Eu1 O1 N2 C27 -82.5(7) . . . . ?
Eu1 O1 N2 C26 -70.9(7) 2_766 . . . ?
Eu1 O1 N2 C26 97.4(6) . . . . ?
Eu1 O2 C13 C14 27.6(11) . . . . ?
Eu1 O2 C13 C12 -154.1(5) . . . . ?
Eu1 O4 C5 C6 -11.2(12) . . . . ?
Eu1 O4 C5 C4 169.8(5) . . . . ?
Eu1 O5 C7 C6 9.7(14) . . . . ?
Eu1 O5 C7 C8 -169.0(6) . . . . ?
Eu1 O6 C23 C22 -2.6(13) . . . . ?
Eu1 O6 C23 C24 -176.8(5) . . . . ?
Eu1 O3 C15 C16 164.9(6) . . . . ?
Eu1 O3 C15 C14 -15.3(13) . . . . ?
Eu1 O7 C21 C22 -25.4(13) . . . . ?
Eu1 O7 C21 C20 153.8(6) . . . . ?
As1 C35 C36 C37 -174.2(7) . . . . ?
As1 C35 C40 C39 175.1(8) . . . . ?
As1 C41 C46 C45 179.3(8) . . . . ?
As1 C41 C42 C43 179.1(8) . . . . ?
As1 C34 C29 C30 177.4(9) . . . . ?
As1 C34 C33 C32 -177.1(9) . . . . ?
S1 C12 C11 C10 -2.0(12) . . . . ?
O1 N2 C27 C28 -179.5(6) . . . . ?
O1 N2 C26 C25 -179.8(6) . . . . ?
O2 C13 C14 C15 2.5(13) . . . . ?
O2 C13 C12 S1 7.4(10) . . . . ?
O2 C13 C12 C11 -172.8(10) . . . . ?
O4 C5 C6 C7 -1.7(13) . . . . ?
O4 C5 C4 C3B -2.2(16) . . . . ?
O4 C5 C4 S3B 179.7(11) . . . . ?
O4 C5 C4 S3A -2.8(10) . . . . ?
O4 C5 C4 C3A -180(2) . . . . ?
O5 C7 C8 F4 -49.2(11) . . . . ?
O5 C7 C8 F5 69.6(10) . . . . ?
O5 C7 C8 F6 -171.3(9) . . . . ?
O6 C23 C22 C21 -2.6(14) . . . . ?
O6 C23 C24 F2 -30.3(10) . . . . ?
O6 C23 C24 F3 88.1(8) . . . . ?
O6 C23 C24 F1 -153.2(7) . . . . ?
F7 C16 C15 O3 -64.4(11) . . . . ?
F7 C16 C15 C14 115.9(10) . . . . ?
S3B C2 C1 C3B 2(2) . . . . ?
O7 C21 C20 S2A -11.7(10) . . . . ?
O7 C21 C20 C19A 174.9(9) . . . . ?
F9 C16 C15 O3 174.4(9) . . . . ?
F9 C16 C15 C14 -5.4(14) . . . . ?
F8 C16 C15 O3 53.6(11) . . . . ?
F8 C16 C15 C14 -126.1(10) . . . . ?
N2 C27 C28 N1 -1.3(11) . . . . ?
N2 C26 C25 N1 -0.2(11) . . . . ?
C35 C36 C37 C38 -1.7(15) . . . . ?
C35 C40 C39 C38 0.0(17) . . . . ?
C13 C14 C15 O3 -8.3(15) . . . . ?
C13 C14 C15 C16 171.5(8) . . . . ?
C13 C12 C11 C10 178.1(9) . . . . ?
C23 C22 C21 O7 15.3(13) . . . . ?
C23 C22 C21 C20 -163.9(8) . . . . ?
C22 C23 C24 F2 154.7(8) . . . . ?
C22 C23 C24 F3 -86.8(9) . . . . ?
C22 C23 C24 F1 31.9(11) . . . . ?
C22 C21 C20 S2A 167.5(6) . . . . ?
C22 C21 C20 C19A -5.9(14) . . . . ?
C27 N2 C26 C25 0.1(11) . . . . ?
C5 C6 C7 O5 2.1(15) . . . . ?
C5 C6 C7 C8 -179.2(8) . . . . ?
C5 C4 S3A C1 -178.2(7) . . . . ?
C5 C4 C3A C2 178.8(12) . . . . ?
C26 N2 C27 C28 0.6(11) . . . . ?
C28 N1 C25 C26 -0.4(11) . . . . ?
C25 N1 C28 C27 1.1(11) . . . . ?
C41 C46 C45 C44 0.6(17) . . . . ?
C41 C42 C43 C44 2.6(17) . . . . ?
C21 C20 S2A C17 -174.1(7) . . . . ?
C21 C20 C19A C18 173.7(9) . . . . ?
C6 C5 C4 C3B 178.8(14) . . . . ?
C6 C5 C4 S3B 0.7(14) . . . . ?
C6 C5 C4 S3A 178.2(6) . . . . ?
C6 C5 C4 C3A 1(2) . . . . ?
C6 C7 C8 F4 131.9(8) . . . . ?
C6 C7 C8 F5 -109.3(9) . . . . ?
C6 C7 C8 F6 9.8(14) . . . . ?
C24 C23 C22 C21 171.5(8) . . . . ?
C36 C35 C40 C39 -2.4(15) . . . . ?
C36 C37 C38 C39 -0.7(16) . . . . ?
C34 C29 C30 C31 0.0(18) . . . . ?
C14 C13 C12 S1 -174.3(6) . . . . ?
C14 C13 C12 C11 5.5(14) . . . . ?
C12 S1 C9 C10 0.5(11) . . . . ?
C12 C13 C14 C15 -175.7(8) . . . . ?
C12 C11 C10 C9 2.5(16) . . . . ?
C4 C3B C1 C2 -1.4(19) . . . . ?
C4 S3B C2 C1 -1.8(16) . . . . ?
C4 C5 C6 C7 177.2(8) . . . . ?
C29 C34 C33 C32 1.3(16) . . . . ?
C29 C30 C31 C32 1(2) . . . . ?
C46 C41 C42 C43 -1.6(15) . . . . ?
C18 C17 S2A C20 -0.8(9) . . . . ?
C42 C41 C46 C45 0.0(15) . . . . ?
C40 C35 C36 C37 3.2(13) . . . . ?
C40 C39 C38 C37 1.6(18) . . . . ?
C2 S3B C4 C3B 0.6(12) . . . . ?
C2 S3B C4 C5 178.8(8) . . . . ?
C2 C1 S3A C4 -0.6(9) . . . . ?
C11 C10 C9 S1 -1.8(15) . . . . ?
C45 C44 C43 C42 -2.0(17) . . . . ?
C1 C3B C4 S3B 0.4(16) . . . . ?
C1 C3B C4 C5 -177.8(10) . . . . ?
C1 C2 C3A C4 -2(3) . . . . ?
C43 C44 C45 C46 0.4(18) . . . . ?
C17 C18 C19A C20 -0.4(15) . . . . ?
C33 C34 C29 C30 -1.1(16) . . . . ?
C33 C32 C31 C30 -1(2) . . . . ?
C9 S1 C12 C13 -179.2(8) . . . . ?
C9 S1 C12 C11 0.9(9) . . . . ?
C31 C32 C33 C34 -0.5(19) . . . . ?
S3A C4 C3A C2 2(3) . . . . ?
C3A C4 S3A C1 -0.7(16) . . . . ?
C3A C2 C1 S3A 1.6(19) . . . . ?
S2A C20 C19A C18 -0.2(12) . . . . ?
C19A C20 S2A C17 0.5(8) . . . . ?
C19A C18 C17 S2A 0.8(13) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.403
_oxdiff_exptl_absorpt_empirical_full_min 0.549

# start Validation Reply Form
_vrf_PLAT973_exp_332_auto        
;
PROBLEM: Check Calcd Positive Resid. Density on Eu1 3.52 eA-3
RESPONSE: The large residue dendity may be caused by the inappropriate  
          absorption correction even if the the overall low data quality 
          and disorder is a more likely cause 
;
# end Validation Reply Form
####################################################################### 
# 
# 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_exp_239_auto
_database_code_depnum_ccdc_archive 'CCDC 2395045'
loop_
_audit_author_name
_audit_author_address
'Marzio Rancan'
;ICMATE CNR
Italy
;
_audit_update_record             
;
2025-04-02 deposited with the CCDC.	2025-05-30 downloaded from the CCDC.
;
_audit_creation_date             2025-04-01
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.03.04 svn.red2d20d0 for OlexSys, GUI svn.r7188)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C78 H46 Cl2 Eu2 F18 N6 O14 Pt2 S6, 2[CH2Cl2]'
_chemical_formula_sum            'C78 H46 Cl2 Eu2 F18 N6 O14 Pt2 S6'
_chemical_formula_weight         2590.57
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Pt2 Eu2 S6 Cl2 O14 N4 F18 C20 H20'
_chemical_oxdiff_usercomment     'MB166 da DCM/C5'
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'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -8.9294 11.1857 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 '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'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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           14
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   14.6534(7)
_cell_length_b                   16.0682(8)
_cell_length_c                   21.6641(9)
_cell_angle_alpha                90
_cell_angle_beta                 108.190(5)
_cell_angle_gamma                90
_cell_volume                     4846.0(4)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    1702
_cell_measurement_temperature    296.1(4)
_cell_measurement_theta_max      35.5290
_cell_measurement_theta_min      4.2890
_shelx_estimated_absorpt_T_max   0.485
_shelx_estimated_absorpt_T_min   0.217
_exptl_absorpt_coefficient_mu    16.938
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.93201
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.41.103a (Rigaku Oxford Diffraction, 2021)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            orange
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    1.775
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             2484
_exptl_crystal_size_max          0.13
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.05
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0492
_diffrn_reflns_av_unetI/netI     0.0584
_diffrn_reflns_Laue_measured_fraction_full 0.980
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            17783
_diffrn_reflns_point_group_measured_fraction_full 0.980
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_theta_full        60.820
_diffrn_reflns_theta_max         60.820
_diffrn_reflns_theta_min         4.202
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      296.1(4)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 8.0637
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω   -102.00 -10.00   0.25    5.00    --  -33.95 -69.00  83.00  368
  2  ω    -57.00  35.00   0.25    5.00    --  -33.95  69.00-144.00  368
  3  ω     19.00  31.50   0.25    5.00    --   33.95 -69.00  83.00   50
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0772777000
_diffrn_orient_matrix_UB_12      0.0648748000
_diffrn_orient_matrix_UB_13      -0.0003499000
_diffrn_orient_matrix_UB_21      0.0076870000
_diffrn_orient_matrix_UB_22      -0.0375914000
_diffrn_orient_matrix_UB_23      -0.0635510000
_diffrn_orient_matrix_UB_31      -0.0786728000
_diffrn_orient_matrix_UB_32      0.0599856000
_diffrn_orient_matrix_UB_33      -0.0395107000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4614
_reflns_number_total             7220
_reflns_odcompleteness_completeness 19.64
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     58.86
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _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 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_collection       'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_reduction        'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         2.464
_refine_diff_density_min         -1.232
_refine_diff_density_rms         0.173
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     618
_refine_ls_number_reflns         7220
_refine_ls_number_restraints     764
_refine_ls_R_factor_all          0.1704
_refine_ls_R_factor_gt           0.1326
_refine_ls_restrained_S_all      1.007
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1719P)²+80.7145P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3486
_refine_ls_wR_factor_ref         0.3757
_refine_special_details          ?
_olex2_refinement_description    
;
1. Restrained distances
 S3-C21 = S3-C24
 1.71 with sigma of 0.02
 S2-C16 = S2-C13
 1.71 with sigma of 0.02
 S1-C4 = S1-C1
 1.71 with sigma of 0.02
 C4-C3 = C2-C1
 1.36 with sigma of 0.02
 C21-C22 = C23-C24
 1.36 with sigma of 0.02
 C3-C2
 1.42 with sigma of 0.02
 C22-C23
 1.42 with sigma of 0.02
 C16-C15 = C14-C13
 1.36 with sigma of 0.02
 C15-C14
 1.42 with sigma of 0.02
 C19B-C18 = C19A-C18 = C20-C19B = C20-C19A
 1.4 with sigma of 0.02
 C21-C23 = C22-C24
 2.31 with sigma of 0.04
 C4-C2 = C3-C1
 2.31 with sigma of 0.04
 S3-C22 = S3-C23
 2.54 with sigma of 0.04
 C16-C14 = C15-C13
 2.31 with sigma of 0.04
 S1-C3 = S1-C2
 2.54 with sigma of 0.04
 S2-C15 = S2-C14
 2.54 with sigma of 0.04
 C18-C17B \\sim C18-C17A
 with sigma of 0.02
 C8-F2 \\sim C8-F3 \\sim C8-F1
 with sigma of 0.02
 C17B-F4B \\sim C17B-F5B \\sim C17B-F6B
 with sigma of 0.02
 C17A-F6A \\sim C17A-F5A \\sim C17A-F4A
 with sigma of 0.02
 F6A-F5A \\sim F6A-F4A \\sim F5A-F4A
 with sigma of 0.04
 F4B-F5B \\sim F4B-F6B \\sim F5B-F6B
 with sigma of 0.04
 F2-F3 \\sim F2-F1 \\sim F3-F1
 with sigma of 0.04
 C7-C6 \\sim C6-C5
 with sigma of 0.02
 C11-C10 \\sim C12-C11
 with sigma of 0.02
 C19A-Eu1 \\sim Eu1-C19B
 with sigma of 0.02
2. Restrained planarity
 S3, C21, C22, C23, C24
 with sigma of 0.1
 S1, C4, C3, C2, C1
 with sigma of 0.1
 C35, C36, C37, C38, C39, N1
 with sigma of 0.1
 S2, C16, C15, C14, C13
 with sigma of 0.1
3. Uiso/Uaniso restraints and constraints
C22 \\sim C21 \\sim C23 \\sim C24: within 2A with sigma of 0.04 and sigma for
terminal atoms of 0.08 within 2A
S1 \\sim C4 \\sim C3 \\sim C2 \\sim C1: within 2A with sigma of 0.04 and sigma
for terminal atoms of 0.08 within 2A
C16 \\sim C15 \\sim C14 \\sim C13: within 2A with sigma of 0.04 and sigma for
terminal atoms of 0.08 within 2A
C11 \\sim C35 \\sim C36 \\sim C37 \\sim C38 \\sim C39 \\sim N1: within 2A with
sigma of 0.04 and sigma for terminal atoms of 0.08 within 2A
Uanis(C19A) = Uanis(C19B)
4. Rigid body (RIGU) restrains
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.002 and sigma for 1-3 distances of 0.002
 C35, N1, C39, C38, C37, C36
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
 F4B, F5B, F6B, C17B, C17A, F6A, F5A, F4A
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
 C20, C19B, C18
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
5. Others
 Sof(F4B)=Sof(F5B)=Sof(F6B)=Sof(C17B)=1-FVAR(1)
 Sof(C17A)=Sof(F6A)=Sof(F5A)=Sof(F4A)=FVAR(1)
 Sof(C19B)=Sof(H19B)=1-FVAR(2)
 Sof(C19A)=Sof(H19A)=FVAR(2)
6.a Aromatic/amide H refined with riding coordinates:
 C27(H27), C30(H30), C28(H28), C25(H25), C6(H6), C26(H26), C31(H31), C33(H33),
 C19B(H19B), C32(H32), C16(H16), C15(H15), C14(H14), C22(H22), C23(H23),
 C24(H24), C3(H3), C2(H2), C1(H1), C39(H39), C38(H38), C37(H37), C36(H36),
 C19A(H19A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Pt1 Pt 0.35417(9) 0.51522(9) 0.14458(6) 0.1183(6) Uani 1 1 d . . . . .
Eu1 Eu 0.38579(11) 0.41583(11) 0.49656(7) 0.1042(6) Uani 1 1 d D . . . .
Cl1 Cl 0.5192(7) 0.5007(10) 0.1527(5) 0.198(6) Uani 1 1 d . . . . .
O7 O 0.4789(12) 0.4930(11) 0.4395(7) 0.110(4) Uani 1 1 d . . . . .
O4 O 0.2766(15) 0.5145(13) 0.4325(9) 0.124(5) Uani 1 1 d . . . . .
O6 O 0.3477(14) 0.3511(12) 0.3937(9) 0.125(5) Uani 1 1 d . . . . .
F7 F 0.2812(13) 0.3477(12) 0.2610(8) 0.143(5) Uani 1 1 d . . . . .
N2 N 0.3966(15) 0.5024(13) 0.2439(10) 0.102(5) Uani 1 1 d . . . . .
F8 F 0.3701(17) 0.2519(15) 0.3001(11) 0.175(6) Uani 1 1 d . . . . .
O5 O 0.2526(16) 0.3344(14) 0.4848(10) 0.140(5) Uani 1 1 d . . . . .
N3 N 0.4559(14) 0.4985(13) 0.3735(9) 0.099(5) Uani 1 1 d . . . . .
O3 O 0.3159(15) 0.4937(13) 0.5635(9) 0.127(5) Uani 1 1 d . . . . .
O1 O 0.5178(16) 0.3267(14) 0.5023(10) 0.146(6) Uani 1 1 d . . . . .
C27 C 0.3897(17) 0.5543(16) 0.3420(11) 0.098(6) Uani 1 1 d . . . . .
H27 H 0.363178 0.590935 0.364852 0.117 Uiso 1 1 calc R U . . .
C5 C 0.563(2) 0.2650(17) 0.5450(16) 0.118(6) Uani 1 1 d D . . . .
C29 C 0.2189(17) 0.5267(13) 0.1358(11) 0.089(5) Uani 1 1 d . . . . .
C34 C 0.1596(19) 0.5601(15) 0.0723(13) 0.103(5) Uani 1 1 d . . . . .
F9 F 0.2269(17) 0.2271(13) 0.2648(9) 0.168(7) Uani 1 1 d . . . . .
C30 C 0.1646(19) 0.5152(18) 0.1703(13) 0.108(6) Uani 1 1 d . . . . .
H30 H 0.194806 0.492893 0.211264 0.130 Uiso 1 1 calc R U . . .
C28 C 0.3623(18) 0.5564(16) 0.2764(11) 0.101(7) Uani 1 1 d . . . . .
H28 H 0.318626 0.596430 0.254073 0.121 Uiso 1 1 calc R U . . .
O2 O 0.4293(15) 0.3400(14) 0.5963(9) 0.133(5) Uani 1 1 d . . . . .
C25 C 0.4862(19) 0.4438(17) 0.3407(12) 0.104(7) Uani 1 1 d . . . . .
H25 H 0.528389 0.403270 0.363926 0.125 Uiso 1 1 calc R U . . .
C8 C 0.457(2) 0.2501(19) 0.680(2) 0.203(10) Uani 1 1 d D . . . .
C11 C 0.204(2) 0.276(2) 0.3820(12) 0.125(7) Uani 1 1 d D . . . .
C12 C 0.187(2) 0.2913(17) 0.4423(13) 0.112(6) Uani 1 1 d D . . . .
C9 C 0.288(3) 0.2789(19) 0.3001(16) 0.125(5) Uani 1 1 d . . . . .
C6 C 0.540(2) 0.239(2) 0.5981(15) 0.136(7) Uani 1 1 d D . . . .
H6 H 0.569842 0.191738 0.619398 0.164 Uiso 1 1 calc R U . . .
C26 C 0.4605(19) 0.4409(16) 0.2737(12) 0.105(7) Uani 1 1 d . . . . .
H26 H 0.483997 0.401438 0.251094 0.126 Uiso 1 1 calc R U . . .
C31 C 0.071(2) 0.530(2) 0.1572(17) 0.137(9) Uani 1 1 d . . . . .
H31 H 0.041313 0.516265 0.188286 0.164 Uiso 1 1 calc R U . . .
F4B F 0.159(4) 0.620(4) 0.339(2) 0.186(13) Uani 0.63(6) 1 d D . P A 2
C10 C 0.281(2) 0.3045(17) 0.3606(13) 0.110(5) Uani 1 1 d D . . . .
C33 C 0.071(2) 0.581(3) 0.0548(17) 0.153(12) Uani 1 1 d . . . . .
H33 H 0.042481 0.606000 0.014711 0.184 Uiso 1 1 calc R U . . .
F2 F 0.477(2) 0.2986(19) 0.7300(13) 0.224(9) Uani 1 1 d D . . . .
C18 C 0.204(2) 0.545(3) 0.4386(14) 0.145(8) Uani 1 1 d D . . . .
F3 F 0.369(2) 0.241(2) 0.6772(11) 0.229(10) Uani 1 1 d D . . . .
F5B F 0.105(3) 0.498(4) 0.331(2) 0.210(15) Uani 0.63(6) 1 d D . P A 2
F6B F 0.048(3) 0.587(4) 0.379(2) 0.206(15) Uani 0.63(6) 1 d D . P A 2
C19B C 0.171(3) 0.535(3) 0.4923(14) 0.156(10) Uani 0.88(8) 1 d D . P A 2
H19B H 0.105040 0.537861 0.485684 0.188 Uiso 0.88(8) 1 calc R U P A 2
C20 C 0.232(3) 0.522(2) 0.5556(14) 0.144(9) Uani 1 1 d D . . . .
C7 C 0.477(2) 0.279(2) 0.6219(15) 0.126(6) Uani 1 1 d D . . . .
F1 F 0.492(2) 0.1802(18) 0.7077(15) 0.253(11) Uani 1 1 d D . . . .
C32 C 0.016(2) 0.564(2) 0.1003(17) 0.147(10) Uani 1 1 d . . . . .
H32 H -0.048610 0.575732 0.090807 0.177 Uiso 1 1 calc R U . . .
C17B C 0.127(3) 0.562(4) 0.369(2) 0.179(13) Uani 0.63(6) 1 d D . P A 2
S2 S 0.0962(9) 0.2900(12) 0.5280(6) 0.220(7) Uani 1 1 d D . . . .
C16 C -0.0084(19) 0.232(2) 0.5106(15) 0.214(15) Uani 1 1 d D U . . .
H16 H -0.046330 0.228287 0.537775 0.257 Uiso 1 1 calc R U . . .
C15 C -0.028(2) 0.192(2) 0.4523(15) 0.204(13) Uani 1 1 d D U . . .
H15 H -0.081873 0.158334 0.434986 0.244 Uiso 1 1 calc R U . . .
C14 C 0.042(2) 0.208(2) 0.4210(14) 0.180(11) Uani 1 1 d D U . . .
H14 H 0.039566 0.185304 0.381145 0.216 Uiso 1 1 calc R U . . .
C13 C 0.112(2) 0.260(2) 0.4556(12) 0.169(11) Uani 1 1 d D U . . .
S3 S 0.2785(12) 0.5061(13) 0.6833(7) 0.251(8) Uani 1 1 d D . . . .
C21 C 0.203(2) 0.544(2) 0.6116(12) 0.176(12) Uani 1 1 d D U . . .
C22 C 0.120(2) 0.578(2) 0.6169(15) 0.198(13) Uani 1 1 d D U . . .
H22 H 0.070463 0.601016 0.582878 0.238 Uiso 1 1 calc R U . . .
C23 C 0.121(3) 0.573(3) 0.6825(17) 0.236(14) Uani 1 1 d D U . . .
H23 H 0.072024 0.594358 0.696873 0.283 Uiso 1 1 calc R U . . .
C24 C 0.199(3) 0.534(3) 0.7223(16) 0.238(17) Uani 1 1 d D U . . .
H24 H 0.207973 0.523614 0.766068 0.285 Uiso 1 1 calc R U . . .
S1 S 0.6487(8) 0.2611(8) 0.4547(6) 0.179(4) Uani 1 1 d D U . . .
C4 C 0.637(2) 0.2318(18) 0.5272(12) 0.168(9) Uani 1 1 d D U . . .
C3 C 0.706(2) 0.1759(19) 0.5573(14) 0.181(10) Uani 1 1 d D U . . .
H3 H 0.711239 0.152225 0.597542 0.218 Uiso 1 1 calc R U . . .
C2 C 0.767(2) 0.158(2) 0.5206(18) 0.192(11) Uani 1 1 d D U . . .
H2 H 0.817437 0.120360 0.534078 0.230 Uiso 1 1 calc R U . . .
C1 C 0.746(2) 0.200(2) 0.4636(18) 0.205(11) Uani 1 1 d D U . . .
H1 H 0.780273 0.196534 0.434049 0.247 Uiso 1 1 calc R U . . .
C17A C 0.152(4) 0.599(4) 0.376(3) 0.153(14) Uani 0.37(6) 1 d D . P A 1
F6A F 0.073(4) 0.646(5) 0.372(3) 0.159(15) Uani 0.37(6) 1 d D . P A 1
F5A F 0.118(4) 0.549(5) 0.323(3) 0.161(17) Uani 0.37(6) 1 d D . P A 1
F4A F 0.206(5) 0.653(4) 0.354(4) 0.163(15) Uani 0.37(6) 1 d D . P A 1
C35 C 0.218(3) 0.561(2) 0.0241(17) 0.166(10) Uani 1 1 d . U . . .
N1 N 0.303(2) 0.544(2) 0.0464(13) 0.160(9) Uani 1 1 d . U . . .
C39 C 0.364(3) 0.537(3) 0.0118(17) 0.175(10) Uani 1 1 d . U . . .
H39 H 0.426202 0.517373 0.031087 0.211 Uiso 1 1 calc R U . . .
C38 C 0.333(3) 0.561(3) -0.0543(18) 0.193(11) Uani 1 1 d . U . . .
H38 H 0.374001 0.560216 -0.079494 0.232 Uiso 1 1 calc R U . . .
C37 C 0.244(3) 0.583(3) -0.0778(19) 0.189(11) Uani 1 1 d . U . . .
H37 H 0.220519 0.599318 -0.121165 0.227 Uiso 1 1 calc R U . . .
C36 C 0.187(3) 0.584(2) -0.0423(17) 0.178(11) Uani 1 1 d . U . . .
H36 H 0.123975 0.600716 -0.061273 0.214 Uiso 1 1 calc R U . . .
C19A C 0.207(6) 0.573(4) 0.5005(18) 0.156(10) Uani 0.12(8) 1 d D . P A 1
H19A H 0.190864 0.628071 0.505133 0.188 Uiso 0.12(8) 1 calc R U P A 1


_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
Pt1 Cl1 2.380(9) . ?
Pt1 N2 2.06(2) . ?
Pt1 C29 1.94(2) . ?
Pt1 N1 2.07(3) . ?
Eu1 Eu1 4.270(4) 3_666 ?
Eu1 O7 2.507(16) 3_666 ?
Eu1 O7 2.45(2) . ?
Eu1 O4 2.369(17) . ?
Eu1 O6 2.362(18) . ?
Eu1 O5 2.30(2) . ?
Eu1 O3 2.38(2) . ?
Eu1 O1 2.38(2) . ?
Eu1 O2 2.39(2) . ?
O7 N3 1.37(2) . ?
O4 C18 1.22(3) . ?
O6 C10 1.26(3) . ?
F7 C9 1.38(4) . ?
N2 C28 1.31(3) . ?
N2 C26 1.38(3) . ?
F8 C9 1.27(4) . ?
O5 C12 1.30(3) . ?
N3 C27 1.34(3) . ?
N3 C25 1.29(3) . ?
O3 C20 1.27(4) . ?
O1 C5 1.38(3) . ?
C27 H27 0.9300 . ?
C27 C28 1.35(3) . ?
C5 C6 1.36(3) . ?
C5 C4 1.37(4) . ?
C29 C34 1.48(3) . ?
C29 C30 1.26(4) . ?
C34 C33 1.27(4) . ?
C34 C35 1.55(5) . ?
F9 C9 1.29(3) . ?
C30 H30 0.9300 . ?
C30 C31 1.34(4) . ?
C28 H28 0.9300 . ?
O2 C7 1.23(3) . ?
C25 H25 0.9300 . ?
C25 C26 1.38(3) . ?
C8 F2 1.29(3) . ?
C8 F3 1.29(3) . ?
C8 C7 1.45(6) . ?
C8 F1 1.30(3) . ?
C11 C12 1.42(3) . ?
C11 C10 1.42(3) . ?
C12 C13 1.32(4) . ?
C9 C10 1.41(4) . ?
C6 H6 0.9300 . ?
C6 C7 1.35(3) . ?
C26 H26 0.9300 . ?
C31 H31 0.9300 . ?
C31 C32 1.36(4) . ?
F4B C17B 1.31(3) . ?
C33 H33 0.9300 . ?
C33 C32 1.48(5) . ?
C18 C19B 1.40(2) . ?
C18 C17B 1.59(5) . ?
C18 C17A 1.59(5) . ?
C18 C19A 1.40(2) . ?
F5B C17B 1.30(3) . ?
F6B C17B 1.30(3) . ?
C19B H19B 0.9300 . ?
C19B C20 1.402(19) . ?
C20 C21 1.45(4) . ?
C20 C19A 1.40(2) . ?
C32 H32 0.9300 . ?
S2 C16 1.733(19) . ?
S2 C13 1.722(19) . ?
C16 H16 0.9300 . ?
C16 C15 1.363(19) . ?
C15 H15 0.9300 . ?
C15 C14 1.418(18) . ?
C14 H14 0.9300 . ?
C14 C13 1.360(18) . ?
S3 C21 1.712(18) . ?
S3 C24 1.701(19) . ?
C21 C22 1.381(18) . ?
C22 H22 0.9300 . ?
C22 C23 1.420(19) . ?
C23 H23 0.9300 . ?
C23 C24 1.352(19) . ?
C24 H24 0.9300 . ?
S1 C4 1.698(19) . ?
S1 C1 1.690(19) . ?
C4 C3 1.353(18) . ?
C3 H3 0.9300 . ?
C3 C2 1.405(18) . ?
C2 H2 0.9300 . ?
C2 C1 1.358(19) . ?
C1 H1 0.9300 . ?
C17A F6A 1.36(4) . ?
C17A F5A 1.36(4) . ?
C17A F4A 1.36(4) . ?
C35 N1 1.21(4) . ?
C35 C36 1.42(5) . ?
N1 C39 1.34(4) . ?
C39 H39 0.9300 . ?
C39 C38 1.41(5) . ?
C38 H38 0.9300 . ?
C38 C37 1.29(5) . ?
C37 H37 0.9300 . ?
C37 C36 1.30(5) . ?
C36 H36 0.9300 . ?
C19A H19A 0.9300 . ?

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
N2 Pt1 Cl1 86.8(7) . . ?
N2 Pt1 N1 171.8(11) . . ?
C29 Pt1 Cl1 178.6(7) . . ?
C29 Pt1 N2 94.5(9) . . ?
C29 Pt1 N1 81.1(11) . . ?
N1 Pt1 Cl1 97.6(9) . . ?
O7 Eu1 Eu1 30.9(3) . 3_666 ?
O7 Eu1 Eu1 30.0(4) 3_666 3_666 ?
O7 Eu1 O7 60.9(6) . 3_666 ?
O4 Eu1 Eu1 88.6(6) . 3_666 ?
O4 Eu1 O7 101.9(7) . 3_666 ?
O4 Eu1 O7 75.3(7) . . ?
O4 Eu1 O3 70.4(7) . . ?
O4 Eu1 O1 145.4(7) . . ?
O4 Eu1 O2 144.3(8) . . ?
O6 Eu1 Eu1 105.3(5) . 3_666 ?
O6 Eu1 O7 133.8(7) . 3_666 ?
O6 Eu1 O7 75.6(6) . . ?
O6 Eu1 O4 79.9(7) . . ?
O6 Eu1 O3 142.0(7) . . ?
O6 Eu1 O1 74.5(7) . . ?
O6 Eu1 O2 123.1(7) . . ?
O5 Eu1 Eu1 174.0(5) . 3_666 ?
O5 Eu1 O7 145.3(6) . . ?
O5 Eu1 O7 153.2(7) . 3_666 ?
O5 Eu1 O4 85.5(8) . . ?
O5 Eu1 O6 72.7(7) . . ?
O5 Eu1 O3 81.6(8) . . ?
O5 Eu1 O1 108.2(9) . . ?
O5 Eu1 O2 77.7(7) . . ?
O3 Eu1 Eu1 97.3(5) . 3_666 ?
O3 Eu1 O7 76.8(7) . 3_666 ?
O3 Eu1 O7 117.1(7) . . ?
O3 Eu1 O1 141.6(7) . . ?
O3 Eu1 O2 76.2(7) . . ?
O1 Eu1 Eu1 76.3(6) . 3_666 ?
O1 Eu1 O7 80.4(7) . 3_666 ?
O1 Eu1 O7 76.1(7) . . ?
O1 Eu1 O2 70.2(8) . . ?
O2 Eu1 Eu1 107.9(5) . 3_666 ?
O2 Eu1 O7 81.7(6) . 3_666 ?
O2 Eu1 O7 133.1(6) . . ?
Eu1 O7 Eu1 119.1(6) . 3_666 ?
N3 O7 Eu1 115.7(15) . 3_666 ?
N3 O7 Eu1 124.6(14) . . ?
C18 O4 Eu1 131(2) . . ?
C10 O6 Eu1 135(2) . . ?
C28 N2 Pt1 117.0(15) . . ?
C28 N2 C26 123(2) . . ?
C26 N2 Pt1 120.1(17) . . ?
C12 O5 Eu1 143(2) . . ?
C27 N3 O7 119(2) . . ?
C25 N3 O7 121.1(19) . . ?
C25 N3 C27 119(2) . . ?
C20 O3 Eu1 133.5(18) . . ?
C5 O1 Eu1 133(2) . . ?
N3 C27 H27 120.6 . . ?
N3 C27 C28 119(2) . . ?
C28 C27 H27 120.6 . . ?
C6 C5 O1 126(3) . . ?
C6 C5 C4 123(3) . . ?
C4 C5 O1 111(3) . . ?
C34 C29 Pt1 114(2) . . ?
C30 C29 Pt1 138(2) . . ?
C30 C29 C34 108(2) . . ?
C29 C34 C35 110(2) . . ?
C33 C34 C29 128(3) . . ?
C33 C34 C35 121(3) . . ?
C29 C30 H30 114.9 . . ?
C29 C30 C31 130(3) . . ?
C31 C30 H30 114.9 . . ?
N2 C28 C27 121(2) . . ?
N2 C28 H28 119.7 . . ?
C27 C28 H28 119.7 . . ?
C7 O2 Eu1 140(2) . . ?
N3 C25 H25 117.5 . . ?
N3 C25 C26 125(2) . . ?
C26 C25 H25 117.5 . . ?
F2 C8 C7 119(3) . . ?
F2 C8 F1 100(4) . . ?
F3 C8 F2 94(3) . . ?
F3 C8 C7 118(3) . . ?
F3 C8 F1 100(4) . . ?
F1 C8 C7 122(4) . . ?
C10 C11 C12 129(3) . . ?
O5 C12 C11 116(3) . . ?
O5 C12 C13 122(3) . . ?
C13 C12 C11 122(3) . . ?
F7 C9 C10 109(2) . . ?
F8 C9 F7 99(3) . . ?
F8 C9 F9 105(3) . . ?
F8 C9 C10 117(3) . . ?
F9 C9 F7 104(3) . . ?
F9 C9 C10 120(3) . . ?
C5 C6 H6 117.9 . . ?
C7 C6 C5 124(3) . . ?
C7 C6 H6 117.9 . . ?
N2 C26 C25 113(2) . . ?
N2 C26 H26 123.5 . . ?
C25 C26 H26 123.5 . . ?
C30 C31 H31 118.8 . . ?
C30 C31 C32 122(4) . . ?
C32 C31 H31 118.8 . . ?
O6 C10 C11 124(3) . . ?
O6 C10 C9 115(3) . . ?
C9 C10 C11 121(3) . . ?
C34 C33 H33 121.1 . . ?
C34 C33 C32 118(3) . . ?
C32 C33 H33 121.1 . . ?
O4 C18 C19B 126(3) . . ?
O4 C18 C17B 111(3) . . ?
O4 C18 C17A 109(3) . . ?
O4 C18 C19A 118(3) . . ?
C19B C18 C17B 118(3) . . ?
C19A C18 C17A 120(3) . . ?
C18 C19B H19B 118.4 . . ?
C18 C19B C20 123(3) . . ?
C20 C19B H19B 118.4 . . ?
O3 C20 C19B 119(3) . . ?
O3 C20 C21 120(2) . . ?
O3 C20 C19A 108(4) . . ?
C19B C20 C21 121(3) . . ?
C19A C20 C21 120(3) . . ?
O2 C7 C8 114(3) . . ?
O2 C7 C6 124(3) . . ?
C6 C7 C8 122(3) . . ?
C31 C32 C33 113(3) . . ?
C31 C32 H32 123.4 . . ?
C33 C32 H32 123.4 . . ?
F4B C17B C18 109(3) . . ?
F5B C17B F4B 107(3) . . ?
F5B C17B C18 116(4) . . ?
F6B C17B F4B 109(3) . . ?
F6B C17B C18 108(3) . . ?
F6B C17B F5B 107(3) . . ?
C13 S2 C16 90.8(14) . . ?
S2 C16 H16 124.0 . . ?
C15 C16 S2 112.0(18) . . ?
C15 C16 H16 124.0 . . ?
C16 C15 H15 123.9 . . ?
C16 C15 C14 112.2(19) . . ?
C14 C15 H15 123.9 . . ?
C15 C14 H14 123.6 . . ?
C13 C14 C15 112.8(19) . . ?
C13 C14 H14 123.6 . . ?
C12 C13 S2 117(2) . . ?
C12 C13 C14 131(2) . . ?
C14 C13 S2 112.1(18) . . ?
C24 S3 C21 90.6(15) . . ?
C20 C21 S3 114(2) . . ?
C22 C21 C20 132(2) . . ?
C22 C21 S3 113.7(18) . . ?
C21 C22 H22 125.5 . . ?
C21 C22 C23 109.1(19) . . ?
C23 C22 H22 125.5 . . ?
C22 C23 H23 122.9 . . ?
C24 C23 C22 114(2) . . ?
C24 C23 H23 122.9 . . ?
S3 C24 H24 123.8 . . ?
C23 C24 S3 112(2) . . ?
C23 C24 H24 123.8 . . ?
C1 S1 C4 93.4(14) . . ?
C5 C4 S1 118(2) . . ?
C3 C4 C5 131(2) . . ?
C3 C4 S1 111.0(18) . . ?
C4 C3 H3 124.1 . . ?
C4 C3 C2 111.8(19) . . ?
C2 C3 H3 124.1 . . ?
C3 C2 H2 122.9 . . ?
C1 C2 C3 114(2) . . ?
C1 C2 H2 122.9 . . ?
S1 C1 H1 125.2 . . ?
C2 C1 S1 109.6(19) . . ?
C2 C1 H1 125.2 . . ?
F6A C17A C18 122(5) . . ?
F6A C17A F5A 101(3) . . ?
F5A C17A C18 110(4) . . ?
F4A C17A C18 118(5) . . ?
F4A C17A F6A 102(3) . . ?
F4A C17A F5A 100(3) . . ?
N1 C35 C34 116(3) . . ?
N1 C35 C36 115(4) . . ?
C36 C35 C34 128(3) . . ?
C35 N1 Pt1 117(3) . . ?
C35 N1 C39 125(3) . . ?
C39 N1 Pt1 117(2) . . ?
N1 C39 H39 120.6 . . ?
N1 C39 C38 119(3) . . ?
C38 C39 H39 120.6 . . ?
C39 C38 H38 121.9 . . ?
C37 C38 C39 116(4) . . ?
C37 C38 H38 121.9 . . ?
C38 C37 H37 119.2 . . ?
C38 C37 C36 122(4) . . ?
C36 C37 H37 119.2 . . ?
C35 C36 H36 118.7 . . ?
C37 C36 C35 123(4) . . ?
C37 C36 H36 118.7 . . ?
C18 C19A H19A 118.5 . . ?
C20 C19A C18 123(4) . . ?
C20 C19A H19A 118.5 . . ?

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
Pt1 N2 C28 C27 -177(2) . . . . ?
Pt1 N2 C26 C25 176(2) . . . . ?
Pt1 C29 C34 C33 -173(3) . . . . ?
Pt1 C29 C34 C35 11(3) . . . . ?
Pt1 C29 C30 C31 177(2) . . . . ?
Pt1 N1 C39 C38 -177(3) . . . . ?
Eu1 O7 N3 C27 -90(2) 3_666 . . . ?
Eu1 O7 N3 C27 82(2) . . . . ?
Eu1 O7 N3 C25 100(2) 3_666 . . . ?
Eu1 O7 N3 C25 -88(3) . . . . ?
Eu1 O4 C18 C19B 8(6) . . . . ?
Eu1 O4 C18 C17B -146(3) . . . . ?
Eu1 O4 C18 C17A -173(3) . . . . ?
Eu1 O4 C18 C19A 46(6) . . . . ?
Eu1 O6 C10 C11 -1(4) . . . . ?
Eu1 O6 C10 C9 -179(2) . . . . ?
Eu1 O5 C12 C11 12(5) . . . . ?
Eu1 O5 C12 C13 -171(3) . . . . ?
Eu1 O3 C20 C19B -23(6) . . . . ?
Eu1 O3 C20 C21 160(2) . . . . ?
Eu1 O3 C20 C19A -57(5) . . . . ?
Eu1 O1 C5 C6 0(4) . . . . ?
Eu1 O1 C5 C4 -180(2) . . . . ?
Eu1 O2 C7 C8 -165(2) . . . . ?
Eu1 O2 C7 C6 13(5) . . . . ?
O7 N3 C27 C28 -176(2) . . . . ?
O7 N3 C25 C26 175(3) . . . . ?
O4 C18 C19B C20 29(7) . . . . ?
O4 C18 C17B F4B -66(4) . . . . ?
O4 C18 C17B F5B 54(4) . . . . ?
O4 C18 C17B F6B 175(3) . . . . ?
O4 C18 C17A F6A -174(4) . . . . ?
O4 C18 C17A F5A 68(4) . . . . ?
O4 C18 C17A F4A -47(5) . . . . ?
O4 C18 C19A C20 -57(9) . . . . ?
F7 C9 C10 O6 -65(4) . . . . ?
F7 C9 C10 C11 118(3) . . . . ?
F8 C9 C10 O6 47(4) . . . . ?
F8 C9 C10 C11 -131(3) . . . . ?
O5 C12 C13 S2 8(5) . . . . ?
O5 C12 C13 C14 -173(3) . . . . ?
N3 C27 C28 N2 3(4) . . . . ?
N3 C25 C26 N2 -1(4) . . . . ?
O3 C20 C21 S3 -15(5) . . . . ?
O3 C20 C21 C22 177(3) . . . . ?
O3 C20 C19A C18 58(8) . . . . ?
O1 C5 C6 C7 -10(5) . . . . ?
O1 C5 C4 S1 -8(4) . . . . ?
O1 C5 C4 C3 173(2) . . . . ?
C27 N3 C25 C26 5(4) . . . . ?
C5 C6 C7 O2 4(5) . . . . ?
C5 C6 C7 C8 -178(3) . . . . ?
C5 C4 C3 C2 179(4) . . . . ?
C29 C34 C33 C32 -6(5) . . . . ?
C29 C34 C35 N1 -7(4) . . . . ?
C29 C34 C35 C36 176(3) . . . . ?
C29 C30 C31 C32 -2(6) . . . . ?
C34 C29 C30 C31 -1(4) . . . . ?
C34 C33 C32 C31 2(5) . . . . ?
C34 C35 N1 Pt1 0(4) . . . . ?
C34 C35 N1 C39 176(4) . . . . ?
C34 C35 C36 C37 179(4) . . . . ?
F9 C9 C10 O6 176(3) . . . . ?
F9 C9 C10 C11 -2(5) . . . . ?
C30 C29 C34 C33 5(4) . . . . ?
C30 C29 C34 C35 -170(2) . . . . ?
C30 C31 C32 C33 1(5) . . . . ?
C28 N2 C26 C25 -2(4) . . . . ?
C25 N3 C27 C28 -6(4) . . . . ?
C11 C12 C13 S2 -176(2) . . . . ?
C11 C12 C13 C14 4(6) . . . . ?
C12 C11 C10 O6 -1(5) . . . . ?
C12 C11 C10 C9 176(3) . . . . ?
C6 C5 C4 S1 172(3) . . . . ?
C6 C5 C4 C3 -6(5) . . . . ?
C26 N2 C28 C27 1(4) . . . . ?
C10 C11 C12 O5 -3(5) . . . . ?
C10 C11 C12 C13 -180(3) . . . . ?
C33 C34 C35 N1 177(4) . . . . ?
C33 C34 C35 C36 0(5) . . . . ?
F2 C8 C7 O2 -64(3) . . . . ?
F2 C8 C7 C6 118(3) . . . . ?
C18 C19B C20 O3 -21(7) . . . . ?
C18 C19B C20 C21 155(4) . . . . ?
F3 C8 C7 O2 48(4) . . . . ?
F3 C8 C7 C6 -130(3) . . . . ?
C19B C18 C17B F4B 137(4) . . . . ?
C19B C18 C17B F5B -102(4) . . . . ?
C19B C18 C17B F6B 18(5) . . . . ?
C19B C20 C21 S3 169(4) . . . . ?
C19B C20 C21 C22 1(6) . . . . ?
C20 C21 C22 C23 169(5) . . . . ?
F1 C8 C7 O2 171(3) . . . . ?
F1 C8 C7 C6 -7(4) . . . . ?
C17B C18 C19B C20 -179(4) . . . . ?
S2 C16 C15 C14 0.3(18) . . . . ?
C16 S2 C13 C12 179(4) . . . . ?
C16 S2 C13 C14 -1(3) . . . . ?
C16 C15 C14 C13 -1(3) . . . . ?
C15 C14 C13 C12 -178(4) . . . . ?
C15 C14 C13 S2 1(4) . . . . ?
C13 S2 C16 C15 0.3(14) . . . . ?
S3 C21 C22 C23 0.8(19) . . . . ?
C21 C20 C19A C18 -159(6) . . . . ?
C21 S3 C24 C23 -2(3) . . . . ?
C21 C22 C23 C24 -3(4) . . . . ?
C22 C23 C24 S3 3(4) . . . . ?
C24 S3 C21 C20 -170(4) . . . . ?
C24 S3 C21 C22 0.7(15) . . . . ?
S1 C4 C3 C2 0.2(19) . . . . ?
C4 C5 C6 C7 170(3) . . . . ?
C4 S1 C1 C2 1(3) . . . . ?
C4 C3 C2 C1 1(4) . . . . ?
C3 C2 C1 S1 -1(4) . . . . ?
C1 S1 C4 C5 -180(3) . . . . ?
C1 S1 C4 C3 -0.7(14) . . . . ?
C17A C18 C19A C20 166(6) . . . . ?
C35 C34 C33 C32 170(3) . . . . ?
C35 N1 C39 C38 8(6) . . . . ?
N1 C35 C36 C37 3(3) . . . . ?
N1 C39 C38 C37 -4(6) . . . . ?
C39 C38 C37 C36 0(5) . . . . ?
C38 C37 C36 C35 0(3) . . . . ?
C36 C35 N1 Pt1 177(2) . . . . ?
C36 C35 N1 C39 -7(5) . . . . ?
C19A C18 C17A F6A -34(7) . . . . ?
C19A C18 C17A F5A -152(6) . . . . ?
C19A C18 C17A F4A 93(6) . . . . ?
C19A C20 C21 S3 -153(5) . . . . ?
C19A C20 C21 C22 39(6) . . . . ?

_smtbx_masks_special_details     
;
A solvent mask was calculated and 156 electrons were 
found in a volume of 700Å³ in 4 voids per unit cell. 
This is consistent with the presence of 
4[CH2Cl2] per Unit Cell 
which account for 168 electrons 
per unit cell.
;
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.147 0.284 0.756 175.2 39.4 '1 CH2Cl2'
2 -0.147 0.716 0.244 175.2 41.6 '1 CH2Cl2'
3 0.353 0.784 0.744 175.2 37.6 '1 CH2Cl2'
4 0.647 0.216 0.256 175.2 43.4 '1 CH2Cl2'

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.125
_oxdiff_exptl_absorpt_empirical_full_min 0.880
####################################################################### 
# 
# 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_exp_427_auto
_database_code_depnum_ccdc_archive 'CCDC 2395043'
loop_
_audit_author_name
_audit_author_address
'Marzio Rancan'
;ICMATE CNR
Italy
;
_audit_update_record             
;
2025-04-02 deposited with the CCDC.	2025-05-30 downloaded from the CCDC.
;
_audit_creation_date             2025-04-01
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.03.04 svn.red2d20d0 for OlexSys, GUI svn.r7188)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C46 H31 Cl2 F9 Gd N2 O7 P Pt S3'
_chemical_formula_sum            'C46 H31 Cl2 F9 Gd N2 O7 P Pt S3'
_chemical_formula_weight         1445.12
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Pt2 Gd2 Cl4 S6 F18 N4 O14 P2 C40'
_chemical_oxdiff_usercomment     MT19
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Gd Gd -0.1653 3.9035 '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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   34.8427(11)
_cell_length_b                   16.2795(6)
_cell_length_c                   19.8361(8)
_cell_angle_alpha                90
_cell_angle_beta                 97.689(3)
_cell_angle_gamma                90
_cell_volume                     11150.3(7)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    21488
_cell_measurement_temperature    298.3(9)
_cell_measurement_theta_max      27.6190
_cell_measurement_theta_min      3.8300
_shelx_estimated_absorpt_T_max   0.691
_shelx_estimated_absorpt_T_min   0.473
_exptl_absorpt_coefficient_mu    3.999
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.52353
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.41.103a (Rigaku Oxford Diffraction, 2021)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.722
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             5576
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0678
_diffrn_reflns_av_unetI/netI     0.0484
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.877
_diffrn_reflns_limit_h_max       47
_diffrn_reflns_limit_h_min       -45
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            61464
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.877
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.420
_diffrn_reflns_theta_min         3.440
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      298.3(9)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.1274
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.877
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -58.00   4.00   0.25   10.00    --  -18.52  94.00 166.00  248
  2  ω    -26.00  21.00   0.25   10.00    --  -18.52 -94.00  55.00  188
  3  ω    -26.00  58.00   0.25   10.00    --   18.68 -94.00  55.00  336
  4  ω    -39.00  12.00   0.25   10.00    --  -18.52 -77.00-120.00  204
  5  ω     39.00  95.00   0.25   10.00    --   18.68 178.00 -60.00  224
  6  ω     -3.00  87.00   0.25   10.00    --   18.68  57.00  30.00  360
  7  ω     39.00  95.00   0.25   10.00    --   18.68 178.00   0.00  224
  8  ω     -3.00  26.00   0.25   10.00    --   18.68  57.00 120.00  116
  9  ω     -3.00  87.00   0.25   10.00    --   18.68  57.00-150.00  360
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0183768000
_diffrn_orient_matrix_UB_12      0.0145783000
_diffrn_orient_matrix_UB_13      -0.0147395000
_diffrn_orient_matrix_UB_21      -0.0085677000
_diffrn_orient_matrix_UB_22      -0.0375323000
_diffrn_orient_matrix_UB_23      0.0082954000
_diffrn_orient_matrix_UB_31      -0.0032233000
_diffrn_orient_matrix_UB_32      0.0165960000
_diffrn_orient_matrix_UB_33      0.0318174000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9244
_reflns_number_total             13531
_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 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_collection       'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_data_reduction        'CrysAlisPro 1.171.41.103a (Rigaku OD, 2021)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         1.925
_refine_diff_density_min         -1.134
_refine_diff_density_rms         0.161
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     656
_refine_ls_number_reflns         13531
_refine_ls_number_restraints     946
_refine_ls_R_factor_all          0.0998
_refine_ls_R_factor_gt           0.0696
_refine_ls_restrained_S_all      1.015
_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)+(0.0917P)²+118.4294P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1831
_refine_ls_wR_factor_ref         0.2107
_refine_special_details          ?
_olex2_refinement_description    
;
1. Restrained distances
 C17-F7B \\sim C17-F8B \\sim C17-F9A \\sim C17-F8A \\sim C17-F7A \\sim C17-F9B
 with sigma of 0.02
 C9-F6B \\sim C9-F4B \\sim C9-F5A \\sim C9-F4A \\sim C9-F6A \\sim C9-F5B
 with sigma of 0.02
 C16A-C15A \\sim C15B-C16B \\sim C14A-C13A \\sim C13B-C14B
 with sigma of 0.02
 C13A-S3A \\sim S3A-C16A \\sim C13B-S3B \\sim S3B-C16B
 with sigma of 0.02
 C13A-C12 \\sim C12-C13B
 with sigma of 0.02
 C14A-C15A \\sim C14B-C15B
 with sigma of 0.02
 F6B-F4B \\sim F6B-F5B \\sim F4B-F5B \\sim F5A-F4A \\sim F5A-F6A \\sim F4A-F6A
 with sigma of 0.04
 F7B-F8B \\sim F7B-F9B \\sim F8B-F9B \\sim F9A-F8A \\sim F9A-F7A \\sim F8A-F7A
 with sigma of 0.04
 C23B-C24B \\sim C24A-C23A
 with sigma of 0.02
 C22B-C21 \\sim C21-C22A
 with sigma of 0.02
 C23B-C22B \\sim C22A-C23A
 with sigma of 0.02
2. Restrained planarity
 C14A, C15A, C16A, S3A, C13A
 with sigma of 0.1
 C30B, C31B, C32B, C33B, C34B, C29B
 with sigma of 0.1
 C29B, C32B, C33B, C34B
 with sigma of 0.1
 S3B, C14B, C13B, C16B, C15B
 with sigma of 0.1
 S2, C24A, C23A, C22A, C21
 with sigma of 0.1
 C23B, C24B, S2, C21, C22B
 with sigma of 0.1
3. Uiso/Uaniso restraints and constraints
Uanis(S3B) = Uanis(S3A) = Uanis(S1) = Uanis(S2)
Uanis(C16B) = Uanis(C16A) = Uanis(C15B) = Uanis(C15A) = Uanis(C14B) =
Uanis(C14A) = Uanis(C13B) = Uanis(C13A)
Uanis(C41B) = Uanis(C42B) = Uanis(C43B) = Uanis(C45B) = Uanis(C46B) =
Uanis(C41A) = Uanis(C42A) = Uanis(C43A) = Uanis(C44A) = Uanis(C45A) =
Uanis(C46A) = Uanis(C44B)
Uanis(C37B) = Uanis(C38B) = Uanis(C39B) = Uanis(C37A) = Uanis(C38A) =
Uanis(C39A)
Uanis(F4A) = Uanis(F4B) = Uanis(F5A) = Uanis(F5B) = Uanis(F6A) = Uanis(F6B)
Uanis(F8A) = Uanis(F8B) = Uanis(F7A) = Uanis(F7B) = Uanis(F9A) = Uanis(F9B)
4. Rigid body (RIGU) restrains
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
5. Others
 Sof(C35B)=Sof(C36B)=Sof(H36B)=Sof(C37B)=Sof(H37B)=Sof(C38B)=Sof(H38B)=
 Sof(C39B)=Sof(H39B)=Sof(C40B)=Sof(H40B)=1-FVAR(1)
 Sof(C35A)=Sof(C36A)=Sof(H36A)=Sof(C37A)=Sof(H37A)=Sof(C38A)=Sof(H38A)=
 Sof(C39A)=Sof(H39A)=Sof(C40A)=Sof(H40A)=FVAR(1)
 Sof(C29B)=Sof(C34B)=Sof(H34B)=Sof(C33B)=Sof(H33B)=Sof(C32B)=Sof(H32B)=
 Sof(C31B)=Sof(H31B)=Sof(C30B)=Sof(H30B)=1-FVAR(2)
 Sof(C29A)=Sof(C34A)=Sof(H34A)=Sof(C33A)=Sof(H33A)=Sof(C32A)=Sof(H32A)=
 Sof(C31A)=Sof(H31A)=Sof(C30A)=Sof(H30A)=FVAR(2)
 Sof(C41B)=Sof(C42B)=Sof(H42B)=Sof(C43B)=Sof(H43B)=Sof(C44B)=Sof(H44B)=
 Sof(C45B)=Sof(H45B)=Sof(C46B)=Sof(H46B)=1-FVAR(3)
 Sof(C41A)=Sof(C42A)=Sof(H42A)=Sof(C43A)=Sof(H43A)=Sof(C44A)=Sof(H44A)=
 Sof(C45A)=Sof(H45A)=Sof(C46A)=Sof(H46A)=FVAR(3)
 Sof(S3B)=Sof(C14B)=Sof(H14B)=Sof(C13B)=Sof(C16B)=Sof(H16B)=Sof(C15B)=
 Sof(H15B)=1-FVAR(4)
 Sof(C13A)=Sof(C14A)=Sof(H14A)=Sof(C15A)=Sof(H15A)=Sof(C16A)=Sof(H16A)=
 Sof(S3A)=FVAR(4)
 Sof(F5B)=Sof(F6B)=Sof(F4B)=1-FVAR(5)
 Sof(F5A)=Sof(F4A)=Sof(F6A)=FVAR(5)
 Sof(F8B)=Sof(F7B)=Sof(F9B)=1-FVAR(6)
 Sof(F9A)=Sof(F8A)=Sof(F7A)=FVAR(6)
 Sof(C22B)=Sof(H22B)=Sof(C24B)=Sof(H24B)=Sof(C23B)=Sof(H23B)=1-FVAR(7)
 Sof(C22A)=Sof(H22A)=Sof(C23A)=Sof(H23A)=Sof(C24A)=Sof(H24A)=FVAR(7)
6.a Aromatic/amide H refined with riding coordinates:
 C28(H28), C25(H25), C26(H26), C27(H27), C36B(H36B), C37B(H37B), C38B(H38B),
 C39B(H39B), C40B(H40B), C11(H11), C19(H19), C34B(H34B), C33B(H33B), C32B(H32B),
  C31B(H31B), C30B(H30B), C42B(H42B), C43B(H43B), C44B(H44B), C45B(H45B),
 C46B(H46B), C6(H6), C14B(H14B), C22B(H22B), C3(H3), C8(H8), C24B(H24B), C7(H7),
  C16B(H16B), C23B(H23B), C15B(H15B), C36A(H36A), C37A(H37A), C38A(H38A),
 C39A(H39A), C40A(H40A), C34A(H34A), C33A(H33A), C32A(H32A), C31A(H31A),
 C30A(H30A), C42A(H42A), C43A(H43A), C44A(H44A), C45A(H45A), C46A(H46A),
 C14A(H14A), C15A(H15A), C16A(H16A), C22A(H22A), C23A(H23A), C24A(H24A)
6.b Fitted hexagon refined as free rotating group:
 C35B(C36B,C37B,C38B,C39B,C40B), C29B(C34B,C33B,C32B,C31B,C30B), C41B(C42B,
 C43B,C44B,C45B,C46B), C35A(C36A,C37A,C38A,C39A,C40A), C29A(C34A,C33A,C32A,C31A,
 C30A), C41A(C42A,C43A,C44A,C45A,C46A)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Pt1 Pt 0.70129(2) 0.64282(2) 0.67611(2) 0.05612(13) Uani 1 1 d . . . . .
Gd2 Gd 0.47990(2) 0.71650(4) 0.64371(3) 0.06863(17) Uani 1 1 d . . . . .
P1 P 0.76050(7) 0.61786(17) 0.65001(13) 0.0605(6) Uani 1 1 d . . . . .
Cl2 Cl 0.68957(9) 0.7316(2) 0.58644(16) 0.0894(9) Uani 1 1 d . . . . .
Cl1 Cl 0.70774(9) 0.5535(2) 0.76513(17) 0.0989(11) Uani 1 1 d . . . . .
S2 S 0.59578(15) 0.6161(3) 0.5390(3) 0.1209(9) Uani 1 1 d . . . . .
S1 S 0.58778(15) 0.8529(3) 0.5414(3) 0.1209(9) Uani 1 1 d . . . . .
N2 N 0.6448(2) 0.6644(5) 0.6992(4) 0.0570(16) Uani 1 1 d . . . . .
O7 O 0.53492(17) 0.7076(5) 0.7370(4) 0.0744(18) Uani 1 1 d . . . . .
O5 O 0.5247(2) 0.6344(5) 0.5973(5) 0.082(2) Uani 1 1 d . . . . .
N1 N 0.5712(2) 0.6938(5) 0.7249(4) 0.0613(18) Uani 1 1 d . . . . .
O4 O 0.5243(2) 0.8118(5) 0.6124(4) 0.085(2) Uani 1 1 d . . . . .
O2 O 0.4599(3) 0.7373(6) 0.5293(4) 0.090(2) Uani 1 1 d . . . . .
O1 O 0.4110(2) 0.7152(6) 0.6274(4) 0.089(2) Uani 1 1 d . . . . .
S3B S 0.4676(4) 0.7538(8) 0.3886(6) 0.1209(9) Uani 0.452(10) 1 d D . P A 2
O3 O 0.4601(3) 0.8486(6) 0.6730(5) 0.096(2) Uani 1 1 d . . . . .
O6 O 0.4655(3) 0.5776(5) 0.6572(4) 0.088(2) Uani 1 1 d . . . . .
C28 C 0.6299(3) 0.7391(6) 0.6974(6) 0.067(2) Uani 1 1 d . . . . .
H28 H 0.644850 0.782504 0.685181 0.080 Uiso 1 1 calc R U . . .
C25 C 0.5848(3) 0.6164(7) 0.7273(5) 0.067(2) Uani 1 1 d . . . . .
H25 H 0.569448 0.572689 0.737984 0.080 Uiso 1 1 calc R U . . .
F8B F 0.4533(7) 0.4212(13) 0.7232(9) 0.140(3) Uani 0.54(3) 1 d D . P B 2
C26 C 0.6219(3) 0.6038(6) 0.7136(5) 0.067(2) Uani 1 1 d . . . . .
H26 H 0.631328 0.550382 0.714412 0.080 Uiso 1 1 calc R U . . .
F3 F 0.4042(4) 0.9723(9) 0.6534(8) 0.193(5) Uani 1 1 d . . . . .
C27 C 0.5935(3) 0.7561(6) 0.7125(6) 0.069(2) Uani 1 1 d . . . . .
H27 H 0.584713 0.809913 0.713941 0.083 Uiso 1 1 calc R U . . .
C12 C 0.4288(4) 0.7547(7) 0.4920(7) 0.082(3) Uani 1 1 d D . . . .
C20 C 0.5313(3) 0.5602(7) 0.5859(6) 0.072(2) Uani 1 1 d . . . . .
C10 C 0.3868(3) 0.7357(8) 0.5782(7) 0.081(3) Uani 1 1 d . . . . .
F2 F 0.4400(5) 0.9793(10) 0.7447(8) 0.221(7) Uani 1 1 d . . . . .
C35B C 0.7907(6) 0.7100(11) 0.6410(11) 0.081(6) Uani 0.52(2) 1 d G . P C 2
C36B C 0.8291(6) 0.6951(12) 0.6329(13) 0.107(8) Uani 0.52(2) 1 d G . P C 2
H36B H 0.837676 0.641420 0.628734 0.128 Uiso 0.52(2) 1 calc R U P C 2
C37B C 0.8547(5) 0.7603(15) 0.6310(14) 0.144(6) Uani 0.52(2) 1 d G . P C 2
H37B H 0.880387 0.750249 0.625589 0.173 Uiso 0.52(2) 1 calc R U P C 2
C38B C 0.8419(6) 0.8404(13) 0.6373(14) 0.144(6) Uani 0.52(2) 1 d G . P C 2
H38B H 0.859028 0.884049 0.636019 0.173 Uiso 0.52(2) 1 calc R U P C 2
C39B C 0.8035(6) 0.8554(11) 0.6454(15) 0.144(6) Uani 0.52(2) 1 d G . P C 2
H39B H 0.794956 0.909019 0.649593 0.173 Uiso 0.52(2) 1 calc R U P C 2
C40B C 0.7779(5) 0.7902(13) 0.6473(14) 0.107(8) Uani 0.52(2) 1 d G . P C 2
H40B H 0.752243 0.800189 0.652737 0.129 Uiso 0.52(2) 1 calc R U P C 2
F5B F 0.3350(4) 0.6649(11) 0.6177(10) 0.152(4) Uani 0.650(14) 1 d D . P D 2
C11 C 0.3912(4) 0.7561(8) 0.5160(7) 0.088(3) Uani 1 1 d . . . . .
H11 H 0.369658 0.772143 0.486168 0.106 Uiso 1 1 calc R U . . .
C4 C 0.5249(3) 0.8875(8) 0.5998(6) 0.079(3) Uani 1 1 d . . . . .
C19 C 0.5071(4) 0.4950(7) 0.6033(7) 0.085(3) Uani 1 1 d . . . . .
H19 H 0.511984 0.441540 0.590264 0.101 Uiso 1 1 calc R U . . .
F7B F 0.4166(4) 0.4636(14) 0.6395(11) 0.140(3) Uani 0.54(3) 1 d D . P B 2
C29B C 0.7899(6) 0.5486(13) 0.7139(12) 0.066(7) Uani 0.45(3) 1 d G . P C 2
C34B C 0.8169(8) 0.5832(12) 0.7636(14) 0.092(10) Uani 0.45(3) 1 d G . P C 2
H34B H 0.822012 0.639295 0.762944 0.110 Uiso 0.45(3) 1 calc R U P C 2
C33B C 0.8364(8) 0.5341(16) 0.8144(12) 0.116(14) Uani 0.45(3) 1 d G . P C 2
H33B H 0.854530 0.557252 0.847667 0.139 Uiso 0.45(3) 1 calc R U P C 2
C32B C 0.8288(7) 0.4503(15) 0.8154(12) 0.100(9) Uani 0.45(3) 1 d G . P C 2
H32B H 0.841884 0.417403 0.849335 0.120 Uiso 0.45(3) 1 calc R U P C 2
C31B C 0.8018(9) 0.4157(10) 0.7656(16) 0.116(12) Uani 0.45(3) 1 d G . P C 2
H31B H 0.796720 0.359596 0.766280 0.139 Uiso 0.45(3) 1 calc R U P C 2
C30B C 0.7823(7) 0.4648(13) 0.7148(15) 0.116(13) Uani 0.45(3) 1 d G . P C 2
H30B H 0.764203 0.441637 0.681555 0.139 Uiso 0.45(3) 1 calc R U P C 2
C41B C 0.7614(10) 0.556(2) 0.5737(14) 0.115(3) Uani 0.290(10) 1 d G . P C 2
C42B C 0.7924(9) 0.503(2) 0.5689(14) 0.115(3) Uani 0.290(10) 1 d G . P C 2
H42B H 0.811150 0.495362 0.606351 0.138 Uiso 0.290(10) 1 calc R U P C 2
C43B C 0.7956(9) 0.463(2) 0.5081(16) 0.115(3) Uani 0.290(10) 1 d G . P C 2
H43B H 0.816345 0.428123 0.504848 0.138 Uiso 0.290(10) 1 calc R U P C 2
C44B C 0.7676(10) 0.475(2) 0.4520(13) 0.115(3) Uani 0.290(10) 1 d G . P C 2
H44B H 0.769687 0.448106 0.411338 0.138 Uiso 0.290(10) 1 calc R U P C 2
C45B C 0.7365(9) 0.527(2) 0.4568(14) 0.115(3) Uani 0.290(10) 1 d G . P C 2
H45B H 0.717833 0.535329 0.419331 0.138 Uiso 0.290(10) 1 calc R U P C 2
C46B C 0.7334(9) 0.568(2) 0.5176(17) 0.115(3) Uani 0.290(10) 1 d G . P C 2
H46B H 0.712636 0.602569 0.520833 0.138 Uiso 0.290(10) 1 calc R U P C 2
C5 C 0.5557(4) 0.9183(8) 0.5647(6) 0.086(3) Uani 1 1 d . . . . .
F9B F 0.4542(8) 0.3742(10) 0.6210(13) 0.140(3) Uani 0.54(3) 1 d D . P B 2
C21 C 0.5661(4) 0.5410(8) 0.5556(6) 0.083(3) Uani 1 1 d D . . . .
C6 C 0.5649(4) 1.0037(9) 0.5478(7) 0.093(3) Uani 1 1 d . . . . .
H6 H 0.551075 1.050320 0.556864 0.112 Uiso 1 1 calc R U . . .
C18 C 0.4772(4) 0.5094(8) 0.6382(7) 0.088(3) Uani 1 1 d . . . . .
C9 C 0.3465(5) 0.7381(11) 0.5959(7) 0.145(5) Uani 1 1 d D . . . .
C2 C 0.4676(4) 0.9184(9) 0.6536(8) 0.095(3) Uani 1 1 d . . . . .
C14B C 0.3980(10) 0.772(3) 0.3565(13) 0.122(5) Uani 0.452(10) 1 d D . P A 2
H14B H 0.371643 0.779829 0.356840 0.147 Uiso 0.452(10) 1 calc R U P A 2
C17 C 0.4544(4) 0.4411(9) 0.6590(7) 0.134(4) Uani 1 1 d D . . . .
F6B F 0.3180(4) 0.7692(14) 0.5525(8) 0.152(4) Uani 0.650(14) 1 d D . P D 2
C22B C 0.5797(12) 0.4564(12) 0.530(3) 0.072(8) Uani 0.57(11) 1 d D . P E 2
H22B H 0.567726 0.405589 0.532690 0.086 Uiso 0.57(11) 1 calc R U P E 2
C1 C 0.4411(7) 0.9811(14) 0.6763(13) 0.151(5) Uani 1 1 d . . . . .
C3 C 0.4964(4) 0.9437(9) 0.6173(8) 0.100(4) Uani 1 1 d . . . . .
H3 H 0.497425 0.998371 0.604096 0.120 Uiso 1 1 calc R U . . .
C13B C 0.4259(7) 0.764(3) 0.4183(10) 0.122(5) Uani 0.452(10) 1 d D . P A 2
F4B F 0.3430(4) 0.7785(14) 0.6536(8) 0.152(4) Uani 0.650(14) 1 d D . P D 2
F1 F 0.4473(5) 1.0593(8) 0.6579(10) 0.225(7) Uani 1 1 d . . . . .
C8 C 0.6125(6) 0.9280(12) 0.5072(8) 0.121(5) Uani 1 1 d . . . . .
H8 H 0.633913 0.918539 0.484798 0.146 Uiso 1 1 calc R U . . .
C24B C 0.6257(15) 0.551(3) 0.504(3) 0.104(11) Uani 0.57(11) 1 d D . P E 2
H24B H 0.647894 0.568633 0.486367 0.125 Uiso 0.57(11) 1 calc R U P E 2
C7 C 0.5981(5) 1.0016(12) 0.5158(9) 0.128(5) Uani 1 1 d . . . . .
H7 H 0.609375 1.049154 0.501438 0.153 Uiso 1 1 calc R U . . .
C16B C 0.4569(10) 0.763(2) 0.3051(11) 0.122(5) Uani 0.452(10) 1 d D . P A 2
H16B H 0.473305 0.765068 0.271844 0.147 Uiso 0.452(10) 1 calc R U P A 2
C23B C 0.6142(15) 0.475(3) 0.503(4) 0.114(14) Uani 0.57(11) 1 d D . P E 2
H23B H 0.628428 0.433232 0.485527 0.137 Uiso 0.57(11) 1 calc R U P E 2
C15B C 0.4149(10) 0.766(2) 0.2978(18) 0.122(5) Uani 0.452(10) 1 d D . P A 2
H15B H 0.400003 0.763928 0.255263 0.147 Uiso 0.452(10) 1 calc R U P A 2
C35A C 0.7905(5) 0.7078(11) 0.6504(12) 0.075(6) Uani 0.48(2) 1 d G . P C 1
C36A C 0.8168(8) 0.7195(16) 0.6044(13) 0.119(13) Uani 0.48(2) 1 d G . P C 1
H36A H 0.819500 0.679775 0.571694 0.143 Uiso 0.48(2) 1 calc R U P C 1
C37A C 0.8391(8) 0.7906(18) 0.6074(13) 0.144(6) Uani 0.48(2) 1 d G . P C 1
H37A H 0.856691 0.798370 0.576604 0.173 Uiso 0.48(2) 1 calc R U P C 1
C38A C 0.8350(8) 0.8500(14) 0.6563(15) 0.144(6) Uani 0.48(2) 1 d G . P C 1
H38A H 0.849953 0.897491 0.658231 0.173 Uiso 0.48(2) 1 calc R U P C 1
C39A C 0.8087(8) 0.8383(14) 0.7022(15) 0.144(6) Uani 0.48(2) 1 d G . P C 1
H39A H 0.806023 0.878019 0.734947 0.173 Uiso 0.48(2) 1 calc R U P C 1
C40A C 0.7864(6) 0.7672(15) 0.6993(13) 0.102(9) Uani 0.48(2) 1 d G . P C 1
H40A H 0.768832 0.759425 0.730038 0.123 Uiso 0.48(2) 1 calc R U P C 1
C29A C 0.7917(5) 0.5581(10) 0.7081(9) 0.069(6) Uani 0.55(3) 1 d G . P C 1
C34A C 0.7997(6) 0.5864(11) 0.7746(10) 0.081(6) Uani 0.55(3) 1 d G . P C 1
H34A H 0.787663 0.633665 0.787718 0.097 Uiso 0.55(3) 1 calc R U P C 1
C33A C 0.8256(6) 0.5440(14) 0.8214(8) 0.115(10) Uani 0.55(3) 1 d G . P C 1
H33A H 0.830955 0.562935 0.865939 0.138 Uiso 0.55(3) 1 calc R U P C 1
C32A C 0.8436(6) 0.4733(14) 0.8018(9) 0.104(8) Uani 0.55(3) 1 d G . P C 1
H32A H 0.860909 0.444961 0.833151 0.124 Uiso 0.55(3) 1 calc R U P C 1
C31A C 0.8356(8) 0.4450(13) 0.7353(11) 0.157(19) Uani 0.55(3) 1 d G . P C 1
H31A H 0.847569 0.397716 0.722143 0.189 Uiso 0.55(3) 1 calc R U P C 1
C30A C 0.8096(7) 0.4874(13) 0.6884(8) 0.104(9) Uani 0.55(3) 1 d G . P C 1
H30A H 0.804277 0.468446 0.643921 0.125 Uiso 0.55(3) 1 calc R U P C 1
C41A C 0.7561(5) 0.5696(9) 0.5684(5) 0.115(3) Uani 0.710(10) 1 d G . P C 1
C42A C 0.7360(5) 0.4957(9) 0.5615(5) 0.115(3) Uani 0.710(10) 1 d G . P C 1
H42A H 0.725327 0.474058 0.598238 0.138 Uiso 0.710(10) 1 calc R U P C 1
C43A C 0.7317(4) 0.4543(8) 0.4997(7) 0.115(3) Uani 0.710(10) 1 d G . P C 1
H43A H 0.718226 0.404839 0.495084 0.138 Uiso 0.710(10) 1 calc R U P C 1
C44A C 0.7476(5) 0.4867(9) 0.4448(5) 0.115(3) Uani 0.710(10) 1 d G . P C 1
H44A H 0.744732 0.458943 0.403443 0.138 Uiso 0.710(10) 1 calc R U P C 1
C45A C 0.7677(5) 0.5606(9) 0.4517(6) 0.115(3) Uani 0.710(10) 1 d G . P C 1
H45A H 0.778337 0.582267 0.414954 0.138 Uiso 0.710(10) 1 calc R U P C 1
C46A C 0.7720(4) 0.6021(8) 0.5135(7) 0.115(3) Uani 0.710(10) 1 d G . P C 1
H46A H 0.785438 0.651489 0.518107 0.138 Uiso 0.710(10) 1 calc R U P C 1
C13A C 0.4348(6) 0.779(3) 0.4229(10) 0.122(5) Uani 0.548(10) 1 d D . P A 1
C14A C 0.4031(9) 0.797(2) 0.3678(12) 0.122(5) Uani 0.548(10) 1 d D . P A 1
H14A H 0.377014 0.792005 0.372292 0.147 Uiso 0.548(10) 1 calc R U P A 1
C15A C 0.4164(8) 0.8222(17) 0.3099(14) 0.122(5) Uani 0.548(10) 1 d D . P A 1
H15A H 0.402091 0.837478 0.268858 0.147 Uiso 0.548(10) 1 calc R U P A 1
C16A C 0.4584(9) 0.8197(18) 0.3269(11) 0.122(5) Uani 0.548(10) 1 d D . P A 1
H16A H 0.473883 0.833216 0.293764 0.147 Uiso 0.548(10) 1 calc R U P A 1
S3A S 0.4795(3) 0.7931(7) 0.4047(5) 0.1209(9) Uani 0.548(10) 1 d D . P A 1
F5A F 0.3354(8) 0.699(2) 0.6490(13) 0.152(4) Uani 0.350(14) 1 d D . P D 1
F4A F 0.3381(7) 0.8159(13) 0.6106(18) 0.152(4) Uani 0.350(14) 1 d D . P D 1
F6A F 0.3188(7) 0.717(2) 0.5461(12) 0.152(4) Uani 0.350(14) 1 d D . P D 1
F9A F 0.4696(7) 0.3655(9) 0.6549(18) 0.140(3) Uani 0.46(3) 1 d D . P B 1
F8A F 0.4581(7) 0.4456(16) 0.7287(8) 0.140(3) Uani 0.46(3) 1 d D . P B 1
F7A F 0.4168(5) 0.4314(17) 0.6430(14) 0.140(3) Uani 0.46(3) 1 d D . P B 1
C22A C 0.5870(10) 0.4567(15) 0.561(4) 0.069(10) Uani 0.43(11) 1 d D . P E 1
H22A H 0.577809 0.406510 0.574201 0.083 Uiso 0.43(11) 1 calc R U P E 1
C23A C 0.6234(14) 0.474(3) 0.539(5) 0.102(17) Uani 0.43(11) 1 d D . P E 1
H23A H 0.641043 0.433179 0.532925 0.123 Uiso 0.43(11) 1 calc R U P E 1
C24A C 0.6307(15) 0.552(3) 0.529(3) 0.089(12) Uani 0.43(11) 1 d D . P E 1
H24A H 0.654148 0.569360 0.515991 0.106 Uiso 0.43(11) 1 calc R U P E 1


_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
Pt1 P1 2.230(2) . ?
Pt1 Cl2 2.286(3) . ?
Pt1 Cl1 2.276(3) . ?
Pt1 N2 2.109(7) . ?
Gd2 O7 2.485(7) . ?
Gd2 O7 2.492(7) 2_656 ?
Gd2 O5 2.336(8) . ?
Gd2 O4 2.334(8) . ?
Gd2 O2 2.307(9) . ?
Gd2 O1 2.378(7) . ?
Gd2 O3 2.355(9) . ?
Gd2 O6 2.339(8) . ?
P1 C35B 1.855(14) . ?
P1 C29B 1.891(18) . ?
P1 C41B 1.83(2) . ?
P1 C35A 1.799(16) . ?
P1 C29A 1.766(13) . ?
P1 C41A 1.787(9) . ?
S2 C21 1.661(12) . ?
S2 C24B 1.70(5) . ?
S2 C24A 1.64(6) . ?
S1 C5 1.654(15) . ?
S1 C8 1.690(17) . ?
N2 C28 1.322(12) . ?
N2 C26 1.324(12) . ?
O7 N1 1.338(9) . ?
O5 C20 1.256(13) . ?
N1 C25 1.344(13) . ?
N1 C27 1.320(12) . ?
O4 C4 1.257(14) . ?
O2 C12 1.261(14) . ?
O1 C10 1.248(14) . ?
S3B C13B 1.65(2) . ?
S3B C16B 1.656(19) . ?
O3 C2 1.238(16) . ?
O6 C18 1.257(15) . ?
C28 H28 0.9300 . ?
C28 C27 1.369(13) . ?
C25 H25 0.9300 . ?
C25 C26 1.372(13) . ?
F8B C17 1.319(14) . ?
C26 H26 0.9300 . ?
F3 C1 1.31(3) . ?
C27 H27 0.9300 . ?
C12 C11 1.453(18) . ?
C12 C13B 1.46(2) . ?
C12 C13A 1.47(2) . ?
C20 C19 1.428(16) . ?
C20 C21 1.458(15) . ?
C10 C11 1.307(17) . ?
C10 C9 1.49(2) . ?
F2 C1 1.36(3) . ?
C35B C36B 1.3900 . ?
C35B C40B 1.3900 . ?
C36B H36B 0.9300 . ?
C36B C37B 1.3900 . ?
C37B H37B 0.9300 . ?
C37B C38B 1.3900 . ?
C38B H38B 0.9300 . ?
C38B C39B 1.3900 . ?
C39B H39B 0.9300 . ?
C39B C40B 1.3900 . ?
C40B H40B 0.9300 . ?
F5B C9 1.346(14) . ?
C11 H11 0.9300 . ?
C4 C5 1.444(17) . ?
C4 C3 1.427(18) . ?
C19 H19 0.9300 . ?
C19 C18 1.346(17) . ?
F7B C17 1.371(14) . ?
C29B C34B 1.3900 . ?
C29B C30B 1.3900 . ?
C34B H34B 0.9300 . ?
C34B C33B 1.3900 . ?
C33B H33B 0.9300 . ?
C33B C32B 1.3900 . ?
C32B H32B 0.9300 . ?
C32B C31B 1.3900 . ?
C31B H31B 0.9300 . ?
C31B C30B 1.3900 . ?
C30B H30B 0.9300 . ?
C41B C42B 1.3900 . ?
C41B C46B 1.3900 . ?
C42B H42B 0.9300 . ?
C42B C43B 1.3900 . ?
C43B H43B 0.9300 . ?
C43B C44B 1.3900 . ?
C44B H44B 0.9300 . ?
C44B C45B 1.3900 . ?
C45B H45B 0.9300 . ?
C45B C46B 1.3900 . ?
C46B H46B 0.9300 . ?
C5 C6 1.475(17) . ?
F9B C17 1.323(14) . ?
C21 C22B 1.56(2) . ?
C21 C22A 1.55(2) . ?
C6 H6 0.9300 . ?
C6 C7 1.39(2) . ?
C18 C17 1.458(19) . ?
C9 F6B 1.325(14) . ?
C9 F4B 1.340(14) . ?
C9 F5A 1.335(16) . ?
C9 F4A 1.342(16) . ?
C9 F6A 1.331(15) . ?
C2 C1 1.49(2) . ?
C2 C3 1.37(2) . ?
C14B H14B 0.9300 . ?
C14B C13B 1.47(2) . ?
C14B C15B 1.37(3) . ?
C17 F9A 1.347(14) . ?
C17 F8A 1.373(15) . ?
C17 F7A 1.314(14) . ?
C22B H22B 0.9300 . ?
C22B C23B 1.42(2) . ?
C1 F1 1.35(3) . ?
C3 H3 0.9300 . ?
C8 H8 0.9300 . ?
C8 C7 1.32(3) . ?
C24B H24B 0.9300 . ?
C24B C23B 1.31(3) . ?
C7 H7 0.9300 . ?
C16B H16B 0.9300 . ?
C16B C15B 1.45(2) . ?
C23B H23B 0.9300 . ?
C15B H15B 0.9300 . ?
C35A C36A 1.3900 . ?
C35A C40A 1.3900 . ?
C36A H36A 0.9300 . ?
C36A C37A 1.3900 . ?
C37A H37A 0.9300 . ?
C37A C38A 1.3900 . ?
C38A H38A 0.9300 . ?
C38A C39A 1.3900 . ?
C39A H39A 0.9300 . ?
C39A C40A 1.3900 . ?
C40A H40A 0.9300 . ?
C29A C34A 1.3900 . ?
C29A C30A 1.3900 . ?
C34A H34A 0.9300 . ?
C34A C33A 1.3900 . ?
C33A H33A 0.9300 . ?
C33A C32A 1.3900 . ?
C32A H32A 0.9300 . ?
C32A C31A 1.3900 . ?
C31A H31A 0.9300 . ?
C31A C30A 1.3900 . ?
C30A H30A 0.9300 . ?
C41A C42A 1.3900 . ?
C41A C46A 1.3900 . ?
C42A H42A 0.9300 . ?
C42A C43A 1.3900 . ?
C43A H43A 0.9300 . ?
C43A C44A 1.3900 . ?
C44A H44A 0.9300 . ?
C44A C45A 1.3900 . ?
C45A H45A 0.9300 . ?
C45A C46A 1.3900 . ?
C46A H46A 0.9300 . ?
C13A C14A 1.48(2) . ?
C13A S3A 1.660(19) . ?
C14A H14A 0.9300 . ?
C14A C15A 1.36(3) . ?
C15A H15A 0.9300 . ?
C15A C16A 1.46(2) . ?
C16A H16A 0.9300 . ?
C16A S3A 1.675(18) . ?
C22A H22A 0.9300 . ?
C22A C23A 1.42(2) . ?
C23A H23A 0.9300 . ?
C23A C24A 1.31(3) . ?
C24A H24A 0.9300 . ?

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
P1 Pt1 Cl2 90.53(10) . . ?
P1 Pt1 Cl1 93.75(10) . . ?
Cl1 Pt1 Cl2 175.41(11) . . ?
N2 Pt1 P1 178.7(2) . . ?
N2 Pt1 Cl2 89.4(2) . . ?
N2 Pt1 Cl1 86.3(2) . . ?
O7 Gd2 O7 61.7(2) . 2_656 ?
O5 Gd2 O7 125.1(3) . 2_656 ?
O5 Gd2 O7 76.7(3) . . ?
O5 Gd2 O1 131.1(3) . . ?
O5 Gd2 O3 148.5(3) . . ?
O5 Gd2 O6 69.9(3) . . ?
O4 Gd2 O7 76.4(3) . . ?
O4 Gd2 O7 121.4(3) . 2_656 ?
O4 Gd2 O5 76.9(3) . . ?
O4 Gd2 O1 131.5(3) . . ?
O4 Gd2 O3 71.6(3) . . ?
O4 Gd2 O6 146.4(3) . . ?
O2 Gd2 O7 150.3(3) . 2_656 ?
O2 Gd2 O7 147.4(3) . . ?
O2 Gd2 O5 80.0(3) . . ?
O2 Gd2 O4 76.3(3) . . ?
O2 Gd2 O1 72.6(3) . . ?
O2 Gd2 O3 92.8(3) . . ?
O2 Gd2 O6 102.3(3) . . ?
O1 Gd2 O7 78.2(3) . 2_656 ?
O1 Gd2 O7 139.9(3) . . ?
O3 Gd2 O7 95.3(3) . . ?
O3 Gd2 O7 73.4(3) . 2_656 ?
O3 Gd2 O1 73.6(3) . . ?
O6 Gd2 O7 76.1(3) . 2_656 ?
O6 Gd2 O7 90.8(3) . . ?
O6 Gd2 O1 77.3(3) . . ?
O6 Gd2 O3 141.3(3) . . ?
C35B P1 Pt1 115.4(7) . . ?
C35B P1 C29B 106.4(10) . . ?
C29B P1 Pt1 112.8(7) . . ?
C41B P1 Pt1 114.3(11) . . ?
C41B P1 C35B 107.2(14) . . ?
C41B P1 C29B 99.0(14) . . ?
C35A P1 Pt1 113.9(7) . . ?
C29A P1 Pt1 117.2(6) . . ?
C29A P1 C35A 98.0(10) . . ?
C29A P1 C41A 108.6(8) . . ?
C41A P1 Pt1 108.7(5) . . ?
C41A P1 C35A 109.9(9) . . ?
C21 S2 C24B 93.3(15) . . ?
C24A S2 C21 92.7(19) . . ?
C5 S1 C8 92.7(8) . . ?
C28 N2 Pt1 121.6(6) . . ?
C28 N2 C26 116.3(8) . . ?
C26 N2 Pt1 122.1(7) . . ?
Gd2 O7 Gd2 117.8(2) . 2_656 ?
N1 O7 Gd2 122.0(6) . . ?
N1 O7 Gd2 120.1(5) . 2_656 ?
C20 O5 Gd2 140.3(7) . . ?
O7 N1 C25 119.1(8) . . ?
C27 N1 O7 119.9(8) . . ?
C27 N1 C25 121.0(8) . . ?
C4 O4 Gd2 137.2(8) . . ?
C12 O2 Gd2 137.1(8) . . ?
C10 O1 Gd2 132.0(8) . . ?
C13B S3B C16B 104.9(16) . . ?
C2 O3 Gd2 132.9(9) . . ?
C18 O6 Gd2 137.5(9) . . ?
N2 C28 H28 118.2 . . ?
N2 C28 C27 123.6(9) . . ?
C27 C28 H28 118.2 . . ?
N1 C25 H25 121.1 . . ?
N1 C25 C26 117.9(9) . . ?
C26 C25 H25 121.1 . . ?
N2 C26 C25 123.0(10) . . ?
N2 C26 H26 118.5 . . ?
C25 C26 H26 118.5 . . ?
N1 C27 C28 118.1(9) . . ?
N1 C27 H27 121.0 . . ?
C28 C27 H27 121.0 . . ?
O2 C12 C11 123.6(12) . . ?
O2 C12 C13B 123.4(14) . . ?
O2 C12 C13A 113.0(14) . . ?
C11 C12 C13B 112.4(14) . . ?
C11 C12 C13A 123.3(14) . . ?
O5 C20 C19 122.9(10) . . ?
O5 C20 C21 117.6(10) . . ?
C19 C20 C21 119.6(11) . . ?
O1 C10 C11 130.7(12) . . ?
O1 C10 C9 112.5(11) . . ?
C11 C10 C9 116.7(11) . . ?
C36B C35B P1 115.9(12) . . ?
C36B C35B C40B 120.0 . . ?
C40B C35B P1 123.9(11) . . ?
C35B C36B H36B 120.0 . . ?
C35B C36B C37B 120.0 . . ?
C37B C36B H36B 120.0 . . ?
C36B C37B H37B 120.0 . . ?
C38B C37B C36B 120.0 . . ?
C38B C37B H37B 120.0 . . ?
C37B C38B H38B 120.0 . . ?
C39B C38B C37B 120.0 . . ?
C39B C38B H38B 120.0 . . ?
C38B C39B H39B 120.0 . . ?
C38B C39B C40B 120.0 . . ?
C40B C39B H39B 120.0 . . ?
C35B C40B H40B 120.0 . . ?
C39B C40B C35B 120.0 . . ?
C39B C40B H40B 120.0 . . ?
C12 C11 H11 118.9 . . ?
C10 C11 C12 122.1(12) . . ?
C10 C11 H11 118.9 . . ?
O4 C4 C5 118.0(12) . . ?
O4 C4 C3 123.3(12) . . ?
C3 C4 C5 118.7(12) . . ?
C20 C19 H19 119.4 . . ?
C18 C19 C20 121.2(11) . . ?
C18 C19 H19 119.4 . . ?
C34B C29B P1 119.3(13) . . ?
C34B C29B C30B 120.0 . . ?
C30B C29B P1 120.5(13) . . ?
C29B C34B H34B 120.0 . . ?
C29B C34B C33B 120.0 . . ?
C33B C34B H34B 120.0 . . ?
C34B C33B H33B 120.0 . . ?
C32B C33B C34B 120.0 . . ?
C32B C33B H33B 120.0 . . ?
C33B C32B H32B 120.0 . . ?
C31B C32B C33B 120.0 . . ?
C31B C32B H32B 120.0 . . ?
C32B C31B H31B 120.0 . . ?
C32B C31B C30B 120.0 . . ?
C30B C31B H31B 120.0 . . ?
C29B C30B H30B 120.0 . . ?
C31B C30B C29B 120.0 . . ?
C31B C30B H30B 120.0 . . ?
C42B C41B P1 119.7(19) . . ?
C42B C41B C46B 120.0 . . ?
C46B C41B P1 119.8(19) . . ?
C41B C42B H42B 120.0 . . ?
C41B C42B C43B 120.0 . . ?
C43B C42B H42B 120.0 . . ?
C42B C43B H43B 120.0 . . ?
C42B C43B C44B 120.0 . . ?
C44B C43B H43B 120.0 . . ?
C43B C44B H44B 120.0 . . ?
C43B C44B C45B 120.0 . . ?
C45B C44B H44B 120.0 . . ?
C44B C45B H45B 120.0 . . ?
C46B C45B C44B 120.0 . . ?
C46B C45B H45B 120.0 . . ?
C41B C46B H46B 120.0 . . ?
C45B C46B C41B 120.0 . . ?
C45B C46B H46B 120.0 . . ?
C4 C5 S1 118.9(10) . . ?
C4 C5 C6 129.5(13) . . ?
C6 C5 S1 111.5(10) . . ?
C20 C21 S2 119.9(9) . . ?
C20 C21 C22B 128.7(14) . . ?
C20 C21 C22A 124.8(18) . . ?
C22B C21 S2 111.3(12) . . ?
C22A C21 S2 111.5(14) . . ?
C5 C6 H6 126.2 . . ?
C7 C6 C5 107.5(15) . . ?
C7 C6 H6 126.2 . . ?
O6 C18 C19 127.7(12) . . ?
O6 C18 C17 112.3(12) . . ?
C19 C18 C17 120.1(12) . . ?
F5B C9 C10 112.5(14) . . ?
F6B C9 C10 120.2(14) . . ?
F6B C9 F5B 108.5(15) . . ?
F6B C9 F4B 102.8(14) . . ?
F4B C9 C10 114.1(13) . . ?
F4B C9 F5B 95.5(14) . . ?
F5A C9 C10 123.7(17) . . ?
F5A C9 F4A 100.8(18) . . ?
F4A C9 C10 108.4(17) . . ?
F6A C9 C10 115.4(18) . . ?
F6A C9 F5A 101.7(18) . . ?
F6A C9 F4A 104.5(18) . . ?
O3 C2 C1 111.7(16) . . ?
O3 C2 C3 129.5(13) . . ?
C3 C2 C1 118.7(17) . . ?
C13B C14B H14B 123.4 . . ?
C15B C14B H14B 123.4 . . ?
C15B C14B C13B 113(3) . . ?
F8B C17 F7B 100.8(15) . . ?
F8B C17 F9B 110.4(15) . . ?
F8B C17 C18 123.2(14) . . ?
F7B C17 C18 104.8(14) . . ?
F9B C17 F7B 97.4(14) . . ?
F9B C17 C18 115.3(13) . . ?
F9A C17 C18 116.5(14) . . ?
F9A C17 F8A 97.1(16) . . ?
F8A C17 C18 105.2(14) . . ?
F7A C17 C18 125.9(16) . . ?
F7A C17 F9A 105.3(15) . . ?
F7A C17 F8A 102.0(16) . . ?
C21 C22B H22B 127.8 . . ?
C23B C22B C21 104(2) . . ?
C23B C22B H22B 127.8 . . ?
F3 C1 F2 101(2) . . ?
F3 C1 C2 116.1(19) . . ?
F3 C1 F1 101.1(18) . . ?
F2 C1 C2 112.9(17) . . ?
F1 C1 F2 108.4(19) . . ?
F1 C1 C2 116(2) . . ?
C4 C3 H3 119.5 . . ?
C2 C3 C4 121.1(13) . . ?
C2 C3 H3 119.5 . . ?
C12 C13B S3B 113.7(16) . . ?
C12 C13B C14B 143(2) . . ?
C14B C13B S3B 103.1(19) . . ?
S1 C8 H8 123.8 . . ?
C7 C8 S1 112.4(14) . . ?
C7 C8 H8 123.8 . . ?
S2 C24B H24B 123.5 . . ?
C23B C24B S2 113(3) . . ?
C23B C24B H24B 123.5 . . ?
C6 C7 H7 122.1 . . ?
C8 C7 C6 115.8(16) . . ?
C8 C7 H7 122.1 . . ?
S3B C16B H16B 129.5 . . ?
C15B C16B S3B 101(2) . . ?
C15B C16B H16B 129.5 . . ?
C22B C23B H23B 121.0 . . ?
C24B C23B C22B 118(3) . . ?
C24B C23B H23B 121.0 . . ?
C14B C15B C16B 117(3) . . ?
C14B C15B H15B 121.4 . . ?
C16B C15B H15B 121.4 . . ?
C36A C35A P1 122.8(13) . . ?
C36A C35A C40A 120.0 . . ?
C40A C35A P1 117.2(13) . . ?
C35A C36A H36A 120.0 . . ?
C37A C36A C35A 120.0 . . ?
C37A C36A H36A 120.0 . . ?
C36A C37A H37A 120.0 . . ?
C38A C37A C36A 120.0 . . ?
C38A C37A H37A 120.0 . . ?
C37A C38A H38A 120.0 . . ?
C37A C38A C39A 120.0 . . ?
C39A C38A H38A 120.0 . . ?
C38A C39A H39A 120.0 . . ?
C40A C39A C38A 120.0 . . ?
C40A C39A H39A 120.0 . . ?
C35A C40A H40A 120.0 . . ?
C39A C40A C35A 120.0 . . ?
C39A C40A H40A 120.0 . . ?
C34A C29A P1 117.6(11) . . ?
C34A C29A C30A 120.0 . . ?
C30A C29A P1 122.3(11) . . ?
C29A C34A H34A 120.0 . . ?
C33A C34A C29A 120.0 . . ?
C33A C34A H34A 120.0 . . ?
C34A C33A H33A 120.0 . . ?
C34A C33A C32A 120.0 . . ?
C32A C33A H33A 120.0 . . ?
C33A C32A H32A 120.0 . . ?
C31A C32A C33A 120.0 . . ?
C31A C32A H32A 120.0 . . ?
C32A C31A H31A 120.0 . . ?
C32A C31A C30A 120.0 . . ?
C30A C31A H31A 120.0 . . ?
C29A C30A H30A 120.0 . . ?
C31A C30A C29A 120.0 . . ?
C31A C30A H30A 120.0 . . ?
C42A C41A P1 116.8(8) . . ?
C42A C41A C46A 120.0 . . ?
C46A C41A P1 123.2(8) . . ?
C41A C42A H42A 120.0 . . ?
C41A C42A C43A 120.0 . . ?
C43A C42A H42A 120.0 . . ?
C42A C43A H43A 120.0 . . ?
C42A C43A C44A 120.0 . . ?
C44A C43A H43A 120.0 . . ?
C43A C44A H44A 120.0 . . ?
C45A C44A C43A 120.0 . . ?
C45A C44A H44A 120.0 . . ?
C44A C45A H45A 120.0 . . ?
C44A C45A C46A 120.0 . . ?
C46A C45A H45A 120.0 . . ?
C41A C46A H46A 120.0 . . ?
C45A C46A C41A 120.0 . . ?
C45A C46A H46A 120.0 . . ?
C12 C13A C14A 124.0(18) . . ?
C12 C13A S3A 119.7(16) . . ?
C14A C13A S3A 116.2(17) . . ?
C13A C14A H14A 123.8 . . ?
C15A C14A C13A 112(2) . . ?
C15A C14A H14A 123.8 . . ?
C14A C15A H15A 128.0 . . ?
C14A C15A C16A 104(3) . . ?
C16A C15A H15A 128.0 . . ?
C15A C16A H16A 119.2 . . ?
C15A C16A S3A 122(2) . . ?
S3A C16A H16A 119.2 . . ?
C13A S3A C16A 85.9(14) . . ?
C21 C22A H22A 128.3 . . ?
C23A C22A C21 103(3) . . ?
C23A C22A H22A 128.3 . . ?
C22A C23A H23A 121.8 . . ?
C24A C23A C22A 116(4) . . ?
C24A C23A H23A 121.8 . . ?
S2 C24A H24A 122.3 . . ?
C23A C24A S2 115(4) . . ?
C23A C24A H24A 122.3 . . ?

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
Pt1 P1 C35B C36B 172.6(11) . . . . ?
Pt1 P1 C35B C40B -2.3(16) . . . . ?
Pt1 P1 C29B C34B -99.5(15) . . . . ?
Pt1 P1 C29B C30B 75.1(16) . . . . ?
Pt1 P1 C41B C42B -148.7(16) . . . . ?
Pt1 P1 C41B C46B 39(2) . . . . ?
Pt1 P1 C35A C36A -143.8(14) . . . . ?
Pt1 P1 C35A C40A 36.1(17) . . . . ?
Pt1 P1 C29A C34A -57.9(13) . . . . ?
Pt1 P1 C29A C30A 125.5(13) . . . . ?
Pt1 P1 C41A C42A -59.1(9) . . . . ?
Pt1 P1 C41A C46A 121.6(9) . . . . ?
Pt1 N2 C28 C27 -179.5(8) . . . . ?
Pt1 N2 C26 C25 -178.6(8) . . . . ?
Gd2 O7 N1 C25 81.9(10) 2_656 . . . ?
Gd2 O7 N1 C25 -94.3(9) . . . . ?
Gd2 O7 N1 C27 87.3(10) . . . . ?
Gd2 O7 N1 C27 -96.5(9) 2_656 . . . ?
Gd2 O5 C20 C19 -0.1(19) . . . . ?
Gd2 O5 C20 C21 -178.2(8) . . . . ?
Gd2 O4 C4 C5 -163.9(8) . . . . ?
Gd2 O4 C4 C3 15.0(19) . . . . ?
Gd2 O2 C12 C11 -9(2) . . . . ?
Gd2 O2 C12 C13B 180(2) . . . . ?
Gd2 O2 C12 C13A 166.8(19) . . . . ?
Gd2 O1 C10 C11 9(2) . . . . ?
Gd2 O1 C10 C9 -169.7(9) . . . . ?
Gd2 O3 C2 C1 167.3(12) . . . . ?
Gd2 O3 C2 C3 -15(2) . . . . ?
Gd2 O6 C18 C19 5(2) . . . . ?
Gd2 O6 C18 C17 -175.4(8) . . . . ?
P1 C35B C36B C37B -175.1(15) . . . . ?
P1 C35B C40B C39B 174.7(17) . . . . ?
P1 C29B C34B C33B 174.5(16) . . . . ?
P1 C29B C30B C31B -174.5(16) . . . . ?
P1 C41B C42B C43B -173(3) . . . . ?
P1 C41B C46B C45B 173(3) . . . . ?
P1 C35A C36A C37A 179.9(18) . . . . ?
P1 C35A C40A C39A -179.9(17) . . . . ?
P1 C29A C34A C33A -176.6(14) . . . . ?
P1 C29A C30A C31A 176.5(15) . . . . ?
P1 C41A C42A C43A -179.3(12) . . . . ?
P1 C41A C46A C45A 179.3(13) . . . . ?
S2 C21 C22B C23B 2(2) . . . . ?
S2 C21 C22A C23A -8(2) . . . . ?
S2 C24B C23B C22B 0.7(17) . . . . ?
S1 C5 C6 C7 1.1(15) . . . . ?
S1 C8 C7 C6 -3(2) . . . . ?
N2 C28 C27 N1 -4.9(17) . . . . ?
O7 N1 C25 C26 178.9(9) . . . . ?
O7 N1 C27 C28 -177.2(9) . . . . ?
O5 C20 C19 C18 -6(2) . . . . ?
O5 C20 C21 S2 1.4(16) . . . . ?
O5 C20 C21 C22B -174(3) . . . . ?
O5 C20 C21 C22A 157(3) . . . . ?
N1 C25 C26 N2 1.0(16) . . . . ?
O4 C4 C5 S1 1.3(16) . . . . ?
O4 C4 C5 C6 -175.3(12) . . . . ?
O4 C4 C3 C2 4(2) . . . . ?
O2 C12 C11 C10 -3(2) . . . . ?
O2 C12 C13B S3B -3(4) . . . . ?
O2 C12 C13B C14B 169(3) . . . . ?
O2 C12 C13A C14A 176(2) . . . . ?
O2 C12 C13A S3A -8(4) . . . . ?
O1 C10 C11 C12 3(2) . . . . ?
O1 C10 C9 F5B -59.4(17) . . . . ?
O1 C10 C9 F6B 170.8(16) . . . . ?
O1 C10 C9 F4B 48.0(19) . . . . ?
O1 C10 C9 F5A -20(3) . . . . ?
O1 C10 C9 F4A 97.0(19) . . . . ?
O1 C10 C9 F6A -146(2) . . . . ?
S3B C16B C15B C14B 8(3) . . . . ?
O3 C2 C1 F3 -62(3) . . . . ?
O3 C2 C1 F2 54(3) . . . . ?
O3 C2 C1 F1 179.5(19) . . . . ?
O3 C2 C3 C4 -4(3) . . . . ?
O6 C18 C17 F8B -65(2) . . . . ?
O6 C18 C17 F7B 49.2(18) . . . . ?
O6 C18 C17 F9B 155.0(17) . . . . ?
O6 C18 C17 F9A -165.4(19) . . . . ?
O6 C18 C17 F8A -59.2(19) . . . . ?
O6 C18 C17 F7A 58(2) . . . . ?
C28 N2 C26 C25 -1.2(15) . . . . ?
C25 N1 C27 C28 4.5(16) . . . . ?
C26 N2 C28 C27 3.2(16) . . . . ?
C27 N1 C25 C26 -2.7(15) . . . . ?
C12 C13A C14A C15A 177(3) . . . . ?
C12 C13A S3A C16A -178(3) . . . . ?
C20 C19 C18 O6 3(2) . . . . ?
C20 C19 C18 C17 -176.1(12) . . . . ?
C20 C21 C22B C23B 178(2) . . . . ?
C20 C21 C22A C23A -166(2) . . . . ?
C35B P1 C29B C34B 28.1(17) . . . . ?
C35B P1 C29B C30B -157.4(16) . . . . ?
C35B P1 C41B C42B 82(2) . . . . ?
C35B P1 C41B C46B -91(2) . . . . ?
C35B C36B C37B C38B 0.0 . . . . ?
C36B C35B C40B C39B 0.0 . . . . ?
C36B C37B C38B C39B 0.0 . . . . ?
C37B C38B C39B C40B 0.0 . . . . ?
C38B C39B C40B C35B 0.0 . . . . ?
C40B C35B C36B C37B 0.0 . . . . ?
C11 C12 C13B S3B -174.6(19) . . . . ?
C11 C12 C13B C14B -3(4) . . . . ?
C11 C12 C13A C14A -8(4) . . . . ?
C11 C12 C13A S3A 167.8(18) . . . . ?
C11 C10 C9 F5B 121.7(15) . . . . ?
C11 C10 C9 F6B -8(2) . . . . ?
C11 C10 C9 F4B -130.8(16) . . . . ?
C11 C10 C9 F5A 161(2) . . . . ?
C11 C10 C9 F4A -82(2) . . . . ?
C11 C10 C9 F6A 35(2) . . . . ?
C4 C5 C6 C7 178.0(14) . . . . ?
C19 C20 C21 S2 -176.7(10) . . . . ?
C19 C20 C21 C22B 8(3) . . . . ?
C19 C20 C21 C22A -21(4) . . . . ?
C19 C18 C17 F8B 114.8(19) . . . . ?
C19 C18 C17 F7B -131.4(16) . . . . ?
C19 C18 C17 F9B -26(2) . . . . ?
C19 C18 C17 F9A 14(2) . . . . ?
C19 C18 C17 F8A 120.2(18) . . . . ?
C19 C18 C17 F7A -122(2) . . . . ?
C29B P1 C35B C36B 46.5(15) . . . . ?
C29B P1 C35B C40B -128.3(15) . . . . ?
C29B P1 C41B C42B -28(2) . . . . ?
C29B P1 C41B C46B 159.0(19) . . . . ?
C29B C34B C33B C32B 0.0 . . . . ?
C34B C29B C30B C31B 0.0 . . . . ?
C34B C33B C32B C31B 0.0 . . . . ?
C33B C32B C31B C30B 0.0 . . . . ?
C32B C31B C30B C29B 0.0 . . . . ?
C30B C29B C34B C33B 0.0 . . . . ?
C41B P1 C35B C36B -58.7(18) . . . . ?
C41B P1 C35B C40B 126.4(18) . . . . ?
C41B P1 C29B C34B 139.2(19) . . . . ?
C41B P1 C29B C30B -46(2) . . . . ?
C41B C42B C43B C44B 0.0 . . . . ?
C42B C41B C46B C45B 0.0 . . . . ?
C42B C43B C44B C45B 0.0 . . . . ?
C43B C44B C45B C46B 0.0 . . . . ?
C44B C45B C46B C41B 0.0 . . . . ?
C46B C41B C42B C43B 0.0 . . . . ?
C5 S1 C8 C7 3.0(16) . . . . ?
C5 C4 C3 C2 -176.9(13) . . . . ?
C5 C6 C7 C8 1(2) . . . . ?
C21 S2 C24B C23B 0.4(12) . . . . ?
C21 S2 C24A C23A -2.7(14) . . . . ?
C21 C20 C19 C18 172.5(13) . . . . ?
C21 C22B C23B C24B -1(2) . . . . ?
C21 C22A C23A C24A 6(2) . . . . ?
C9 C10 C11 C12 -178.7(12) . . . . ?
C1 C2 C3 C4 174.1(16) . . . . ?
C3 C4 C5 S1 -177.6(10) . . . . ?
C3 C4 C5 C6 6(2) . . . . ?
C3 C2 C1 F3 120(2) . . . . ?
C3 C2 C1 F2 -125(2) . . . . ?
C3 C2 C1 F1 1(3) . . . . ?
C13B S3B C16B C15B -6(2) . . . . ?
C13B C12 C11 C10 169(2) . . . . ?
C13B C14B C15B C16B -7(3) . . . . ?
C8 S1 C5 C4 -179.5(11) . . . . ?
C8 S1 C5 C6 -2.3(11) . . . . ?
C24B S2 C21 C20 -178(2) . . . . ?
C24B S2 C21 C22B -1.2(15) . . . . ?
C16B S3B C13B C12 178(3) . . . . ?
C16B S3B C13B C14B 2.9(13) . . . . ?
C15B C14B C13B S3B 1.8(17) . . . . ?
C15B C14B C13B C12 -170(5) . . . . ?
C35A P1 C29A C34A 64.2(14) . . . . ?
C35A P1 C29A C30A -112.3(15) . . . . ?
C35A P1 C41A C42A 175.6(10) . . . . ?
C35A P1 C41A C46A -3.7(13) . . . . ?
C35A C36A C37A C38A 0.0 . . . . ?
C36A C35A C40A C39A 0.0 . . . . ?
C36A C37A C38A C39A 0.0 . . . . ?
C37A C38A C39A C40A 0.0 . . . . ?
C38A C39A C40A C35A 0.0 . . . . ?
C40A C35A C36A C37A 0.0 . . . . ?
C29A P1 C35A C36A 91.7(16) . . . . ?
C29A P1 C35A C40A -88.4(16) . . . . ?
C29A P1 C41A C42A 69.4(11) . . . . ?
C29A P1 C41A C46A -110.0(11) . . . . ?
C29A C34A C33A C32A 0.0 . . . . ?
C34A C29A C30A C31A 0.0 . . . . ?
C34A C33A C32A C31A 0.0 . . . . ?
C33A C32A C31A C30A 0.0 . . . . ?
C32A C31A C30A C29A 0.0 . . . . ?
C30A C29A C34A C33A 0.0 . . . . ?
C41A P1 C35A C36A -21.5(17) . . . . ?
C41A P1 C35A C40A 158.4(15) . . . . ?
C41A P1 C29A C34A 178.5(12) . . . . ?
C41A P1 C29A C30A 2.0(15) . . . . ?
C41A C42A C43A C44A 0.0 . . . . ?
C42A C41A C46A C45A 0.0 . . . . ?
C42A C43A C44A C45A 0.0 . . . . ?
C43A C44A C45A C46A 0.0 . . . . ?
C44A C45A C46A C41A 0.0 . . . . ?
C46A C41A C42A C43A 0.0 . . . . ?
C13A C12 C11 C10 -179(2) . . . . ?
C13A C14A C15A C16A 0.6(17) . . . . ?
C14A C13A S3A C16A -1(2) . . . . ?
C14A C15A C16A S3A -1.8(17) . . . . ?
C15A C16A S3A C13A 2(2) . . . . ?
S3A C13A C14A C15A 1(3) . . . . ?
C22A C23A C24A S2 -2.3(19) . . . . ?
C24A S2 C21 C20 165(3) . . . . ?
C24A S2 C21 C22A 6.2(18) . . . . ?

# end Validation Reply Form
# end Validation Reply Form
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.539
_oxdiff_exptl_absorpt_empirical_full_min 0.673
# start Validation Reply Form
_vrf_PLAT910_exp_427_auto        
;
PROBLEM: Missing # of FCF Reflection(s) Below Theta(Min). 27 Note
RESPONSE: reflections with |Error/esd| > 10 were omitted
;
