#------------------------------------------------------------------------------ #$Date: 2024-11-21 01:08:29 +0200 (Thu, 21 Nov 2024) $ #$Revision: 296018 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/57/32/1573216.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1573216 loop_ _publ_author_name 'Chen, Jingwen' 'Zhou, Kang' 'Li, Jingbai' 'Xu, Guozhong' 'Hei, Xiuze' 'Li, Jing' _publ_section_title ; Strongly Photoluminescent and Radioluminescent Copper(I) Iodide Hybrid Materials Made of Coordinated Ionic Chains ; _journal_name_full 'Chemical Science' _journal_paper_doi 10.1039/D4SC06242F _journal_year 2024 _chemical_formula_moiety 'C15 H21 Cu2 I3 N4 O, C2 H3 N' _chemical_formula_sum 'C17 H24 Cu2 I3 N5 O' _chemical_formula_weight 822.19 _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2ybc' _space_group_name_H-M_alt 'P 1 21/c 1' _atom_sites_solution_hydrogens mixed _atom_sites_solution_primary dual _audit_creation_date 2023-12-13 _audit_creation_method ; Olex2 1.3 (compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408) ; _audit_update_record ; 2024-07-31 deposited with the CCDC. 2024-11-18 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 108.662(2) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 10.8995(5) _cell_length_b 16.7093(8) _cell_length_c 13.8142(6) _cell_measurement_reflns_used 9946 _cell_measurement_temperature 200.0 _cell_measurement_theta_max 29.311 _cell_measurement_theta_min 2.318 _cell_volume 2383.61(19) _computing_cell_refinement 'SAINT V8.38A (Bruker, 2018)' _computing_data_reduction 'SAINT V8.38A (Bruker, 2018)' _computing_molecular_graphics 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2017/1 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' _diffrn_ambient_temperature 200.0 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.997 _diffrn_measurement_device_type 'Bruker APEX-II CCD' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0583 _diffrn_reflns_av_unetI/netI 0.0469 _diffrn_reflns_Laue_measured_fraction_full 0.999 _diffrn_reflns_Laue_measured_fraction_max 0.997 _diffrn_reflns_limit_h_max 15 _diffrn_reflns_limit_h_min -15 _diffrn_reflns_limit_k_max 23 _diffrn_reflns_limit_k_min -20 _diffrn_reflns_limit_l_max 19 _diffrn_reflns_limit_l_min -19 _diffrn_reflns_number 30486 _diffrn_reflns_point_group_measured_fraction_full 0.999 _diffrn_reflns_point_group_measured_fraction_max 0.997 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 29.621 _diffrn_reflns_theta_min 1.977 _diffrn_source_current 1.0 _diffrn_source_power 0.05 _diffrn_source_voltage 50.0 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 5.687 _exptl_absorpt_correction_T_max 0.7459 _exptl_absorpt_correction_T_min 0.3871 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1060 before and 0.0720 after correction. The Ratio of minimum to maximum transmission is 0.5190. The \l/2 correction factor is Not present. ; _exptl_crystal_colour yellow _exptl_crystal_colour_primary yellow _exptl_crystal_density_diffrn 2.291 _exptl_crystal_description plate _exptl_crystal_F_000 1544 _exptl_crystal_size_max 0.32 _exptl_crystal_size_mid 0.24 _exptl_crystal_size_min 0.1 _refine_diff_density_max 0.912 _refine_diff_density_min -0.914 _refine_diff_density_rms 0.174 _refine_ls_extinction_coef 0.00176(11) _refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^ _refine_ls_extinction_method 'SHELXL-2017/1 (Sheldrick 2017)' _refine_ls_goodness_of_fit_ref 1.257 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 266 _refine_ls_number_reflns 6693 _refine_ls_number_restraints 2 _refine_ls_restrained_S_all 1.259 _refine_ls_R_factor_all 0.0753 _refine_ls_R_factor_gt 0.0540 _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/[\s^2^(Fo^2^)+17.3421P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1045 _refine_ls_wR_factor_ref 0.1117 _reflns_Friedel_coverage 0.000 _reflns_number_gt 5231 _reflns_number_total 6693 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d4sc06242f2.cif _cod_data_source_block 1685_hxz_0m _cod_original_cell_volume 2383.60(19) _cod_database_code 1573216 _shelx_shelxl_version_number 2017/1 _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. ; _shelx_estimated_absorpt_t_max 0.600 _shelx_estimated_absorpt_t_min 0.263 _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H) groups, {H12A,H12B,H12} of C12, {H14A,H14B,H14} of C14, All C(H,H) groups At 1.5 times of: All O(H) groups, {H17A,H17B,H17C} of C17 2. Restrained distances O1A-C14 = O1B-C12 1.43 with sigma of 0.01 3. Others Sof(O1B)=Sof(H1B)=Sof(H12)=Sof(H14A)=Sof(H14B)=1-FVAR(1) Sof(O1A)=Sof(H1A)=Sof(H12A)=Sof(H12B)=Sof(H14)=FVAR(1) 4.a Riding coordinates: C17(H17A,H17B,H17C) 4.b Ternary CH refined with riding coordinates: C12(H12), C14(H14), C15(H15) 4.c Secondary CH2 refined with riding coordinates: C7(H7A,H7B), C8(H8A,H8B), C9(H9A,H9B), C10(H10A,H10B), C11(H11A,H11B), C12(H12A,H12B), C13(H13A,H13B), C14(H14A,H14B) 4.d Aromatic/amide H refined with riding coordinates: C3(H3), C4(H4), C5(H5), C6(H6) 4.e Idealised tetrahedral OH refined as rotating group: O1A(H1A), O1B(H1B) ; _shelx_res_file ; TITL 1685_hxz_0m_a.res in P2(1)/c 1685_hxz_0m.res created by SHELXL-2017/1 at 21:52:32 on 13-Dec-2023 REM Old TITL 1685_HXZ_0m in P2(1)/c REM SHELXT solution in P2(1)/c REM R1 0.128, Rweak 0.011, Alpha 0.028, Orientation as input REM Formula found by SHELXT: C18 N4 O Cu2 I3 CELL 0.71073 10.8995 16.7093 13.8142 90 108.662 90 ZERR 4 0.0005 0.0008 0.0006 0 0.002 0 LATT 1 SYMM -X,0.5+Y,0.5-Z SFAC C H Cu I N O UNIT 68 96 8 12 20 4 DFIX 1.43 0.01 O1A C14 O1B C12 L.S. 10 PLAN 99 SIZE 0.32 0.24 0.1 TEMP -73.15 CONF BOND $H list 4 MORE -1 fmap 2 53 acta OMIT 1 3 2 OMIT -5 1 5 REM REM REM WGHT 0.000000 17.342100 EXTI 0.001756 FVAR 0.19767 0.50400 I1 4 0.427333 0.147566 0.578142 11.00000 0.05032 0.03107 = 0.03120 -0.00061 0.01036 0.00316 I2 4 0.612196 0.278856 0.854972 11.00000 0.03888 0.04729 = 0.02925 -0.00286 0.01097 -0.00583 I3 4 0.207728 0.267055 0.754549 11.00000 0.03780 0.03729 = 0.03247 0.00384 0.01021 -0.00229 CU1 3 0.411078 0.273728 0.686981 11.00000 0.05045 0.04579 = 0.03702 -0.00365 0.01232 -0.00013 CU2 3 0.416542 0.245426 0.424956 11.00000 0.05352 0.03693 = 0.04033 -0.00472 0.01867 0.00368 PART 1 O1A 6 0.169551 0.467071 0.991539 21.00000 0.05941 0.06991 = 0.05396 0.01812 0.03649 0.01736 AFIX 147 H1A 2 0.108139 0.447333 0.944096 21.00000 -1.50000 AFIX 0 PART 2 O1B 6 -0.023497 0.480159 0.889654 -21.00000 0.07121 0.06092 = 0.08729 0.01954 0.05196 0.01853 AFIX 147 H1B 2 -0.071858 0.494181 0.923302 -21.00000 -1.50000 AFIX 0 PART 0 N1 5 0.385070 0.353275 0.482698 11.00000 0.04218 0.02707 = 0.02718 -0.00249 0.01524 0.00185 N2 5 0.385726 0.366032 0.577383 11.00000 0.03923 0.03621 = 0.02654 -0.00608 0.01315 -0.00233 N3 5 0.359603 0.444109 0.586789 11.00000 0.04066 0.03135 = 0.02661 -0.00485 0.01423 0.00262 N4 5 0.184583 0.524852 0.761626 11.00000 0.02719 0.02165 = 0.02445 0.00121 0.00627 0.00324 C1 1 0.340886 0.482694 0.496908 11.00000 0.02642 0.03236 = 0.03889 -0.00187 0.01572 -0.00354 C2 1 0.355724 0.425173 0.430296 11.00000 0.02950 0.03068 = 0.03059 -0.00405 0.01338 -0.00421 C3 1 0.345431 0.444016 0.328630 11.00000 0.04946 0.03830 = 0.02892 -0.00117 0.01536 -0.00710 AFIX 43 H3 2 0.357119 0.404804 0.282557 11.00000 -1.20000 AFIX 0 C4 1 0.317818 0.521522 0.300255 11.00000 0.05053 0.04400 = 0.04073 0.00625 0.01736 -0.00632 AFIX 43 H4 2 0.308986 0.536600 0.232047 11.00000 -1.20000 AFIX 0 C5 1 0.301679 0.580803 0.368815 11.00000 0.05477 0.02791 = 0.05464 0.00734 0.01928 -0.00478 AFIX 43 H5 2 0.282421 0.634137 0.344972 11.00000 -1.20000 AFIX 0 C6 1 0.312955 0.563606 0.467958 11.00000 0.05059 0.02543 = 0.04747 -0.00407 0.02122 -0.00109 AFIX 43 H6 2 0.302770 0.603158 0.514198 11.00000 -1.20000 AFIX 0 C7 1 0.350780 0.475929 0.682890 11.00000 0.03915 0.03903 = 0.02620 -0.00946 0.01313 -0.00262 AFIX 23 H7A 2 0.393222 0.528982 0.696978 11.00000 -1.20000 H7B 2 0.395137 0.439540 0.739905 11.00000 -1.20000 AFIX 0 C8 1 0.208995 0.483458 0.673885 11.00000 0.04443 0.02974 = 0.02278 -0.00881 0.01294 -0.00663 AFIX 23 H8A 2 0.163802 0.513117 0.610439 11.00000 -1.20000 H8B 2 0.170778 0.429182 0.667347 11.00000 -1.20000 AFIX 0 C9 1 0.207448 0.614260 0.759943 11.00000 0.04132 0.02020 = 0.03706 -0.00057 0.00331 0.00278 AFIX 23 H9A 2 0.151996 0.636982 0.694345 11.00000 -1.20000 H9B 2 0.298982 0.624582 0.765783 11.00000 -1.20000 AFIX 0 C10 1 0.176011 0.654420 0.848448 11.00000 0.08738 0.03365 = 0.06500 -0.01214 0.03729 0.01389 AFIX 23 H10A 2 0.254423 0.681257 0.893671 11.00000 -1.20000 H10B 2 0.108416 0.695627 0.821458 11.00000 -1.20000 AFIX 0 C11 1 0.044860 0.509630 0.751900 11.00000 0.02412 0.04345 = 0.04618 -0.00301 0.01116 -0.00183 AFIX 23 H11A 2 0.030054 0.451273 0.753726 11.00000 -1.20000 H11B 2 -0.011436 0.530279 0.685331 11.00000 -1.20000 AFIX 0 C12 1 0.008696 0.550288 0.838388 11.00000 0.03859 0.07621 = 0.05304 -0.00343 0.02373 0.00892 PART 1 AFIX 23 H12A 2 -0.021830 0.509798 0.877762 21.00000 -1.20000 H12B 2 -0.062004 0.589285 0.809679 21.00000 -1.20000 AFIX 13 PART 2 H12 2 -0.066703 0.587331 0.811876 -21.00000 -1.20000 AFIX 0 PART 0 C13 1 0.268352 0.492200 0.862623 11.00000 0.04345 0.03071 = 0.02604 0.00273 0.01328 0.01014 AFIX 23 H13A 2 0.360378 0.503839 0.871519 11.00000 -1.20000 H13B 2 0.257841 0.433385 0.863591 11.00000 -1.20000 AFIX 0 C14 1 0.231427 0.529710 0.950779 11.00000 0.04802 0.05153 = 0.02930 -0.00614 0.01499 0.01222 PART 2 AFIX 23 H14A 2 0.197517 0.487906 0.986224 -21.00000 -1.20000 H14B 2 0.308899 0.553900 1.000768 -21.00000 -1.20000 AFIX 13 PART 1 H14 2 0.308919 0.551903 1.004461 21.00000 -1.20000 AFIX 0 PART 0 C15 1 0.129003 0.593469 0.908820 11.00000 0.05221 0.04467 = 0.04211 -0.00696 0.02191 0.01695 AFIX 13 H15 2 0.107521 0.620287 0.966086 11.00000 -1.20000 AFIX 0 N5 5 -0.046960 0.618959 0.527790 11.00000 0.15013 0.07566 = 0.06468 0.00878 -0.02259 0.02412 C16 1 -0.046536 0.684727 0.529005 11.00000 0.05318 0.08669 = 0.04183 0.01230 -0.01653 -0.00238 C17 1 -0.046179 0.770337 0.535895 11.00000 0.09356 0.08569 = 0.05781 0.01198 0.03268 -0.01091 AFIX 3 H17A 2 0.039641 0.788387 0.578515 11.00000 -1.50000 H17B 2 -0.066269 0.793587 0.467435 11.00000 -1.50000 H17C 2 -0.111289 0.787537 0.566685 11.00000 -1.50000 AFIX 0 HKLF 4 REM 1685_hxz_0m_a.res in P2(1)/c REM R1 = 0.0540 for 5231 Fo > 4sig(Fo) and 0.0753 for all 6693 data REM 266 parameters refined using 2 restraints END WGHT 0.0000 17.3433 REM Highest difference peak 0.912, deepest hole -0.914, 1-sigma level 0.174 Q1 1 0.4087 0.2389 0.7220 11.00000 0.05 0.91 Q2 1 0.5743 0.3161 0.8497 11.00000 0.05 0.82 Q3 1 0.5423 0.1445 0.6437 11.00000 0.05 0.79 Q4 1 0.0411 0.6399 0.4811 11.00000 0.05 0.77 Q5 1 0.2079 0.2388 0.7173 11.00000 0.05 0.76 Q6 1 0.6559 0.2781 0.8792 11.00000 0.05 0.74 Q7 1 0.2986 0.2201 0.8032 11.00000 0.05 0.74 Q8 1 0.2181 0.2800 0.8579 11.00000 0.05 0.72 Q9 1 0.5635 0.2273 0.7839 11.00000 0.05 0.71 Q10 1 -0.0307 0.4608 0.8973 11.00000 0.05 0.68 Q11 1 0.1941 0.2034 0.8002 11.00000 0.05 0.68 Q12 1 0.5979 0.2585 0.8837 11.00000 0.05 0.68 Q13 1 0.4778 0.2421 0.4693 11.00000 0.05 0.65 Q14 1 0.1762 0.6615 0.3585 11.00000 0.05 0.65 Q15 1 -0.0161 0.4218 0.9760 11.00000 0.05 0.64 Q16 1 -0.0267 0.4210 0.6397 11.00000 0.05 0.64 Q17 1 0.0230 0.5966 0.5156 11.00000 0.05 0.63 Q18 1 0.5981 0.2592 0.8287 11.00000 0.05 0.62 Q19 1 -0.2021 0.5877 0.7718 11.00000 0.05 0.61 Q20 1 0.1986 0.3394 0.7403 11.00000 0.05 0.61 Q21 1 0.5050 0.1856 0.5105 11.00000 0.05 0.60 Q22 1 0.3761 0.1520 0.5651 11.00000 0.05 0.59 Q23 1 0.3893 0.1973 0.3411 11.00000 0.05 0.59 Q24 1 -0.2413 0.8598 0.5233 11.00000 0.05 0.58 Q25 1 0.3408 0.2942 0.3645 11.00000 0.05 0.58 Q26 1 0.4629 0.1987 0.6588 11.00000 0.05 0.57 Q27 1 0.4005 0.4007 0.5756 11.00000 0.05 0.57 Q28 1 0.5938 0.2248 0.9014 11.00000 0.05 0.57 Q29 1 0.7048 0.2806 0.9214 11.00000 0.05 0.57 Q30 1 0.3035 0.2647 0.7236 11.00000 0.05 0.57 Q31 1 -0.0226 0.6324 0.5665 11.00000 0.05 0.57 Q32 1 0.3376 0.5234 0.4689 11.00000 0.05 0.56 Q33 1 -0.0164 0.6021 0.4599 11.00000 0.05 0.56 Q34 1 0.1763 0.1793 0.8642 11.00000 0.05 0.56 Q35 1 0.6651 0.1980 0.8913 11.00000 0.05 0.55 Q36 1 0.1551 0.4526 0.5605 11.00000 0.05 0.55 Q37 1 0.2152 0.4586 1.0895 11.00000 0.05 0.55 Q38 1 0.0001 0.7817 0.4031 11.00000 0.05 0.54 Q39 1 0.5366 0.1419 0.5605 11.00000 0.05 0.54 Q40 1 0.4166 0.6596 0.6119 11.00000 0.05 0.54 Q41 1 0.2931 0.3161 0.8206 11.00000 0.05 0.54 Q42 1 0.1959 0.2352 0.7809 11.00000 0.05 0.54 Q43 1 0.2605 0.4434 0.2936 11.00000 0.05 0.54 Q44 1 0.5097 0.2809 0.7825 11.00000 0.05 0.53 Q45 1 0.3787 0.5347 0.5802 11.00000 0.05 0.53 Q46 1 0.3767 0.1803 0.4155 11.00000 0.05 0.53 Q47 1 0.1188 0.7658 0.9402 11.00000 0.05 0.53 Q48 1 0.3854 0.2192 0.6267 11.00000 0.05 0.53 Q49 1 0.2372 0.3611 0.2751 11.00000 0.05 0.52 Q50 1 0.4229 0.3195 0.4837 11.00000 0.05 0.52 Q51 1 0.2146 0.2037 0.7512 11.00000 0.05 0.51 Q52 1 0.4071 0.3217 0.6169 11.00000 0.05 0.51 Q53 1 0.4680 0.3622 0.5342 11.00000 0.05 0.51 Q54 1 0.2938 0.2184 0.6802 11.00000 0.05 0.51 Q55 1 0.5560 0.2424 0.5834 11.00000 0.05 0.51 Q56 1 0.3446 0.2592 0.6531 11.00000 0.05 0.51 Q57 1 0.3933 0.6164 1.0005 11.00000 0.05 0.50 Q58 1 -0.2395 0.7790 0.3843 11.00000 0.05 0.50 Q59 1 0.4383 0.1516 0.5405 11.00000 0.05 0.50 Q60 1 -0.1640 0.8126 0.5782 11.00000 0.05 0.50 Q61 1 -0.2031 0.6438 0.7978 11.00000 0.05 0.50 Q62 1 0.6984 0.2727 0.8224 11.00000 0.05 0.49 Q63 1 0.2421 0.4266 1.0164 11.00000 0.05 0.49 Q64 1 -0.0805 0.5604 0.4786 11.00000 0.05 0.49 Q65 1 -0.0106 0.7056 0.6175 11.00000 0.05 0.49 Q66 1 -0.1154 0.6764 0.5993 11.00000 0.05 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11 -4 26.70 6.30 -4 -11 4 38.70 8.10 -4 11 4 26.80 3.10 4 11 -4 31.50 7.00 -4 11 4 24.50 4.70 4 11 -4 29.60 7.40 4 11 -4 30.40 8.30 -3 -11 4 331.87 22.00 -3 11 4 340.27 17.70 -3 11 4 343.77 17.30 3 11 -4 329.07 22.70 3 11 -4 326.67 21.20 3 11 -4 302.57 23.80 2 11 -4 277.47 19.50 -2 11 4 280.77 15.30 2 11 -4 282.07 21.40 2 11 -4 235.38 17.70 -1 -11 4 28.60 6.90 1 11 -4 34.30 8.00 1 11 -4 36.60 7.10 -1 11 4 28.30 4.60 1 11 -4 29.50 6.70 0 -11 4 20.10 6.00 0 11 -4 11.80 5.40 0 11 -4 16.00 4.80 0 11 4 18.50 3.90 0 11 -4 23.10 6.20 1 -11 4 21.30 5.70 -1 11 -4 5.90 3.60 -1 11 -4 6.30 4.40 1 11 4 6.20 2.80 -1 11 -4 12.10 4.40 2 -11 4 256.47 21.20 -2 11 -4 298.37 20.10 2 11 4 288.27 17.20 -2 11 -4 283.97 20.70 -3 -11 -4 332.97 18.20 3 -11 4 374.96 24.50 -3 11 -4 353.76 23.90 3 11 4 343.17 20.40 -3 11 -4 325.07 22.20 -4 -11 -4 3.80 2.80 4 -11 4 17.30 6.50 4 -11 4 3.30 4.10 -4 11 -4 10.10 4.10 4 11 4 6.60 3.70 -4 11 -4 8.30 4.50 5 -11 4 13.90 5.90 5 -11 4 10.40 5.70 -5 -11 -4 5.70 4.00 5 11 4 9.60 4.00 -5 11 -4 3.10 2.70 -5 11 -4 -0.30 2.90 -6 -11 -4 32.70 8.10 6 -11 4 37.00 9.30 6 -11 4 40.80 10.10 -6 11 -4 24.60 7.70 6 11 4 29.00 7.10 -6 11 -4 19.40 7.00 -7 -11 -4 42.20 10.20 7 -11 4 40.10 11.00 -7 11 -4 36.30 9.80 -7 11 -4 41.60 10.00 7 11 4 46.10 9.30 -8 -11 -4 101.29 16.60 8 -11 4 144.09 24.00 8 -11 4 147.09 18.10 -8 11 -4 143.89 16.80 8 11 4 115.89 14.10 -9 -11 -4 -0.70 5.90 9 -11 4 14.10 8.90 -9 11 -4 17.40 7.40 -10 -11 -4 -3.20 7.40 10 -11 4 -0.20 8.80 -10 11 -4 10.90 6.40 -11 -11 -4 17.10 9.80 11 -11 4 12.00 17.10 -11 11 -4 12.70 7.10 -12 -12 4 11.50 7.40 -12 12 4 15.40 7.70 12 12 -4 1.30 9.70 -11 -12 4 -1.50 5.10 11 12 -4 2.70 6.70 -11 12 4 -9.20 4.10 -10 -12 4 -9.00 4.60 10 12 -4 -0.70 4.00 -10 12 4 11.70 5.50 -9 -12 4 5.60 5.40 9 12 -4 -10.80 4.40 -9 12 4 4.50 3.90 9 12 -4 -3.10 5.00 8 12 -4 16.80 7.90 -8 12 4 29.10 6.50 -7 -12 4 42.70 10.30 -7 12 4 52.99 8.30 7 12 -4 41.90 10.70 -6 -12 4 8.00 5.00 -6 12 4 13.80 4.10 6 12 -4 13.70 6.00 -5 -12 4 62.39 11.40 -5 12 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9.70 -4 13 4 50.39 6.40 4 13 -4 70.39 13.50 -3 13 4 9.40 3.30 3 13 -4 9.70 5.40 3 13 -4 13.50 5.20 3 13 -4 19.00 7.30 2 13 -4 128.49 15.00 2 13 -4 125.49 13.00 -2 13 4 123.09 12.10 -2 13 4 137.69 10.80 2 13 -4 109.29 13.00 -1 13 4 347.27 19.60 1 13 -4 307.27 24.10 1 13 -4 348.37 23.10 1 13 -4 330.27 23.30 0 -13 4 435.06 27.60 0 13 -4 456.85 29.50 0 13 -4 466.05 28.10 0 13 4 412.96 24.20 0 13 4 435.06 23.70 0 13 -4 433.56 27.70 1 -13 4 190.88 17.00 1 13 4 201.58 14.30 -1 13 -4 211.18 17.30 -1 13 -4 182.08 17.10 -1 13 -4 202.48 17.90 2 -13 4 0.70 3.70 -2 13 -4 4.10 4.20 -2 13 -4 -0.80 3.60 -2 13 -4 1.10 3.60 3 -13 4 67.99 12.30 3 -13 4 93.79 12.00 -3 13 -4 94.39 11.60 -3 13 -4 92.19 11.80 3 13 4 78.09 9.20 4 -13 4 85.09 13.70 4 -13 4 103.39 14.30 4 13 4 100.49 10.70 -4 13 -4 96.09 11.90 -4 13 -4 105.69 13.20 -5 -13 -4 45.80 8.40 5 -13 4 50.19 10.50 5 -13 4 80.59 14.60 -5 13 -4 53.09 12.60 5 13 4 60.49 10.00 -5 13 -4 51.29 10.70 6 -13 4 2.50 5.50 -6 -13 -4 8.00 5.30 6 -13 4 2.60 5.80 -6 13 -4 7.90 5.20 6 13 4 7.50 5.10 -6 13 -4 8.40 5.80 7 -13 4 4.90 7.40 -7 -13 -4 9.70 5.40 -7 13 -4 0.10 4.80 -7 13 -4 -7.00 3.30 7 13 4 2.00 4.40 8 -13 4 -7.60 6.50 8 -13 4 -7.80 10.50 -8 -13 -4 32.60 10.30 -8 13 -4 7.70 5.10 9 -13 4 -4.00 9.70 9 -13 4 2.40 8.70 -9 -13 -4 14.80 9.00 -9 13 -4 5.90 5.90 10 -13 4 24.60 12.50 -10 -13 -4 3.30 10.70 -10 13 -4 1.70 6.60 -12 -14 4 14.80 10.10 -12 14 4 28.40 8.20 12 14 -4 12.10 9.80 -11 -14 4 16.80 9.30 -11 14 4 34.50 9.20 11 14 -4 19.00 9.30 -10 -14 4 17.60 7.60 10 14 -4 10.00 6.10 -10 14 4 23.40 7.20 -9 -14 4 1.60 4.50 9 14 -4 2.90 5.90 -9 14 4 8.50 4.80 -8 -14 4 3.70 5.20 -8 14 4 4.20 3.70 8 14 -4 -2.00 5.40 8 14 -4 8.70 4.90 -7 -14 4 -2.90 3.90 7 14 -4 8.10 6.50 -7 14 4 0.70 3.00 -6 -14 4 1.70 3.50 6 14 -4 0.40 6.30 -6 14 4 -2.80 2.60 -5 -14 4 3.00 5.10 -5 14 4 6.10 2.00 5 14 -4 2.10 4.50 -5 14 4 8.70 3.90 5 14 -4 18.90 7.50 -4 -14 4 36.20 8.60 4 14 -4 34.90 10.40 -4 14 4 37.80 6.80 -4 14 4 57.49 5.80 4 14 -4 37.70 8.40 4 14 -4 41.70 10.30 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33.70 8.90 -3 15 4 48.40 7.70 -3 15 4 27.20 6.20 -2 15 4 321.87 20.50 2 15 -4 314.67 23.90 2 15 -4 310.67 23.10 2 15 -4 335.07 26.80 -2 15 4 315.87 20.70 -2 15 4 333.07 20.50 -1 15 4 382.36 23.00 1 15 -4 374.26 26.30 -1 15 4 385.26 23.30 1 15 -4 355.26 27.80 1 15 -4 428.66 27.90 0 15 4 238.28 17.40 0 15 -4 252.77 21.60 0 15 -4 218.98 19.40 0 15 -4 238.18 20.00 1 -15 4 61.89 11.00 -1 15 -4 49.40 10.10 -1 15 -4 43.60 9.60 -1 15 -4 63.49 11.90 1 15 4 44.60 8.60 1 15 4 45.90 8.20 2 -15 4 2.00 4.50 -2 15 -4 5.90 4.30 -2 15 -4 16.90 6.00 -2 15 -4 9.70 5.40 2 15 4 11.40 4.90 3 -15 4 7.20 5.40 -3 15 -4 -2.60 3.40 -3 15 -4 4.70 3.80 -3 15 -4 -3.10 2.10 3 15 4 2.30 3.30 4 -15 4 16.40 7.50 -4 15 -4 5.10 5.50 -4 15 -4 16.60 6.60 4 15 4 8.70 5.50 5 -15 4 5.90 5.20 5 15 4 2.30 4.50 -5 15 -4 2.30 5.40 -5 15 -4 7.90 5.40 -6 -15 -4 21.50 6.60 6 -15 4 7.90 7.80 6 15 4 21.10 7.50 -6 15 -4 24.40 8.70 -6 15 -4 13.70 6.90 7 -15 4 11.00 8.40 -7 -15 -4 1.00 6.10 -7 15 -4 6.60 5.90 -7 15 -4 9.00 5.30 -8 -15 -4 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445.46 28.00 -1 7 7 461.75 19.30 1 7 -7 499.35 26.40 -1 7 7 441.56 24.40 1 7 -7 480.45 26.10 1 7 -7 409.66 27.40 0 -7 7 1273.37 58.89 0 -7 7 1226.68 55.79 0 7 7 1187.58 48.70 0 7 -7 1209.58 55.39 0 7 7 1242.78 55.19 0 7 -7 1084.99 56.89 0 7 -7 1169.18 54.49 1 -7 7 1917.71 82.59 1 -7 7 1952.60 87.49 1 7 7 2009.70 76.79 -1 7 -7 1914.91 88.09 1 7 7 1793.62 82.49 -1 7 -7 1852.01 81.39 -1 7 -7 1840.42 84.79 2 -7 7 165.28 14.20 2 -7 7 144.89 14.60 2 7 7 141.29 14.20 -2 7 -7 129.29 12.70 2 7 7 156.98 11.00 -2 7 -7 145.69 15.10 3 -7 7 301.07 21.30 3 -7 7 322.87 23.60 -3 -7 -7 279.57 15.60 -3 7 -7 287.77 22.80 3 7 7 322.37 23.50 -3 7 -7 268.97 20.00 3 7 7 303.57 18.30 4 -7 7 122.99 13.20 4 -7 7 103.99 13.50 4 7 7 130.49 14.80 -4 7 -7 108.89 13.70 -4 7 -7 132.59 13.50 4 7 7 100.29 11.00 5 -7 7 341.37 24.80 -5 -7 -7 337.67 22.80 5 -7 7 337.77 27.00 -5 7 -7 321.67 26.30 5 7 7 343.17 22.40 -5 7 -7 352.26 24.90 5 7 7 365.36 27.60 -6 -7 -7 316.77 24.10 -6 7 -7 371.96 28.70 6 7 7 350.26 24.10 6 7 7 380.06 30.00 -6 7 -7 357.46 30.50 -7 -7 -7 6.20 5.00 7 -7 7 25.40 7.20 -7 7 -7 10.30 6.00 7 7 7 11.60 6.90 -8 -7 -7 46.10 12.50 8 -7 7 44.30 13.80 8 7 7 61.39 14.00 -8 7 -7 66.29 12.90 -9 -7 -7 11.20 8.60 -9 7 -7 -4.40 5.40 -10 -7 -7 6.40 9.80 -10 7 -7 4.20 7.50 -14 -8 7 22.80 10.90 14 8 -7 42.30 12.00 -14 8 7 22.00 9.90 -13 -8 7 -2.90 6.20 13 8 -7 0.20 7.20 -13 8 7 0.30 6.40 -12 -8 7 177.58 20.80 12 8 -7 136.89 15.80 12 8 -7 143.79 18.00 -12 8 7 182.28 17.40 -11 -8 7 221.58 22.30 11 8 -7 187.08 20.90 -11 8 7 216.58 18.10 11 8 -7 228.08 18.90 -10 -8 7 93.09 15.80 10 8 -7 115.99 29.70 -10 8 7 123.79 12.00 -9 -8 7 214.08 20.80 9 8 -7 201.88 20.10 -9 8 7 217.88 15.70 9 8 -7 218.18 17.50 -8 -8 7 78.89 12.80 8 8 -7 78.49 10.20 -8 8 7 75.69 8.10 8 8 -7 85.59 14.10 -7 -8 7 581.84 33.90 7 8 -7 529.45 30.00 7 8 -7 477.65 35.60 -7 8 7 565.34 26.30 7 8 -7 529.55 33.60 -6 -8 7 685.93 37.70 -6 8 7 669.93 29.60 6 8 -7 629.54 34.40 6 8 -7 737.23 39.10 6 8 -7 693.53 42.00 -5 -8 7 79.09 10.10 5 8 -7 64.79 12.20 5 8 -7 70.19 8.70 5 8 -7 70.69 11.40 -5 8 7 70.39 4.90 -4 -8 7 234.28 18.20 -4 -8 7 245.18 18.70 -4 8 7 272.27 11.60 4 8 -7 261.67 21.20 4 8 -7 282.67 19.70 -3 -8 7 325.17 21.50 -3 -8 7 303.97 21.00 3 8 -7 324.67 20.40 -3 8 7 328.17 16.40 3 8 -7 344.27 21.60 3 8 -7 290.07 22.70 2 8 -7 251.57 17.40 -2 8 7 251.37 15.20 2 8 -7 244.78 17.60 2 8 -7 243.18 19.60 -1 -8 7 147.19 15.20 -1 -8 7 154.08 15.90 1 8 -7 132.09 12.40 1 8 -7 144.79 12.90 -1 8 7 158.38 12.30 1 8 -7 146.89 14.60 -1 8 7 143.89 7.80 0 -8 7 55.09 9.60 0 -8 7 66.89 12.00 0 8 -7 66.79 8.70 0 8 7 76.49 5.90 0 8 -7 41.70 9.70 0 8 7 70.69 8.80 0 8 -7 51.39 10.80 1 -8 7 4.60 4.10 1 -8 7 8.80 4.30 -1 8 -7 6.80 4.80 1 8 7 1.60 1.90 -1 8 -7 4.10 3.60 -1 8 -7 0.80 3.60 1 8 7 4.70 3.70 2 -8 7 166.98 16.50 2 -8 7 174.78 15.30 -2 8 -7 181.18 15.10 2 8 7 178.78 12.20 2 8 7 165.38 18.50 -2 8 -7 168.98 16.60 -3 -8 -7 47.90 4.70 3 -8 7 46.40 9.60 3 -8 7 43.30 8.90 -3 8 -7 55.49 10.80 3 8 7 52.79 8.10 3 8 7 49.00 10.50 -3 8 -7 57.39 10.20 4 -8 7 25.10 7.60 4 -8 7 15.80 7.00 -4 -8 -7 22.00 5.30 4 8 7 21.40 5.70 -4 8 -7 18.90 7.00 4 8 7 9.10 5.70 -4 8 -7 16.40 5.80 -5 -8 -7 216.38 16.80 5 -8 7 208.48 20.80 5 8 7 206.88 21.00 5 8 7 228.38 17.30 -5 8 -7 221.98 20.90 -5 8 -7 235.08 19.30 -6 -8 -7 104.29 13.30 -6 8 -7 102.39 13.30 6 8 7 90.29 16.70 6 8 7 124.79 12.90 -6 8 -7 91.19 15.90 -7 -8 -7 1.40 4.30 7 -8 7 -4.00 6.00 7 -8 7 3.80 5.20 7 8 7 9.30 6.10 7 8 7 -0.80 6.40 -7 8 -7 0.40 4.10 8 -8 7 68.99 14.70 -8 -8 -7 34.00 10.60 -8 8 -7 26.10 9.00 -9 -8 -7 -12.20 6.60 -9 8 -7 10.20 5.40 -10 -8 -7 34.00 14.30 -10 8 -7 67.09 17.10 -13 -9 7 9.70 8.80 -13 9 7 4.80 6.10 13 9 -7 -0.40 7.80 -12 -9 7 5.70 6.60 12 9 -7 1.60 6.30 -12 9 7 5.70 4.80 -11 -9 7 21.90 8.80 11 9 -7 16.90 6.90 11 9 -7 10.70 7.80 -11 9 7 41.70 9.10 -10 -9 7 51.49 12.10 10 9 -7 67.79 13.60 10 9 -7 36.40 11.30 -10 9 7 37.30 8.20 -9 -9 7 159.18 17.80 -9 9 7 200.18 14.90 9 9 -7 188.18 19.80 -8 -9 7 19.80 6.80 8 9 -7 19.90 7.40 8 9 -7 41.00 8.50 8 9 -7 24.20 8.70 -8 9 7 28.90 5.80 -7 -9 7 156.98 16.00 7 9 -7 154.98 16.70 7 9 -7 138.09 17.90 -7 9 7 140.39 10.30 7 9 -7 125.99 12.60 -6 -9 7 34.50 7.90 6 9 -7 33.00 9.80 6 9 -7 32.30 7.10 6 9 -7 33.30 8.00 -6 9 7 36.20 4.50 -5 -9 7 272.07 20.70 -5 9 7 289.67 13.70 5 9 -7 291.77 21.70 5 9 -7 304.47 24.50 5 9 -7 287.97 19.70 -4 -9 7 767.72 41.00 -4 -9 7 818.62 41.60 4 9 -7 796.82 39.60 -4 9 7 790.92 30.90 4 9 -7 737.43 40.60 -4 9 7 795.82 30.90 4 9 -7 770.32 44.20 -3 -9 7 50.79 8.80 -3 -9 7 36.90 7.70 3 9 -7 45.10 9.70 3 9 -7 38.30 8.10 -3 9 7 47.00 5.00 3 9 -7 43.10 7.90 -2 -9 7 626.54 35.50 2 9 -7 683.53 35.50 -2 9 7 684.63 32.10 2 9 -7 651.43 38.30 2 9 -7 686.73 35.90 -1 -9 7 187.18 15.50 -1 -9 7 161.48 16.10 -1 9 7 172.38 13.50 1 9 -7 175.78 16.60 1 9 -7 187.08 15.20 1 9 -7 168.98 14.50 -1 9 7 167.68 9.30 0 -9 7 372.26 26.60 0 -9 7 392.06 25.00 0 9 -7 405.36 25.20 0 9 7 387.26 18.80 0 9 -7 364.36 26.20 0 9 -7 416.26 24.90 0 9 7 390.56 24.20 1 -9 7 998.50 49.90 1 -9 7 1019.80 52.89 -1 9 -7 1018.30 49.30 1 9 7 1008.60 43.60 -1 9 -7 1017.50 50.59 -1 9 -7 968.80 51.69 2 -9 7 28.40 7.50 2 -9 7 16.30 6.10 -2 9 -7 11.00 5.10 2 9 7 22.40 4.90 -2 9 -7 14.50 6.20 3 -9 7 357.56 25.40 3 -9 7 377.66 27.70 3 9 7 378.46 24.20 -3 9 -7 341.37 26.40 -3 9 -7 365.86 24.50 4 -9 7 55.59 12.10 4 -9 7 49.10 10.40 -4 -9 -7 45.60 6.60 -4 9 -7 54.59 10.30 -4 9 -7 44.90 10.60 4 9 7 47.00 8.30 5 -9 7 75.89 13.90 -5 -9 -7 59.89 9.10 5 9 7 53.29 12.40 -5 9 -7 72.49 12.30 -5 9 -7 71.59 13.10 5 9 7 67.79 10.40 -6 -9 -7 244.48 20.50 -6 9 -7 307.97 26.00 -6 9 -7 302.27 24.10 6 9 7 284.87 27.20 6 9 7 296.97 21.80 7 -9 7 3.10 4.50 -7 -9 -7 1.40 5.50 7 9 7 2.90 3.20 7 9 7 5.10 5.50 -7 9 -7 -4.80 3.70 8 -9 7 70.19 16.60 -8 -9 -7 81.89 15.70 -8 9 -7 68.19 14.20 -9 -9 -7 -5.60 7.70 -9 9 -7 7.50 7.40 -10 -9 -7 4.50 9.00 -10 9 -7 -2.30 6.40 -13 -10 7 -6.00 6.60 -13 10 7 -5.30 4.40 13 10 -7 -0.20 7.20 -12 -10 7 98.49 18.00 12 10 -7 72.09 15.70 -12 10 7 90.59 13.80 -11 -10 7 35.50 10.70 11 10 -7 42.50 12.50 -11 10 7 43.80 9.30 -10 -10 7 4.40 3.80 -10 10 7 8.10 4.00 10 10 -7 -2.60 4.20 10 10 -7 -2.10 3.60 -9 -10 7 36.40 10.40 -9 10 7 30.30 7.00 9 10 -7 40.10 10.10 -8 -10 7 11.30 6.00 8 10 -7 4.10 5.20 8 10 -7 6.30 5.20 -8 10 7 -2.90 2.20 8 10 -7 -0.60 2.30 -7 -10 7 411.76 28.90 7 10 -7 423.16 30.30 7 10 -7 421.66 33.10 7 10 -7 433.16 26.60 -7 10 7 429.46 22.00 -6 -10 7 262.57 21.20 6 10 -7 258.27 21.80 -6 10 7 267.87 14.40 6 10 -7 268.47 24.10 6 10 -7 270.17 19.40 5 10 -7 9.30 5.80 5 10 -7 5.40 4.00 -5 10 7 9.10 2.30 5 10 -7 7.00 4.40 -4 -10 7 87.69 11.00 -4 -10 7 76.99 9.90 -4 10 7 62.59 4.60 -4 10 7 68.29 4.00 4 10 -7 56.69 11.50 4 10 -7 67.19 10.50 4 10 -7 69.79 11.10 -3 -10 7 9.50 4.60 3 10 -7 11.70 5.40 3 10 -7 16.40 5.90 3 10 -7 20.00 6.20 -3 10 7 15.90 3.50 -2 -10 7 994.00 49.99 2 10 -7 996.10 52.89 -2 10 7 1025.90 45.60 -2 10 7 1045.60 40.80 2 10 -7 989.90 49.10 2 10 -7 997.80 49.70 -1 -10 7 651.93 36.10 -1 10 7 662.83 28.10 -1 10 7 673.33 33.80 1 10 -7 691.63 36.00 1 10 -7 626.04 35.10 1 10 -7 570.64 36.80 0 -10 7 2.20 4.40 0 -10 7 1.70 3.20 0 10 -7 -0.10 3.10 0 10 7 6.30 2.30 0 10 -7 5.10 4.20 0 10 -7 5.10 3.70 1 -10 7 8.00 5.20 1 -10 7 5.70 4.30 1 10 7 10.90 3.10 -1 10 -7 9.20 5.00 -1 10 -7 15.70 6.20 -1 10 -7 4.80 3.20 2 -10 7 12.60 6.60 2 -10 7 16.30 5.90 -2 10 -7 11.80 5.50 -2 10 -7 14.60 6.20 2 10 7 19.30 4.60 -2 10 -7 24.80 6.90 3 -10 7 372.16 27.10 3 -10 7 372.36 28.90 -3 10 -7 413.96 26.80 3 10 7 402.76 23.20 -3 10 -7 421.96 29.30 4 -10 7 186.88 19.60 -4 -10 -7 162.28 10.90 4 10 7 191.08 15.00 -4 10 -7 167.88 16.60 -4 10 -7 233.18 20.60 -5 -10 -7 41.00 7.30 -5 10 -7 33.60 8.80 5 10 7 47.70 8.90 -5 10 -7 43.70 11.10 6 -10 7 25.60 8.30 -6 -10 -7 26.70 7.30 -6 10 -7 29.80 8.40 -6 10 -7 35.10 11.20 6 10 7 26.40 7.30 -7 -10 -7 -1.00 4.60 7 -10 7 7.00 7.20 7 -10 7 1.40 6.30 -7 10 -7 0.20 5.40 7 10 7 0.10 5.00 -8 -10 -7 1.60 6.90 8 -10 7 28.50 9.80 -8 10 -7 3.00 5.90 -9 -10 -7 18.00 8.80 -9 10 -7 20.70 9.60 -10 -10 -7 17.50 11.00 -10 10 -7 26.10 10.20 -13 -11 7 -2.30 6.40 -13 11 7 7.10 6.80 -12 -11 7 14.10 8.20 -12 11 7 9.80 6.10 12 11 -7 7.00 9.30 -11 -11 7 78.79 15.80 11 11 -7 92.09 17.30 -11 11 7 82.99 12.50 -10 -11 7 11.60 7.50 -10 11 7 3.80 4.10 10 11 -7 4.50 6.30 10 11 -7 0.00 5.20 -9 -11 7 172.78 19.20 -9 11 7 195.68 15.10 9 11 -7 170.18 17.00 9 11 -7 210.58 21.20 -8 -11 7 10.20 5.00 8 11 -7 18.70 9.60 -8 11 7 15.90 4.50 8 11 -7 14.60 7.50 -7 -11 7 8.20 4.50 7 11 -7 6.30 7.10 7 11 -7 5.40 6.30 7 11 -7 -0.40 2.00 -6 -11 7 328.97 24.50 -6 11 7 313.47 16.60 6 11 -7 323.17 27.90 6 11 -7 273.97 23.70 6 11 -7 308.17 22.00 -5 -11 7 7.90 4.70 -5 11 7 4.30 2.00 5 11 -7 1.90 4.70 5 11 -7 1.20 3.60 5 11 -7 4.50 3.10 -4 -11 7 252.47 20.10 -4 11 7 244.48 11.30 -4 11 7 253.27 11.40 4 11 -7 252.47 18.90 4 11 -7 214.68 20.90 -4 11 7 267.17 12.90 4 11 -7 272.97 20.90 -3 -11 7 68.69 11.60 3 11 -7 72.69 11.30 3 11 -7 108.19 13.40 3 11 -7 70.69 11.50 -3 11 7 80.19 7.10 -2 -11 7 110.79 12.90 -2 11 7 107.69 9.80 -2 11 7 103.59 7.10 2 11 -7 98.39 13.50 2 11 -7 80.59 10.90 2 11 -7 116.99 13.10 -1 -11 7 115.39 12.60 -1 11 7 112.49 7.80 1 11 -7 98.99 11.80 1 11 -7 103.59 13.70 1 11 -7 81.49 12.80 0 -11 7 -2.80 1.70 0 -11 7 1.70 3.80 0 11 -7 0.60 3.30 0 11 7 -1.50 1.80 0 11 -7 -2.60 1.60 0 11 -7 7.40 4.40 1 -11 7 75.79 12.50 1 -11 7 101.89 13.40 -1 11 -7 78.89 12.10 -1 11 -7 70.39 12.70 1 11 7 76.19 7.60 -1 11 -7 77.49 12.30 2 -11 7 119.59 13.90 2 -11 7 122.19 15.20 2 11 7 121.29 10.40 -2 11 -7 110.69 14.00 -2 11 -7 100.29 12.40 3 -11 7 498.95 34.40 3 -11 7 699.73 41.20 -3 11 -7 662.63 39.10 -3 11 -7 585.24 35.30 3 11 7 580.04 31.30 4 -11 7 51.89 12.00 4 11 7 30.50 7.30 -4 11 -7 34.00 9.70 5 -11 7 19.70 8.50 -5 11 -7 24.90 7.90 5 11 7 25.70 6.50 -5 11 -7 30.10 8.80 6 -11 7 18.50 8.70 6 -11 7 30.20 10.30 -6 -11 -7 33.30 7.20 -6 11 -7 16.00 7.10 -6 11 -7 34.30 10.60 -7 -11 -7 28.90 8.60 7 -11 7 52.79 14.00 -7 11 -7 75.29 14.10 -7 11 -7 75.09 14.30 7 11 7 45.40 12.50 -8 -11 -7 236.98 23.40 -8 11 -7 264.57 24.50 -9 -11 -7 30.60 16.30 -9 11 -7 17.90 10.60 12 12 -7 50.29 14.70 -12 12 7 46.70 10.60 -11 -12 7 15.80 9.40 11 12 -7 23.70 9.50 -11 12 7 15.90 5.60 -10 -12 7 29.00 9.40 10 12 -7 6.10 6.90 -10 12 7 36.00 8.00 -9 -12 7 8.70 5.50 9 12 -7 7.00 5.50 9 12 -7 6.10 6.80 9 12 -7 -1.50 5.10 -9 12 7 11.80 4.60 -8 -12 7 41.60 10.50 8 12 -7 42.30 9.20 -8 12 7 46.00 7.50 8 12 -7 48.50 12.80 8 12 -7 31.20 10.20 -7 -12 7 525.75 36.20 7 12 -7 486.85 40.80 -7 12 7 605.14 28.20 -6 -12 7 251.27 22.00 6 12 -7 267.27 23.50 6 12 -7 252.37 25.30 -6 12 7 276.77 15.50 -5 -12 7 182.58 17.70 5 12 -7 196.78 18.60 5 12 -7 166.58 19.10 5 12 -7 165.58 15.40 -5 12 7 173.08 10.80 -4 -12 7 182.38 17.20 4 12 -7 172.78 16.10 -4 12 7 179.48 9.10 4 12 -7 200.18 18.20 -4 12 7 180.28 10.60 4 12 -7 193.08 20.00 -3 -12 7 97.29 12.20 -3 12 7 97.99 7.20 3 12 -7 103.09 12.70 3 12 -7 84.59 14.40 -3 12 7 106.79 8.60 3 12 -7 79.89 12.60 -2 -12 7 1216.38 60.29 2 12 -7 1200.68 62.99 2 12 -7 1224.68 59.29 2 12 -7 1194.38 59.49 -2 12 7 1265.67 50.79 -1 -12 7 694.63 40.00 -1 12 7 716.43 32.00 1 12 -7 698.53 39.00 1 12 -7 751.12 40.00 1 12 -7 698.43 42.10 0 -12 7 60.69 11.10 0 12 -7 63.69 10.60 0 12 7 47.60 5.80 0 12 -7 54.09 11.10 1 -12 7 20.90 7.70 1 -12 7 38.70 9.40 1 12 7 19.00 4.40 -1 12 -7 35.20 8.60 -1 12 -7 21.80 6.60 2 -12 7 13.00 6.30 2 -12 7 14.10 6.10 2 12 7 8.50 4.00 -2 12 -7 10.20 5.30 -2 12 -7 4.30 5.10 3 -12 7 512.75 36.10 3 12 7 542.25 29.10 -3 12 -7 474.55 36.80 -3 12 -7 568.94 36.40 -4 12 -7 476.75 33.70 4 12 7 457.85 27.50 -4 12 -7 474.35 31.40 5 -12 7 11.30 8.20 -5 -12 -7 0.90 2.40 -5 12 -7 0.80 4.40 -5 12 -7 3.40 5.00 5 12 7 8.20 4.50 6 -12 7 12.60 8.80 -6 -12 -7 -2.10 3.60 6 -12 7 9.80 7.50 -6 12 -7 11.00 6.20 -6 12 -7 6.40 5.90 6 12 7 10.90 5.50 7 -12 7 39.10 14.20 -7 -12 -7 14.00 7.10 -7 12 -7 51.09 12.40 -7 12 -7 38.60 10.70 -8 -12 -7 15.30 8.40 -8 12 -7 5.60 7.70 -9 12 -7 52.09 13.00 -12 -13 7 3.80 7.60 -12 13 7 12.10 6.90 12 13 -7 9.90 10.40 -11 -13 7 72.19 15.80 -11 13 7 81.09 18.60 11 13 -7 69.09 16.70 -10 -13 7 1.10 6.60 10 13 -7 7.20 4.80 -10 13 7 -4.90 3.70 10 13 -7 -0.90 5.90 -9 -13 7 50.59 12.80 9 13 -7 91.19 18.60 -9 13 7 83.39 9.80 9 13 -7 62.49 14.10 -8 -13 7 3.00 5.20 -8 13 7 5.50 3.10 8 13 -7 8.80 7.20 8 13 -7 9.50 6.30 8 13 -7 3.80 6.30 -7 -13 7 31.60 9.70 -7 13 7 41.10 6.70 7 13 -7 38.70 9.50 7 13 -7 47.60 12.00 7 13 -7 23.30 9.90 -6 -13 7 189.68 23.40 6 13 -7 261.37 25.80 6 13 -7 235.08 26.50 -6 13 7 236.88 16.40 -5 -13 7 8.20 5.20 5 13 -7 21.20 8.00 5 13 -7 8.50 5.50 -5 13 7 17.90 4.00 -4 13 7 62.49 6.10 -4 13 7 64.49 4.80 4 13 -7 65.39 13.30 4 13 -7 53.99 11.20 -3 -13 7 51.09 10.70 -3 13 7 57.89 6.60 3 13 -7 57.89 11.20 3 13 -7 54.89 12.30 -3 13 7 67.09 6.50 -3 13 7 60.99 6.20 -2 -13 7 22.40 7.40 2 13 -7 38.70 9.50 2 13 -7 44.40 11.10 -2 13 7 26.50 4.70 -1 -13 7 153.98 16.10 1 13 -7 137.59 16.40 1 13 -7 142.99 15.00 -1 13 7 146.59 10.50 0 -13 7 39.30 9.20 0 13 -7 38.20 9.60 0 13 7 32.50 5.70 0 13 -7 32.40 7.90 1 -13 7 11.90 5.50 -1 13 -7 17.50 6.40 -1 13 -7 15.50 6.70 1 13 7 22.60 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18.70 3.80 0 9 9 25.60 7.10 0 9 -9 14.30 6.70 1 -9 9 26.60 8.50 1 9 9 22.10 7.00 -1 9 -9 21.60 6.80 1 9 9 25.80 5.20 -1 9 -9 23.90 6.90 -1 9 -9 17.20 7.00 2 9 9 587.04 37.00 -2 9 -9 572.84 34.90 -2 9 -9 658.53 40.10 2 9 9 610.74 30.70 -2 9 -9 553.64 35.70 -3 9 -9 1117.99 54.49 3 9 9 1022.00 56.59 3 9 9 986.60 48.50 -3 9 -9 1018.00 57.29 4 -9 9 84.09 17.30 4 -9 9 81.99 17.60 4 9 9 95.89 11.40 4 9 9 80.09 15.50 -4 9 -9 91.29 19.00 -4 9 -9 107.09 15.80 5 -9 9 3.00 6.20 5 -9 9 12.60 7.90 -5 -9 -9 18.80 6.20 5 9 9 11.60 7.80 5 9 9 11.00 5.70 -5 9 -9 21.80 7.40 -5 9 -9 14.00 6.50 6 -9 9 -0.30 6.90 -6 -9 -9 9.50 5.20 -6 9 -9 29.20 8.80 6 9 9 -0.40 4.20 -6 9 -9 19.30 8.70 -7 -9 -9 73.09 12.40 -7 9 -9 131.69 16.20 -8 -9 -9 115.39 18.10 -8 9 -9 110.19 18.60 -9 -9 -9 0.00 9.90 -9 9 -9 7.20 7.40 -13 -10 9 24.00 9.10 13 10 -9 16.70 9.60 -13 10 9 -6.30 6.00 13 10 -9 -8.00 7.00 -12 -10 9 102.49 19.60 12 10 -9 74.09 17.10 12 10 -9 102.79 18.10 -11 -10 9 29.20 10.70 11 10 -9 9.40 6.80 -11 10 9 30.70 7.50 11 10 -9 6.90 9.70 11 10 -9 31.80 10.10 -10 -10 9 41.50 11.80 10 10 -9 44.50 10.40 -10 10 9 41.20 7.50 10 10 -9 37.80 12.50 10 10 -9 43.10 11.90 -9 -10 9 10.40 6.60 9 10 -9 11.80 7.50 9 10 -9 9.60 6.70 -9 10 9 19.80 4.90 9 10 -9 12.30 5.80 -8 -10 9 10.30 5.60 8 10 -9 11.30 6.80 -8 10 9 10.10 5.40 8 10 -9 13.00 7.00 -7 -10 9 313.57 28.80 7 10 -9 289.17 27.40 7 10 -9 316.97 25.20 -7 10 9 280.77 15.60 -6 -10 9 19.70 6.80 6 10 -9 10.10 7.20 6 10 -9 25.40 6.90 -6 10 9 25.00 3.20 6 10 -9 26.90 7.80 -5 -10 9 211.78 19.10 -5 10 9 246.78 10.50 5 10 -9 231.48 22.40 5 10 -9 193.18 18.50 5 10 -9 260.67 19.20 -4 -10 9 41.60 9.20 -4 10 9 39.30 4.40 4 10 -9 32.90 9.50 4 10 -9 42.00 8.80 4 10 -9 37.80 9.10 -3 10 9 10.50 3.40 3 10 -9 15.00 6.30 3 10 -9 3.40 4.90 3 10 -9 13.60 4.90 -2 10 9 122.69 11.30 -2 10 9 125.29 7.20 2 10 -9 133.79 13.60 2 10 -9 120.49 12.90 2 10 -9 121.59 15.10 -1 -10 9 38.50 9.70 1 10 -9 34.80 9.20 -1 10 9 41.00 4.50 1 10 -9 50.59 9.80 1 10 -9 39.50 8.60 -1 10 9 52.29 9.10 0 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21.30 -9 -11 9 80.49 14.80 -9 11 9 98.39 9.60 9 11 -9 92.99 16.70 9 11 -9 99.99 13.20 9 11 -9 88.89 18.40 -8 -11 9 62.09 12.80 -8 11 9 75.89 7.60 8 11 -9 75.09 14.70 8 11 -9 62.09 11.10 8 11 -9 55.89 13.30 -7 -11 9 314.07 25.50 -7 11 9 332.07 17.40 7 11 -9 362.76 30.90 7 11 -9 335.97 28.10 -6 -11 9 55.19 13.50 6 11 -9 80.59 13.70 6 11 -9 78.39 15.30 -6 11 9 84.69 6.10 -5 -11 9 158.28 16.40 5 11 -9 139.79 17.40 5 11 -9 143.99 15.90 5 11 -9 168.48 15.40 -5 11 9 153.48 8.00 4 11 -9 221.08 19.40 4 11 -9 201.38 21.30 4 11 -9 220.98 18.10 -4 11 9 198.68 11.50 3 11 -9 143.49 17.20 3 11 -9 153.38 15.70 3 11 -9 155.48 14.80 -3 11 9 152.08 7.70 -3 11 9 132.69 10.90 2 11 -9 545.85 33.30 -2 11 9 585.74 30.10 2 11 -9 538.85 36.50 2 11 -9 552.14 33.00 -2 11 9 520.25 23.70 -1 -11 9 2.30 4.20 -1 11 9 12.00 4.80 1 11 -9 3.70 3.50 1 11 -9 10.00 5.70 1 11 -9 14.80 6.00 -1 11 9 9.90 2.80 0 -11 9 -1.60 3.50 0 11 -9 5.10 5.20 0 11 9 1.40 4.00 0 11 -9 8.50 4.90 0 11 -9 1.00 2.60 0 11 9 7.50 3.00 1 11 9 64.79 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36.20 8.20 -1 5 -14 28.30 10.20 -1 5 -14 41.60 9.90 1 5 14 53.99 12.40 1 5 14 20.60 6.50 2 5 14 39.80 8.50 2 5 14 24.70 9.80 -2 5 -14 39.80 9.70 -2 5 -14 34.70 12.00 -2 5 -14 12.00 6.50 -3 5 -14 -1.80 6.00 3 5 14 13.50 6.00 -3 5 -14 -0.70 7.50 -4 5 -14 146.89 19.10 -4 5 -14 108.29 17.60 -5 5 -14 46.10 12.70 -12 -6 14 -1.90 6.90 12 6 -14 3.20 7.80 12 6 -14 4.40 6.60 12 6 -14 13.80 8.50 -11 -6 14 13.90 7.40 -11 6 14 10.90 4.90 11 6 -14 14.60 6.30 11 6 -14 -1.30 6.10 11 6 -14 11.70 9.00 -10 -6 14 62.69 12.60 10 6 -14 58.59 15.00 10 6 -14 34.30 9.20 10 6 -14 53.99 9.30 -10 6 14 53.59 9.60 -9 -6 14 13.30 6.70 9 6 -14 9.00 6.90 9 6 -14 6.80 5.40 9 6 -14 14.70 5.30 -9 6 14 20.20 5.10 -8 -6 14 56.19 11.60 8 6 -14 53.69 9.90 -8 6 14 67.19 8.10 8 6 -14 71.79 15.20 -7 -6 14 -3.50 4.80 -7 -6 14 6.00 5.10 7 6 -14 2.50 4.50 -7 6 14 0.40 2.70 -7 6 14 3.90 3.20 7 6 -14 -3.50 5.10 -6 -6 14 -2.50 3.30 6 6 -14 9.30 4.90 -6 6 14 9.10 3.30 6 6 -14 -0.40 4.80 -6 6 14 0.00 2.40 -5 -6 14 74.99 15.40 -5 6 14 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16.50 -4 6 -14 91.19 16.80 -4 6 -14 94.09 19.60 -5 6 -14 6.50 8.80 12 7 -14 6.10 9.50 12 7 -14 7.30 9.40 -12 7 14 2.10 6.30 -11 -7 14 21.30 8.80 11 7 -14 35.20 12.80 -11 7 14 22.60 6.70 11 7 -14 16.20 7.80 11 7 -14 15.50 8.40 -10 -7 14 11.70 6.90 10 7 -14 12.20 6.30 10 7 -14 12.80 7.00 10 7 -14 21.00 9.80 -10 7 14 18.40 5.80 -9 -7 14 10.10 5.70 9 7 -14 2.70 5.00 -9 7 14 12.30 4.30 9 7 -14 17.60 7.90 9 7 -14 6.70 5.30 -8 -7 14 7.20 5.20 8 7 -14 11.00 6.50 8 7 -14 9.40 4.70 8 7 -14 2.00 4.80 -8 7 14 1.60 3.00 -7 -7 14 2.10 5.80 -7 -7 14 7.50 5.00 7 7 -14 13.40 5.10 7 7 -14 9.90 5.60 7 7 -14 4.50 7.20 -7 7 14 8.40 3.10 -6 -7 14 117.79 14.50 -6 -7 14 117.79 14.90 6 7 -14 98.89 18.30 6 7 -14 108.19 13.20 -6 7 14 102.79 8.80 -6 7 14 113.39 8.90 6 7 -14 111.09 11.50 -5 -7 14 35.10 8.70 -5 7 14 22.00 6.00 5 7 -14 12.70 5.80 5 7 -14 20.20 9.50 -5 7 14 23.60 4.40 5 7 -14 33.70 7.30 -4 -7 14 32.00 9.30 -4 -7 14 19.60 7.30 4 7 -14 14.60 8.60 -4 7 14 27.30 6.90 4 7 -14 27.50 7.70 -4 7 14 18.90 4.40 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5.80 8.80 10 8 -14 0.70 10.10 -9 -8 14 19.20 7.40 9 8 -14 2.40 5.90 9 8 -14 -2.20 6.10 -9 8 14 -0.90 3.40 9 8 -14 10.00 5.90 -8 -8 14 15.90 7.10 8 8 -14 7.30 5.70 8 8 -14 3.20 5.30 8 8 -14 11.10 8.00 -7 -8 14 136.69 16.00 7 8 -14 103.79 19.80 7 8 -14 107.49 12.70 7 8 -14 139.19 15.50 -7 8 14 110.99 9.00 -6 -8 14 71.39 13.70 -6 -8 14 66.19 13.10 -6 8 14 77.09 6.90 -6 8 14 84.69 7.10 6 8 -14 74.89 16.40 6 8 -14 62.89 11.90 6 8 -14 83.89 12.00 -5 -8 14 2.30 4.80 5 8 -14 -6.90 4.30 5 8 -14 4.90 6.40 -5 8 14 4.30 3.40 -5 8 14 4.50 2.40 5 8 -14 6.40 4.70 -4 -8 14 19.00 7.60 4 8 -14 27.20 8.30 -4 8 14 21.60 4.10 4 8 -14 15.20 9.10 4 8 -14 27.70 7.40 -3 -8 14 29.70 9.40 -3 -8 14 47.80 10.70 3 8 -14 43.60 9.20 3 8 -14 24.40 9.40 -3 8 14 28.50 5.10 -3 8 14 27.60 7.60 3 8 -14 36.40 9.60 -2 -8 14 28.90 8.50 -2 -8 14 35.50 11.00 2 8 -14 50.49 10.30 -2 8 14 53.49 11.20 -2 8 14 41.00 6.50 2 8 -14 44.40 12.40 2 8 -14 59.49 11.10 -1 -8 14 93.09 18.00 1 8 -14 75.19 16.20 -1 8 14 99.19 11.20 -1 8 14 103.59 15.80 1 8 -14 114.89 16.70 0 8 -14 3.90 4.30 0 8 -14 2.10 4.80 0 8 14 1.50 3.60 0 8 14 0.80 6.50 -1 8 -14 19.20 8.70 1 8 14 30.10 6.70 1 8 14 34.80 9.90 -1 8 -14 40.70 12.40 -2 8 -14 30.70 10.30 -2 8 -14 46.60 12.90 2 8 14 35.40 8.30 -2 8 -14 30.50 10.30 -3 8 -14 14.00 7.40 3 8 14 4.10 7.10 -3 8 -14 17.20 8.00 -4 8 -14 27.60 12.40 -4 8 -14 22.10 9.40 -11 9 14 46.70 8.40 11 9 -14 62.79 14.40 11 9 -14 30.10 14.00 11 9 -14 32.20 9.50 -10 -9 14 21.40 9.70 10 9 -14 28.30 9.90 10 9 -14 30.40 13.10 10 9 -14 3.40 6.90 -10 9 14 16.40 5.70 -9 -9 14 6.70 6.10 9 9 -14 17.10 10.20 9 9 -14 20.20 8.80 -9 9 14 13.80 4.30 -8 -9 14 192.78 20.40 -8 9 14 167.28 11.60 8 9 -14 122.59 22.10 -7 -9 14 52.19 12.00 7 9 -14 47.30 12.90 -7 9 14 52.09 5.80 7 9 -14 56.89 12.70 6 9 -14 0.30 5.80 6 9 -14 18.90 9.60 -6 9 14 12.10 3.30 -6 9 14 17.40 3.50 6 9 -14 20.30 8.20 5 9 -14 10.80 6.70 -5 9 14 20.50 3.60 5 9 -14 15.10 6.40 5 9 -14 7.90 5.50 -5 9 14 20.00 5.10 4 9 -14 18.80 8.30 4 9 -14 19.50 7.20 -4 9 14 22.80 3.90 4 9 -14 5.90 5.20 -4 9 14 13.80 5.10 -3 9 14 166.08 11.30 3 9 -14 214.68 24.70 -3 9 14 170.08 16.60 3 9 -14 222.58 19.60 -2 9 14 153.38 11.30 2 9 -14 167.48 22.20 -2 9 14 145.89 15.90 -1 9 14 13.50 6.40 1 9 -14 9.40 8.10 1 9 -14 2.50 6.00 -1 9 14 9.70 6.60 0 9 14 0.20 3.20 0 9 -14 -4.70 5.40 0 9 14 -1.80 5.00 0 9 -14 16.20 7.30 1 9 14 8.40 4.60 -1 9 -14 7.30 5.70 -1 9 -14 7.10 6.30 1 9 14 13.00 6.90 -1 9 -14 8.00 6.80 -2 9 -14 19.20 9.10 -2 9 -14 31.50 11.70 2 9 14 31.50 8.80 -2 9 -14 28.90 10.70 -3 9 -14 73.09 14.80 3 9 14 81.49 13.20 -3 9 -14 65.49 15.60 -4 9 -14 -0.50 10.50 -4 9 -14 5.40 8.20 -11 -10 14 17.10 10.40 -11 10 14 3.40 5.90 11 10 -14 19.60 9.40 11 10 -14 8.60 9.90 11 10 -14 3.00 10.50 -10 -10 14 -12.60 4.30 10 10 -14 -1.60 7.30 10 10 -14 2.10 8.50 -10 10 14 7.90 4.40 10 10 -14 2.00 7.40 -9 -10 14 -8.00 5.60 9 10 -14 5.40 9.20 9 10 -14 -7.70 5.90 -9 10 14 4.20 3.10 9 10 -14 -1.00 5.70 -8 -10 14 37.10 11.20 8 10 -14 29.70 10.80 -8 10 14 29.00 4.90 8 10 -14 6.30 8.10 -7 -10 14 112.19 18.00 7 10 -14 92.49 19.70 -7 10 14 122.09 8.00 7 10 -14 71.89 15.40 7 10 -14 106.09 16.90 6 10 -14 102.99 16.90 -6 10 14 132.39 7.90 6 10 -14 120.39 21.90 -6 10 14 110.19 7.40 5 10 -14 32.30 11.00 -5 10 14 36.40 3.90 5 10 -14 29.90 8.70 -5 10 14 38.00 6.70 4 10 -14 40.10 12.80 -4 10 14 38.50 4.10 -4 10 14 30.70 7.10 4 10 -14 39.10 9.80 3 10 -14 10.40 6.80 -3 10 14 12.00 3.30 3 10 -14 0.20 5.60 -3 10 14 2.50 4.90 3 10 -14 3.70 6.90 2 10 -14 67.99 13.00 -2 10 14 48.10 6.90 -2 10 14 70.99 12.20 2 10 -14 44.90 13.10 1 10 -14 57.49 11.90 1 10 -14 39.30 11.90 -1 10 14 53.29 11.10 1 10 -14 60.69 12.50 0 10 -14 8.70 7.40 0 10 -14 26.90 9.00 0 10 14 37.10 15.10 0 10 -14 19.60 9.30 0 10 14 22.30 5.50 -1 10 -14 34.90 10.00 -1 10 -14 11.00 8.30 1 10 14 44.70 10.90 1 10 14 35.50 7.50 -2 10 -14 64.09 17.10 -2 10 -14 55.09 12.60 -3 10 -14 5.00 7.90 3 10 14 -5.30 6.30 -3 10 -14 16.50 12.60 -4 10 -14 -3.20 6.00 -4 10 -14 -16.10 7.30 -10 -11 14 8.50 7.90 10 11 -14 22.80 11.00 -10 11 14 19.00 5.70 10 11 -14 15.40 9.00 -9 -11 14 17.80 8.30 9 11 -14 30.10 12.00 9 11 -14 29.70 9.20 9 11 -14 16.50 8.00 -8 -11 14 53.59 13.10 8 11 -14 34.60 12.80 -8 11 14 53.49 5.90 8 11 -14 49.20 12.60 8 11 -14 40.90 10.80 -7 -11 14 44.70 11.30 -7 11 14 48.50 4.50 7 11 -14 46.20 14.00 7 11 -14 44.80 11.80 7 11 -14 47.50 9.70 6 11 -14 0.80 5.00 6 11 -14 14.20 8.10 6 11 -14 -1.10 7.40 -5 11 14 10.90 2.00 5 11 -14 1.30 6.70 5 11 -14 18.50 8.10 5 11 -14 18.10 8.60 -5 11 14 7.50 3.70 4 11 -14 9.30 8.30 4 11 -14 16.20 7.70 4 11 -14 17.00 6.60 -4 11 14 11.00 4.90 -4 11 14 10.70 2.50 -3 11 14 111.99 8.50 -3 11 14 111.69 13.30 3 11 -14 128.99 21.70 3 11 -14 117.49 17.00 3 11 -14 127.19 16.50 -2 11 14 142.99 16.60 -2 11 14 177.58 12.20 2 11 -14 206.38 20.10 2 11 -14 178.98 22.70 2 11 -14 194.78 20.40 1 11 -14 37.80 10.90 1 11 -14 30.30 10.30 -1 11 14 17.10 8.60 -1 11 14 20.10 6.40 1 11 -14 28.60 9.70 0 11 14 9.00 7.20 0 11 -14 16.10 9.00 0 11 14 11.90 4.70 0 11 -14 11.40 7.10 -1 11 -14 -1.00 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304.97 30.70 -1 8 15 254.47 23.70 1 8 -15 337.57 26.40 0 8 -15 20.30 8.70 0 8 15 20.90 8.90 0 8 -15 36.60 12.40 0 8 15 29.50 6.70 0 8 -15 25.10 9.50 -1 8 -15 10.00 6.50 1 8 15 8.90 5.40 -1 8 -15 13.60 7.70 -1 8 -15 0.30 5.70 -2 8 -15 15.70 8.30 -2 8 -15 11.00 8.30 -2 8 -15 3.20 8.00 2 8 15 -0.10 6.50 -3 8 -15 54.79 13.00 -3 8 -15 59.19 15.60 10 9 -15 0.10 8.00 10 9 -15 -11.60 8.70 -10 9 15 3.60 4.60 -9 -9 15 68.29 15.10 9 9 -15 40.80 14.30 -9 9 15 66.89 7.90 9 9 -15 43.30 10.70 -8 -9 15 15.50 8.20 -8 9 15 22.00 4.80 8 9 -15 34.90 12.40 -7 -9 15 1.00 5.10 7 9 -15 21.10 8.10 7 9 -15 -6.30 3.90 -7 9 15 4.60 3.00 7 9 -15 23.40 10.70 6 9 -15 155.48 17.70 6 9 -15 168.38 22.40 -6 9 15 148.29 10.10 -5 9 15 10.50 3.10 5 9 -15 20.10 8.60 5 9 -15 14.80 7.60 5 9 -15 -3.70 4.10 -5 9 15 24.00 6.20 -4 9 15 62.99 6.90 4 9 -15 79.29 18.10 -4 9 15 56.49 9.70 3 9 -15 35.60 9.10 -3 9 15 27.60 5.10 -3 9 15 39.50 8.60 3 9 -15 20.00 10.40 2 9 -15 4.20 6.40 2 9 -15 -0.50 5.60 -2 9 15 -6.00 5.70 -1 9 15 75.69 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-5 3 18 -13.30 4.70 4 3 -18 60.69 16.30 -4 3 18 64.99 13.00 -4 3 18 78.39 15.60 -3 3 18 -8.30 4.90 3 3 -18 1.70 8.10 2 3 -18 88.59 20.20 -2 3 18 86.39 12.90 0 3 -18 -10.00 6.90 -8 4 18 9.80 6.20 -8 4 18 30.50 9.00 8 4 -18 33.30 13.10 -7 4 18 70.99 10.80 7 4 -18 57.69 16.70 -6 4 18 17.50 6.60 -6 4 18 -5.50 5.80 6 4 -18 1.70 7.60 -5 4 18 27.90 9.60 5 4 -18 63.29 17.70 -5 4 18 51.59 9.30 4 4 -18 42.10 13.40 -4 4 18 49.70 13.20 -4 4 18 61.99 11.10 3 4 -18 52.89 15.00 -2 4 18 29.60 9.30 2 4 -18 48.90 15.20 1 4 -18 11.40 9.50 1 4 -18 12.70 5.00 1 4 -18 10.70 7.50 8 5 -18 4.20 10.80 7 5 -18 18.60 8.80 6 5 -18 14.30 11.40 -6 5 18 25.60 8.30 -6 5 18 24.00 7.00 -5 5 18 0.20 10.80 5 5 -18 5.60 8.10 -5 5 18 1.70 5.80 4 5 -18 20.70 10.70 4 5 -18 6.40 3.50 -4 5 18 -4.80 5.40 -4 5 18 2.60 7.00 -3 5 18 46.50 8.70 3 5 -18 38.20 13.50 -2 5 18 29.40 8.60 2 5 -18 39.30 8.70 1 5 -18 6.70 7.40 1 5 -18 -0.10 6.80 1 5 -18 -7.10 7.20 -7 6 18 46.40 8.30 7 6 -18 26.10 12.50 6 6 -18 9.20 3.70 -6 6 18 -1.30 6.20 -6 6 18 -0.10 5.90 6 6 -18 9.10 11.20 5 6 -18 32.90 14.10 5 6 -18 20.90 8.10 -5 6 18 31.00 8.40 5 6 -18 31.20 6.40 -5 6 18 41.40 11.30 4 6 -18 23.30 6.60 4 6 -18 15.20 7.30 -4 6 18 26.60 7.20 -4 6 18 46.50 10.10 4 6 -18 23.90 10.90 3 6 -18 5.00 5.90 -3 6 18 -5.80 5.60 3 6 -18 3.30 6.90 -2 6 18 45.30 11.20 2 6 -18 54.49 16.40 2 6 -18 48.50 10.90 7 7 -18 -0.30 5.00 7 7 -18 19.90 12.20 -7 7 18 -9.20 5.30 7 7 -18 -6.30 6.20 -6 7 18 5.60 5.90 6 7 -18 1.50 5.50 6 7 -18 0.80 6.70 6 7 -18 -1.40 11.50 -6 7 18 -6.40 5.80 -5 7 18 12.60 7.50 5 7 -18 6.20 12.40 5 7 -18 -1.80 6.50 -5 7 18 -4.20 5.20 4 7 -18 10.30 8.00 -4 7 18 18.10 6.70 4 7 -18 18.80 8.80 -3 7 18 -7.30 9.30 3 7 -18 0.60 7.10 -3 7 18 5.20 6.10 3 7 -18 -1.70 6.80 3 7 -18 -6.70 8.20 5 8 -18 73.59 18.40 -5 8 18 40.00 10.30 -5 8 18 55.09 8.70 5 8 -18 30.00 9.20 5 8 -18 29.60 10.50 4 8 -18 -14.30 8.00 -4 8 18 -4.30 4.80 4 8 -18 -10.10 7.90 -4 8 18 -10.00 7.20 4 8 -18 -4.90 7.60 6 0 -19 3.80 9.80 5 0 -19 14.70 8.90 4 0 -19 3.70 11.00 3 0 -19 -18.00 8.20 6 -1 -19 20.70 12.90 6 1 -19 5.80 9.20 5 -1 -19 16.20 11.90 5 1 -19 9.60 10.80 4 -1 -19 -4.90 10.30 4 1 -19 -11.30 7.10 3 1 -19 6.30 9.80 6 -2 -19 8.80 11.10 -6 2 19 13.80 8.50 6 2 -19 34.00 11.90 5 2 -19 66.29 17.60 -5 2 19 73.19 14.90 4 2 -19 31.80 12.30 -5 3 19 -20.00 7.00 5 3 -19 -2.90 8.60 -4 3 19 4.70 7.30 4 3 -19 -4.90 8.50 0 0 0 0.00 0.00 _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' ; _shelx_hkl_checksum 76269 _olex2_submission_special_instructions 'No special instructions were received' 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' 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 I1 I 0.42733(5) 0.14757(3) 0.57814(4) 0.03816(14) Uani 1 1 d . . . . . I2 I 0.61220(5) 0.27886(3) 0.85497(4) 0.03845(14) Uani 1 1 d . . . . . I3 I 0.20773(5) 0.26705(3) 0.75455(4) 0.03610(13) Uani 1 1 d . . . . . Cu1 Cu 0.41108(11) 0.27373(6) 0.68698(7) 0.0448(3) Uani 1 1 d . . . . . Cu2 Cu 0.41654(11) 0.24543(6) 0.42496(7) 0.0427(2) Uani 1 1 d . . . . . O1A O 0.1696(12) 0.4671(7) 0.9915(9) 0.057(4) Uani 0.504(14) 1 d D . P A 1 H1A H 0.108139 0.447333 0.944096 0.085 Uiso 0.504(14) 1 calc R U P A 1 O1B O -0.0235(15) 0.4802(7) 0.8897(12) 0.067(5) Uani 0.496(14) 1 d D . P A 2 H1B H -0.071858 0.494181 0.923302 0.100 Uiso 0.496(14) 1 calc R U P A 2 N1 N 0.3851(6) 0.3533(3) 0.4827(4) 0.0312(12) Uani 1 1 d . . . . . N2 N 0.3857(6) 0.3660(4) 0.5774(4) 0.0334(13) Uani 1 1 d . . . . . N3 N 0.3596(6) 0.4441(3) 0.5868(4) 0.0321(13) Uani 1 1 d . . . . . N4 N 0.1846(5) 0.5249(3) 0.7616(4) 0.0249(11) Uani 1 1 d . . . . . C1 C 0.3409(7) 0.4827(4) 0.4969(5) 0.0313(15) Uani 1 1 d . . . . . C2 C 0.3557(7) 0.4252(4) 0.4303(5) 0.0294(14) Uani 1 1 d . . . . . C3 C 0.3454(8) 0.4440(5) 0.3286(5) 0.0382(17) Uani 1 1 d . . . . . H3 H 0.357119 0.404804 0.282557 0.046 Uiso 1 1 calc R U . . . C4 C 0.3178(8) 0.5215(5) 0.3003(6) 0.0444(19) Uani 1 1 d . . . . . H4 H 0.308986 0.536600 0.232047 0.053 Uiso 1 1 calc R U . . . C5 C 0.3017(9) 0.5808(5) 0.3688(7) 0.045(2) Uani 1 1 d . . . . . H5 H 0.282421 0.634137 0.344972 0.054 Uiso 1 1 calc R U . . . C6 C 0.3130(8) 0.5636(4) 0.4680(6) 0.0398(18) Uani 1 1 d . . . . . H6 H 0.302770 0.603158 0.514198 0.048 Uiso 1 1 calc R U . . . C7 C 0.3508(7) 0.4759(5) 0.6829(5) 0.0342(16) Uani 1 1 d . . . . . H7A H 0.393222 0.528982 0.696978 0.041 Uiso 1 1 calc R U . . . H7B H 0.395137 0.439540 0.739905 0.041 Uiso 1 1 calc R U . . . C8 C 0.2090(7) 0.4835(4) 0.6739(5) 0.0318(15) Uani 1 1 d . . . . . H8A H 0.163802 0.513117 0.610439 0.038 Uiso 1 1 calc R U . . . H8B H 0.170778 0.429182 0.667347 0.038 Uiso 1 1 calc R U . . . C9 C 0.2074(8) 0.6143(4) 0.7599(5) 0.0351(16) Uani 1 1 d . . . . . H9A H 0.151996 0.636982 0.694345 0.042 Uiso 1 1 calc R U . . . H9B H 0.298982 0.624582 0.765783 0.042 Uiso 1 1 calc R U . . . C10 C 0.1760(11) 0.6544(5) 0.8484(7) 0.059(3) Uani 1 1 d . . . . . H10A H 0.254423 0.681257 0.893671 0.071 Uiso 1 1 calc R U . . . H10B H 0.108416 0.695627 0.821458 0.071 Uiso 1 1 calc R U . . . C11 C 0.0449(7) 0.5096(5) 0.7519(6) 0.0379(17) Uani 1 1 d . . . . . H11A H 0.030054 0.451273 0.753726 0.046 Uiso 1 1 calc R U . . . H11B H -0.011436 0.530279 0.685331 0.046 Uiso 1 1 calc R U . . . C12 C 0.0087(9) 0.5503(6) 0.8384(7) 0.054(2) Uani 1 1 d D . . . . H12A H -0.021830 0.509798 0.877762 0.065 Uiso 0.504(14) 1 calc R U P A 1 H12B H -0.062004 0.589285 0.809679 0.065 Uiso 0.504(14) 1 calc R U P A 1 H12 H -0.066703 0.587331 0.811876 0.065 Uiso 0.496(14) 1 calc R U P A 2 C13 C 0.2684(8) 0.4922(4) 0.8626(5) 0.0329(15) Uani 1 1 d . . . . . H13A H 0.360378 0.503839 0.871519 0.039 Uiso 1 1 calc R U . . . H13B H 0.257841 0.433385 0.863591 0.039 Uiso 1 1 calc R U . . . C14 C 0.2314(8) 0.5297(5) 0.9508(6) 0.0423(19) Uani 1 1 d D . . . . H14A H 0.197517 0.487906 0.986224 0.051 Uiso 0.496(14) 1 calc R U P A 2 H14B H 0.308899 0.553900 1.000768 0.051 Uiso 0.496(14) 1 calc R U P A 2 H14 H 0.308919 0.551903 1.004461 0.051 Uiso 0.504(14) 1 calc R U P A 1 C15 C 0.1290(9) 0.5935(5) 0.9088(6) 0.045(2) Uani 1 1 d . . . . . H15 H 0.107521 0.620287 0.966086 0.054 Uiso 1 1 calc R U . . . N5 N -0.0470(14) 0.6190(7) 0.5278(8) 0.110(5) Uani 1 1 d . . . . . C16 C -0.0465(10) 0.6847(8) 0.5290(7) 0.068(3) Uani 1 1 d . . . . . C17 C -0.0462(13) 0.7703(7) 0.5359(8) 0.077(3) Uani 1 1 d . . . . . H17A H 0.039641 0.788387 0.578515 0.116 Uiso 1 1 d R U . . . H17B H -0.066269 0.793587 0.467435 0.116 Uiso 1 1 d R U . . . H17C H -0.111289 0.787537 0.566685 0.116 Uiso 1 1 d R U . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 I1 0.0503(3) 0.0311(2) 0.0312(2) -0.00061(19) 0.0104(2) 0.0032(2) I2 0.0389(3) 0.0473(3) 0.0292(2) -0.0029(2) 0.0110(2) -0.0058(2) I3 0.0378(3) 0.0373(3) 0.0325(2) 0.00384(19) 0.0102(2) -0.0023(2) Cu1 0.0504(6) 0.0458(6) 0.0370(5) -0.0037(4) 0.0123(5) -0.0001(5) Cu2 0.0535(6) 0.0369(5) 0.0403(5) -0.0047(4) 0.0187(5) 0.0037(4) O1A 0.059(9) 0.070(9) 0.054(8) 0.018(7) 0.036(7) 0.017(7) O1B 0.071(11) 0.061(9) 0.087(11) 0.020(8) 0.052(9) 0.019(7) N1 0.042(3) 0.027(3) 0.027(3) -0.002(2) 0.015(3) 0.002(3) N2 0.039(4) 0.036(3) 0.027(3) -0.006(2) 0.013(3) -0.002(3) N3 0.041(4) 0.031(3) 0.027(3) -0.005(2) 0.014(3) 0.003(3) N4 0.027(3) 0.022(3) 0.024(3) 0.001(2) 0.006(2) 0.003(2) C1 0.026(4) 0.032(4) 0.039(4) -0.002(3) 0.016(3) -0.004(3) C2 0.029(4) 0.031(3) 0.031(3) -0.004(3) 0.013(3) -0.004(3) C3 0.049(5) 0.038(4) 0.029(3) -0.001(3) 0.015(3) -0.007(3) C4 0.051(5) 0.044(5) 0.041(4) 0.006(3) 0.017(4) -0.006(4) C5 0.055(5) 0.028(4) 0.055(5) 0.007(3) 0.019(4) -0.005(4) C6 0.051(5) 0.025(3) 0.047(4) -0.004(3) 0.021(4) -0.001(3) C7 0.039(4) 0.039(4) 0.026(3) -0.009(3) 0.013(3) -0.003(3) C8 0.044(4) 0.030(3) 0.023(3) -0.009(3) 0.013(3) -0.007(3) C9 0.041(4) 0.020(3) 0.037(4) -0.001(3) 0.003(3) 0.003(3) C10 0.087(7) 0.034(4) 0.065(6) -0.012(4) 0.037(6) 0.014(5) C11 0.024(4) 0.043(4) 0.046(4) -0.003(3) 0.011(3) -0.002(3) C12 0.039(5) 0.076(7) 0.053(5) -0.003(5) 0.024(4) 0.009(4) C13 0.043(4) 0.031(3) 0.026(3) 0.003(3) 0.013(3) 0.010(3) C14 0.048(5) 0.052(5) 0.029(4) -0.006(3) 0.015(4) 0.012(4) C15 0.052(5) 0.045(4) 0.042(4) -0.007(3) 0.022(4) 0.017(4) N5 0.150(12) 0.076(8) 0.065(6) 0.009(6) -0.023(7) 0.024(8) C16 0.053(6) 0.087(8) 0.042(5) 0.012(5) -0.017(4) -0.002(6) C17 0.094(9) 0.086(9) 0.058(6) 0.012(6) 0.033(6) -0.011(7) 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' Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' I I -0.4742 1.8119 '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' 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 Cu1 I1 Cu2 88.16(3) . . ? Cu1 I2 Cu2 77.03(4) . 4_566 ? Cu1 I3 Cu2 75.30(3) . 4_566 ? I1 Cu1 I2 109.91(4) . . ? I1 Cu1 I3 112.47(4) . . ? I2 Cu1 I3 104.08(4) . . ? N2 Cu1 I1 101.10(15) . . ? N2 Cu1 I2 119.19(17) . . ? N2 Cu1 I3 110.35(17) . . ? I1 Cu2 I3 117.21(4) . 4_565 ? I2 Cu2 I1 111.31(4) 4_565 . ? I2 Cu2 I3 102.86(3) 4_565 4_565 ? N1 Cu2 I1 101.70(16) . . ? N1 Cu2 I2 122.33(17) . 4_565 ? N1 Cu2 I3 102.00(17) . 4_565 ? C14 O1A H1A 109.5 . . ? C12 O1B H1B 109.5 . . ? N2 N1 Cu2 125.4(5) . . ? N2 N1 C2 107.7(5) . . ? C2 N1 Cu2 126.9(4) . . ? N1 N2 Cu1 123.2(5) . . ? N1 N2 N3 108.4(5) . . ? N3 N2 Cu1 128.2(4) . . ? N2 N3 C1 110.2(5) . . ? N2 N3 C7 121.1(6) . . ? C1 N3 C7 128.7(6) . . ? C8 N4 C9 111.8(5) . . ? C8 N4 C11 106.7(5) . . ? C8 N4 C13 111.9(5) . . ? C11 N4 C9 109.4(5) . . ? C13 N4 C9 108.5(5) . . ? C13 N4 C11 108.5(5) . . ? N3 C1 C2 105.4(6) . . ? N3 C1 C6 132.0(7) . . ? C2 C1 C6 122.6(7) . . ? N1 C2 C3 130.2(6) . . ? C1 C2 N1 108.2(6) . . ? C1 C2 C3 121.5(7) . . ? C2 C3 H3 121.9 . . ? C4 C3 C2 116.1(7) . . ? C4 C3 H3 121.9 . . ? C3 C4 H4 118.8 . . ? C3 C4 C5 122.4(7) . . ? C5 C4 H4 118.8 . . ? C4 C5 H5 118.9 . . ? C6 C5 C4 122.1(7) . . ? C6 C5 H5 118.9 . . ? C1 C6 H6 122.4 . . ? C5 C6 C1 115.2(7) . . ? C5 C6 H6 122.4 . . ? N3 C7 H7A 110.0 . . ? N3 C7 H7B 110.0 . . ? N3 C7 C8 108.5(6) . . ? H7A C7 H7B 108.4 . . ? C8 C7 H7A 110.0 . . ? C8 C7 H7B 110.0 . . ? N4 C8 C7 114.5(5) . . ? N4 C8 H8A 108.6 . . ? N4 C8 H8B 108.6 . . ? C7 C8 H8A 108.6 . . ? C7 C8 H8B 108.6 . . ? H8A C8 H8B 107.6 . . ? N4 C9 H9A 109.7 . . ? N4 C9 H9B 109.7 . . ? N4 C9 C10 109.9(6) . . ? H9A C9 H9B 108.2 . . ? C10 C9 H9A 109.7 . . ? C10 C9 H9B 109.7 . . ? C9 C10 H10A 109.6 . . ? C9 C10 H10B 109.6 . . ? H10A C10 H10B 108.1 . . ? C15 C10 C9 110.5(7) . . ? C15 C10 H10A 109.6 . . ? C15 C10 H10B 109.6 . . ? N4 C11 H11A 109.4 . . ? N4 C11 H11B 109.4 . . ? N4 C11 C12 111.1(6) . . ? H11A C11 H11B 108.0 . . ? C12 C11 H11A 109.4 . . ? C12 C11 H11B 109.4 . . ? O1B C12 C11 100.5(8) . . ? O1B C12 H12 112.0 . . ? O1B C12 C15 110.8(10) . . ? C11 C12 H12A 109.9 . . ? C11 C12 H12B 109.9 . . ? C11 C12 H12 112.0 . . ? C11 C12 C15 108.7(6) . . ? H12A C12 H12B 108.3 . . ? C15 C12 H12A 109.9 . . ? C15 C12 H12B 109.9 . . ? C15 C12 H12 112.0 . . ? N4 C13 H13A 109.5 . . ? N4 C13 H13B 109.5 . . ? N4 C13 C14 110.7(6) . . ? H13A C13 H13B 108.1 . . ? C14 C13 H13A 109.5 . . ? C14 C13 H13B 109.5 . . ? O1A C14 C13 106.6(7) . . ? O1A C14 H14 111.5 . . ? O1A C14 C15 106.1(8) . . ? C13 C14 H14A 109.8 . . ? C13 C14 H14B 109.8 . . ? C13 C14 H14 111.5 . . ? H14A C14 H14B 108.2 . . ? C15 C14 C13 109.4(6) . . ? C15 C14 H14A 109.8 . . ? C15 C14 H14B 109.8 . . ? C15 C14 H14 111.5 . . ? C10 C15 C12 109.8(7) . . ? C10 C15 C14 110.3(7) . . ? C10 C15 H15 110.0 . . ? C12 C15 H15 110.0 . . ? C14 C15 C12 106.6(7) . . ? C14 C15 H15 110.0 . . ? N5 C16 C17 177.0(14) . . ? C16 C17 H17A 109.2 . . ? C16 C17 H17B 109.7 . . ? C16 C17 H17C 109.5 . . ? H17A C17 H17B 109.5 . . ? H17A C17 H17C 109.5 . . ? H17B C17 H17C 109.5 . . ? 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 I1 Cu1 2.6280(11) . ? I1 Cu2 2.6470(11) . ? I2 Cu1 2.6349(12) . ? I2 Cu2 2.6393(11) 4_566 ? I3 Cu1 2.6684(12) . ? I3 Cu2 2.7085(12) 4_566 ? Cu1 N2 2.117(6) . ? Cu2 N1 2.044(6) . ? O1A H1A 0.8400 . ? O1A C14 1.453(8) . ? O1B H1B 0.8400 . ? O1B C12 1.469(9) . ? N1 N2 1.323(7) . ? N1 C2 1.386(9) . ? N2 N3 1.350(8) . ? N3 C1 1.355(9) . ? N3 C7 1.462(8) . ? N4 C8 1.492(8) . ? N4 C9 1.516(8) . ? N4 C11 1.507(9) . ? N4 C13 1.504(8) . ? C1 C2 1.375(9) . ? C1 C6 1.415(10) . ? C2 C3 1.408(9) . ? C3 H3 0.9500 . ? C3 C4 1.359(11) . ? C4 H4 0.9500 . ? C4 C5 1.420(11) . ? C5 H5 0.9500 . ? C5 C6 1.366(11) . ? C6 H6 0.9500 . ? C7 H7A 0.9900 . ? C7 H7B 0.9900 . ? C7 C8 1.515(10) . ? C8 H8A 0.9900 . ? C8 H8B 0.9900 . ? C9 H9A 0.9900 . ? C9 H9B 0.9900 . ? C9 C10 1.527(10) . ? C10 H10A 0.9900 . ? C10 H10B 0.9900 . ? C10 C15 1.506(12) . ? C11 H11A 0.9900 . ? C11 H11B 0.9900 . ? C11 C12 1.532(11) . ? C12 H12A 0.9900 . ? C12 H12B 0.9900 . ? C12 H12 1.0000 . ? C12 C15 1.540(13) . ? C13 H13A 0.9900 . ? C13 H13B 0.9900 . ? C13 C14 1.533(9) . ? C14 H14A 0.9900 . ? C14 H14B 0.9900 . ? C14 H14 1.0000 . ? C14 C15 1.518(11) . ? C15 H15 1.0000 . ? N5 C16 1.099(15) . ? C16 C17 1.434(16) . ? C17 H17A 0.9799 . ? C17 H17B 0.9802 . ? C17 H17C 0.9800 . ? 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 Cu1 N2 N3 C1 -175.4(5) . . . . ? Cu1 N2 N3 C7 2.8(10) . . . . ? Cu2 N1 N2 Cu1 -3.2(8) . . . . ? Cu2 N1 N2 N3 -179.2(5) . . . . ? Cu2 N1 C2 C1 179.4(5) . . . . ? Cu2 N1 C2 C3 -3.0(11) . . . . ? O1A C14 C15 C10 -170.2(8) . . . . ? O1A C14 C15 C12 -51.0(9) . . . . ? O1B C12 C15 C10 168.6(8) . . . . ? O1B C12 C15 C14 49.1(9) . . . . ? N1 N2 N3 C1 0.4(8) . . . . ? N1 N2 N3 C7 178.6(6) . . . . ? N1 C2 C3 C4 -178.5(8) . . . . ? N2 N1 C2 C1 1.1(8) . . . . ? N2 N1 C2 C3 178.7(7) . . . . ? N2 N3 C1 C2 0.3(8) . . . . ? N2 N3 C1 C6 -179.2(8) . . . . ? N2 N3 C7 C8 -100.6(8) . . . . ? N3 C1 C2 N1 -0.9(8) . . . . ? N3 C1 C2 C3 -178.7(7) . . . . ? N3 C1 C6 C5 179.4(8) . . . . ? N3 C7 C8 N4 -172.7(5) . . . . ? N4 C9 C10 C15 -1.3(10) . . . . ? N4 C11 C12 O1B -117.0(9) . . . . ? N4 C11 C12 C15 -0.6(9) . . . . ? N4 C13 C14 O1A 109.6(8) . . . . ? N4 C13 C14 C15 -4.7(9) . . . . ? C1 N3 C7 C8 77.2(9) . . . . ? C1 C2 C3 C4 -1.2(11) . . . . ? C2 N1 N2 Cu1 175.1(5) . . . . ? C2 N1 N2 N3 -0.9(8) . . . . ? C2 C1 C6 C5 0.0(11) . . . . ? C2 C3 C4 C5 0.8(12) . . . . ? C3 C4 C5 C6 0.0(14) . . . . ? C4 C5 C6 C1 -0.4(13) . . . . ? C6 C1 C2 N1 178.7(7) . . . . ? C6 C1 C2 C3 0.8(11) . . . . ? C7 N3 C1 C2 -177.7(7) . . . . ? C7 N3 C1 C6 2.8(13) . . . . ? C8 N4 C9 C10 177.7(7) . . . . ? C8 N4 C11 C12 -179.6(6) . . . . ? C8 N4 C13 C14 -174.2(6) . . . . ? C9 N4 C8 C7 73.6(7) . . . . ? C9 N4 C11 C12 -58.5(8) . . . . ? C9 N4 C13 C14 62.0(8) . . . . ? C9 C10 C15 C12 -58.0(10) . . . . ? C9 C10 C15 C14 59.2(10) . . . . ? C11 N4 C8 C7 -166.9(6) . . . . ? C11 N4 C9 C10 59.8(8) . . . . ? C11 N4 C13 C14 -56.7(8) . . . . ? C11 C12 C15 C10 59.0(9) . . . . ? C11 C12 C15 C14 -60.5(8) . . . . ? C13 N4 C8 C7 -48.4(8) . . . . ? C13 N4 C9 C10 -58.4(8) . . . . ? C13 N4 C11 C12 59.7(8) . . . . ? C13 C14 C15 C10 -55.5(9) . . . . ? C13 C14 C15 C12 63.6(8) . . . . ?