#------------------------------------------------------------------------------ #$Date: 2022-07-06 11:10:23 +0300 (Wed, 06 Jul 2022) $ #$Revision: 276619 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/71/04/7710423.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_7710423 loop_ _publ_author_name 'Greijer, Bj\"orn H' 'Nestor, Gustav' 'Eriksson, Jan E.' 'Seisenbaeva, Gulaim A.' 'Kessler, Vadim G.' _publ_section_title ; Factors influencing stoichiometry and stability of polyoxometalate - peptide complexes. ; _journal_issue 24 _journal_name_full 'Dalton transactions (Cambridge, England : 2003)' _journal_page_first 9511 _journal_page_last 9521 _journal_paper_doi 10.1039/d2dt00717g _journal_volume 51 _journal_year 2022 _chemical_formula_sum 'C12 H41 Mo12 N6 O56 P' _chemical_formula_weight 2347.76 _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _atom_sites_solution_hydrogens mixed _audit_creation_method SHELXL-2018/3 _audit_update_record ; 2022-02-10 deposited with the CCDC. 2022-06-07 downloaded from the CCDC. ; _cell_angle_alpha 97.8970(10) _cell_angle_beta 105.2180(10) _cell_angle_gamma 105.9070(10) _cell_formula_units_Z 2 _cell_length_a 12.7308(12) _cell_length_b 13.0510(12) _cell_length_c 18.0332(17) _cell_measurement_reflns_used 9454 _cell_measurement_temperature 296(2) _cell_measurement_theta_max 29.27 _cell_measurement_theta_min 2.26 _cell_volume 2708.8(4) _computing_cell_refinement 'Bruker SAINT' _computing_data_collection 'Bruker APEX2' _computing_data_reduction 'Bruker SAINT' _computing_molecular_graphics 'Bruker SHELXTL' _computing_publication_material 'Bruker SHELXTL' _computing_structure_refinement 'SHELXL-2018/3 (Sheldrick, 2018)' _computing_structure_solution 'SHELXS-97 (Sheldrick, 2008)' _diffrn_ambient_temperature 296(2) _diffrn_measured_fraction_theta_full 0.997 _diffrn_measured_fraction_theta_max 0.997 _diffrn_measurement_device_type 'Bruker SMART Apex-II CCD' _diffrn_measurement_method 'omega scan' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0336 _diffrn_reflns_av_unetI/netI 0.0338 _diffrn_reflns_Laue_measured_fraction_full 0.997 _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 15 _diffrn_reflns_limit_k_min -15 _diffrn_reflns_limit_l_max 21 _diffrn_reflns_limit_l_min -21 _diffrn_reflns_number 26853 _diffrn_reflns_point_group_measured_fraction_full 0.997 _diffrn_reflns_point_group_measured_fraction_max 0.997 _diffrn_reflns_theta_full 25.025 _diffrn_reflns_theta_max 25.025 _diffrn_reflns_theta_min 2.230 _diffrn_source 'sealed tube' _exptl_absorpt_coefficient_mu 2.843 _exptl_absorpt_correction_T_max 0.784 _exptl_absorpt_correction_T_min 0.454 _exptl_absorpt_correction_type empirical _exptl_absorpt_process_details 'Bruker SADABS' _exptl_crystal_colour yellow _exptl_crystal_density_diffrn 2.878 _exptl_crystal_density_meas ? _exptl_crystal_density_method 'not measured' _exptl_crystal_description plate _exptl_crystal_F_000 2244 _exptl_crystal_size_max 0.330 _exptl_crystal_size_mid 0.310 _exptl_crystal_size_min 0.090 _exptl_transmission_factor_max 0.784 _exptl_transmission_factor_min 0.454 _refine_diff_density_max 1.086 _refine_diff_density_min -0.862 _refine_diff_density_rms 0.120 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.062 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 812 _refine_ls_number_reflns 9555 _refine_ls_number_restraints 801 _refine_ls_restrained_S_all 1.040 _refine_ls_R_factor_all 0.0296 _refine_ls_R_factor_gt 0.0263 _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/[\s^2^(Fo^2^)+(0.0313P)^2^+3.9135P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0670 _refine_ls_wR_factor_ref 0.0686 _reflns_Friedel_coverage 0.000 _reflns_number_gt 8786 _reflns_number_total 9555 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d2dt00717g2.cif _cod_data_source_block GG1PMo_200709_0m _cod_depositor_comments ; The following automatic conversions were performed: data item '_exptl_absorpt_correction_type' value 'Empirical' was changed to 'empirical' in accordance with the /home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic dictionary named 'cif_core.dic' version 2.4.2 last updated on 2011-04-26. data item '_exptl_crystal_density_meas' value 'not measured' was changed to '?' -- the value is perceived as not measured. Automatic conversion script Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas Adding full bibliography for 7710422--7710427.cif. ; _cod_database_code 7710423 _shelx_shelxl_version_number 2018/3 _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_min 0.454 _shelx_estimated_absorpt_t_max 0.784 _exptl_absorpt_special_details 'Bruker SADABS' _shelx_res_file ; TITL GG1PMo_200709_0m in P-1 GG1PMo_200709_0m.res created by SHELXL-2018/3 at 13:57:59 on 29-Nov-2021 CELL 0.71073 12.7308 13.0510 18.0332 97.897 105.218 105.907 ZERR 2.00 0.0012 0.0012 0.0017 0.001 0.001 0.001 LATT 1 SFAC C H N O P MO UNIT 24 82 12 112 2 24 LIST 6 ! automatically inserted. Change 6 to 4 for CHECKCIF!! TEMP 23.000 ACTA L.S. 48 BOND $H FMAP 2 PLAN 200 OMIT 0 50.05 OMIT 2 3 1 OMIT -3 3 4 OMIT 4 -4 4 OMIT 1 -1 1 OMIT 4 -4 3 OMIT 5 -5 2 SIZE 0.33 0.31 0.09 SIMU DELU HTAB ISOR 0.001 O2C DFIX 0.92 0.01 O7D H7DA O7D H7DB WGHT 0.031300 3.913500 FVAR 0.16040 MO1 6 0.460383 0.478506 0.132589 11.00000 0.02092 0.01755 = 0.01889 -0.00009 0.00572 0.00455 MO2 6 0.515740 0.852226 0.126768 11.00000 0.02258 0.02143 = 0.02101 0.00846 0.00722 0.00747 MO3 6 0.356149 0.482712 0.288933 11.00000 0.02116 0.01740 = 0.02210 0.00480 0.00770 0.00394 MO4 6 0.642903 0.589105 0.441948 11.00000 0.02434 0.02424 = 0.01853 0.00776 0.00631 0.01079 MO5 6 0.742550 0.546455 0.286191 11.00000 0.02100 0.02126 = 0.02251 0.00480 0.00661 0.01047 MO6 6 0.779273 0.955522 0.269644 11.00000 0.02107 0.01855 = 0.02527 0.00396 0.00846 0.00259 MO7 6 0.437495 0.743379 0.433122 11.00000 0.02268 0.02109 = 0.01915 0.00393 0.00906 0.00787 MO8 6 0.285082 0.630260 0.152428 11.00000 0.01713 0.02078 = 0.02002 0.00318 0.00342 0.00523 MO9 6 0.407014 0.898977 0.296420 11.00000 0.02384 0.01876 = 0.02217 0.00457 0.00674 0.01054 MO10 6 0.856100 0.794415 0.416258 11.00000 0.01843 0.02421 = 0.02340 0.00293 0.00155 0.00696 MO11 6 0.664550 0.959063 0.438453 11.00000 0.02330 0.01680 = 0.02001 -0.00042 0.00504 0.00525 MO12 6 0.709435 0.713471 0.136852 11.00000 0.02136 0.02173 = 0.02061 0.00466 0.00985 0.00661 P13 5 0.571135 0.720260 0.283752 11.00000 0.01578 0.01437 = 0.01563 0.00256 0.00484 0.00456 O1 4 0.358994 0.615214 0.358487 11.00000 0.02460 0.02284 = 0.02190 0.00498 0.00781 0.00852 O2 4 0.379691 0.409323 0.202934 11.00000 0.02647 0.01835 = 0.02679 0.00336 0.00841 0.00494 O3 4 0.394744 0.728537 0.110307 11.00000 0.02324 0.02524 = 0.02135 0.00647 0.00738 0.00800 O4 4 0.467226 0.915411 0.056241 11.00000 0.03895 0.03314 = 0.02554 0.01521 0.01369 0.01713 O5 4 0.561394 0.680129 0.462601 11.00000 0.02426 0.02446 = 0.02077 0.00385 0.00623 0.00925 O6 4 0.377770 0.728440 0.504950 11.00000 0.03006 0.03186 = 0.02443 0.00683 0.01211 0.01297 O7 4 0.361955 0.826642 0.376962 11.00000 0.02358 0.02277 = 0.02401 0.00730 0.01029 0.01050 O8 4 0.495144 0.498414 0.359927 11.00000 0.02401 0.02157 = 0.02127 0.00497 0.00631 0.00770 O9 4 0.763778 0.642509 0.212381 11.00000 0.02252 0.02635 = 0.02679 0.00697 0.00798 0.00910 O10 4 0.601725 0.783246 0.080660 11.00000 0.02599 0.02371 = 0.01917 0.00526 0.00809 0.00814 O11 4 0.891001 1.066144 0.279969 11.00000 0.03027 0.02448 = 0.04095 0.00435 0.01271 -0.00012 O12 4 0.807696 0.851673 0.188310 11.00000 0.02070 0.02321 = 0.02700 0.00587 0.00973 0.00448 O13 4 0.721302 0.991670 0.347169 11.00000 0.02719 0.02145 = 0.02638 0.00397 0.00786 0.00659 O14 4 0.261374 0.383391 0.310024 11.00000 0.02707 0.02415 = 0.03367 0.00669 0.01050 0.00229 O15 4 0.159407 0.613071 0.084274 11.00000 0.02147 0.03378 = 0.02934 0.00575 0.00084 0.00640 O16 4 0.536398 0.796554 0.337489 11.00000 0.02115 0.01738 = 0.01668 0.00246 0.00655 0.00639 O17 4 0.871944 0.672439 0.361564 11.00000 0.01919 0.02761 = 0.03033 0.00303 0.00672 0.00793 O18 4 0.599044 0.477552 0.217190 11.00000 0.02656 0.02090 = 0.02528 0.00652 0.00759 0.00791 O19 4 0.564834 0.884405 0.484169 11.00000 0.02852 0.02172 = 0.02030 0.00048 0.00861 0.00725 O20 4 0.852022 0.872299 0.339309 11.00000 0.02166 0.02510 = 0.02744 0.00347 0.00590 0.00700 O21 4 0.621600 0.782382 0.228166 11.00000 0.02073 0.01684 = 0.01902 0.00386 0.00700 0.00565 O22 4 0.443156 0.365802 0.067843 11.00000 0.03231 0.02561 = 0.02562 -0.00306 0.00616 0.00775 O23 4 0.661645 0.679121 0.333602 11.00000 0.01972 0.01962 = 0.01974 0.00496 0.00649 0.00659 O24 4 0.817618 0.463772 0.266728 11.00000 0.03140 0.03008 = 0.03296 0.00759 0.01100 0.01859 O25 4 0.532907 0.997075 0.373851 11.00000 0.02763 0.01847 = 0.02293 0.00292 0.00736 0.00971 O26 4 0.763029 0.678396 0.065666 11.00000 0.02912 0.03558 = 0.02579 0.00562 0.01310 0.01020 O27 4 0.647349 0.519615 0.513107 11.00000 0.04126 0.03596 = 0.02761 0.01753 0.01002 0.01839 O28 4 0.563556 0.586274 0.108605 11.00000 0.02204 0.02324 = 0.02226 0.00505 0.00764 0.00587 O29 4 0.308929 0.751444 0.225181 11.00000 0.02138 0.02380 = 0.02220 0.00483 0.00646 0.00793 O30 4 0.470228 0.912491 0.214031 11.00000 0.02575 0.02084 = 0.02507 0.00561 0.00978 0.00905 O31 4 0.313361 0.968023 0.278293 11.00000 0.03331 0.02828 = 0.03461 0.01022 0.01371 0.01716 O32 4 0.708827 0.506257 0.374898 11.00000 0.02777 0.02270 = 0.02481 0.00823 0.00962 0.01375 O33 4 0.330016 0.515406 0.091394 11.00000 0.02077 0.02323 = 0.01974 0.00028 0.00402 0.00357 O34 4 0.735619 1.077386 0.505069 11.00000 0.03325 0.02176 = 0.02791 -0.00357 0.00833 0.00369 O35 4 0.766506 0.882411 0.454625 11.00000 0.02605 0.02498 = 0.02185 0.00417 0.00352 0.01008 O36 4 0.465378 0.622664 0.234792 11.00000 0.01814 0.01671 = 0.01825 0.00160 0.00442 0.00432 O37 4 0.986966 0.856887 0.481898 11.00000 0.02658 0.03360 = 0.03545 0.00293 -0.00196 0.00855 O38 4 0.667302 0.968785 0.185213 11.00000 0.02666 0.01957 = 0.02654 0.00644 0.00980 0.00555 O39 4 0.243214 0.527950 0.209201 11.00000 0.01951 0.02187 = 0.02283 0.00457 0.00517 0.00512 O40 4 0.785786 0.695998 0.478235 11.00000 0.02616 0.02747 = 0.02598 0.00704 0.00509 0.01074 O1B 4 0.688972 0.820899 0.766476 11.00000 0.04328 0.03497 = 0.03210 0.00482 0.00772 0.01639 O3B 4 0.288450 0.779529 0.726184 11.00000 0.03772 0.04287 = 0.03102 0.00073 0.00303 0.01271 O1A 4 0.085553 0.823795 0.297813 11.00000 0.06045 0.04113 = 0.03916 0.00628 0.01270 0.01672 N1A 3 0.127196 0.699153 0.399306 11.00000 0.02776 0.02527 = 0.03224 0.00022 0.00628 0.00228 AFIX 43 H1A 2 0.158460 0.768967 0.414830 11.00000 -1.20000 AFIX 0 O1C 4 0.648524 0.873381 -0.046445 11.00000 0.04836 0.05001 = 0.05860 0.03296 0.01688 0.00699 O3C 4 0.859517 1.214510 0.028915 11.00000 0.04237 0.04390 = 0.04008 -0.00260 0.02341 -0.00175 O2A 4 0.022394 0.686747 0.191945 11.00000 0.05204 0.05104 = 0.02992 0.00379 0.00756 0.01495 O2B 4 0.627512 0.787987 0.635094 11.00000 0.04628 0.06243 = 0.03251 0.00467 0.01506 0.02148 O1D 4 0.962230 0.303111 0.219470 11.00000 0.05393 0.06274 = 0.04931 0.01460 0.01026 0.01730 O3A 4 0.070407 0.540196 0.435444 11.00000 0.05752 0.02808 = 0.04536 0.00369 0.01513 0.00219 N2A 3 0.141773 0.629193 0.588669 11.00000 0.04163 0.03629 = 0.03207 0.01091 0.00133 0.00918 AFIX 33 H2A1 2 0.161756 0.666697 0.638115 11.00000 -1.50000 H2A2 2 0.070969 0.581842 0.575279 11.00000 -1.50000 H2A3 2 0.190830 0.593089 0.584797 11.00000 -1.50000 AFIX 0 C3B 1 0.372855 0.788746 0.781703 11.00000 0.03850 0.02080 = 0.03074 0.00383 0.01010 0.00753 N1B 3 0.472654 0.785394 0.773257 11.00000 0.03993 0.03963 = 0.02712 0.00880 0.00782 0.01203 AFIX 43 H1B 2 0.529512 0.794324 0.814582 11.00000 -1.20000 AFIX 0 N1C 3 0.863971 1.096236 -0.071850 11.00000 0.04027 0.03961 = 0.04425 0.00345 0.02626 0.00702 AFIX 43 H1C 2 0.903749 1.082151 -0.101384 11.00000 -1.20000 AFIX 0 C1A 1 0.062803 0.721862 0.262591 11.00000 0.02385 0.03985 = 0.03332 0.00040 0.01022 0.00519 O2D 4 -0.042038 0.460054 0.125118 11.00000 0.05947 0.05198 = 0.05785 0.00215 0.01932 0.00242 C3A 1 0.110787 0.641153 0.451889 11.00000 0.02201 0.02774 = 0.03371 0.00507 0.00859 0.00715 C1B 1 0.612906 0.795454 0.704352 11.00000 0.04386 0.01994 = 0.03271 0.00254 0.01197 0.01503 O3D 4 0.283063 0.587384 -0.063035 11.00000 0.07603 0.07482 = 0.04584 0.02307 0.02596 0.03204 N2B 3 0.263459 0.832196 0.866117 11.00000 0.04619 0.03789 = 0.03672 0.01266 0.02017 0.01111 AFIX 33 H2B1 2 0.259699 0.840950 0.915070 11.00000 -1.50000 H2B2 2 0.266892 0.894166 0.850019 11.00000 -1.50000 H2B3 2 0.201187 0.778865 0.834202 11.00000 -1.50000 AFIX 0 C4A 1 0.144670 0.704614 0.535844 11.00000 0.03430 0.02921 = 0.03419 0.01131 0.01396 0.01313 AFIX 23 H4A1 2 0.221519 0.756869 0.550569 11.00000 -1.20000 H4A2 2 0.091898 0.744706 0.540276 11.00000 -1.20000 AFIX 0 O4D 4 0.847640 0.871408 0.634618 11.00000 0.05389 0.10384 = 0.06362 0.01557 0.02273 0.02635 C2B 1 0.488090 0.767186 0.696658 11.00000 0.04068 0.03518 = 0.03064 0.00239 0.01009 0.01308 AFIX 23 H2B4 2 0.454517 0.811714 0.665241 11.00000 -1.20000 H2B5 2 0.448663 0.691057 0.669742 11.00000 -1.20000 AFIX 0 C1C 1 0.907550 1.187554 -0.017155 11.00000 0.03055 0.03333 = 0.03053 0.01103 0.01047 0.00909 C2A 1 0.094493 0.649604 0.316303 11.00000 0.02841 0.03654 = 0.02908 0.00112 0.00829 0.01058 AFIX 23 H2A4 2 0.029520 0.583228 0.303749 11.00000 -1.20000 H2A5 2 0.157924 0.629020 0.306143 11.00000 -1.20000 AFIX 0 O5D 4 1.037540 0.960142 0.196047 11.00000 0.06264 0.05714 = 0.09791 0.01655 0.05138 0.02218 C4B 1 0.367047 0.803412 0.864564 11.00000 0.04180 0.04150 = 0.03131 0.01310 0.01260 0.01272 AFIX 23 H4B1 2 0.364109 0.736245 0.882511 11.00000 -1.20000 H4B2 2 0.435186 0.860974 0.899621 11.00000 -1.20000 AFIX 0 O6D 4 0.092521 0.187388 0.162541 11.00000 0.05874 0.08875 = 0.07798 -0.00482 0.00470 0.03468 O7D 4 0.946909 0.685939 0.624952 11.00000 0.05502 0.09891 = 0.04636 0.01511 0.01436 0.02921 C4C 1 1.023085 1.259573 -0.016274 11.00000 0.03182 0.05007 = 0.05943 0.01657 0.02179 0.00304 AFIX 23 H4C1 2 1.070574 1.214759 -0.023777 11.00000 -1.20000 H4C2 2 1.012654 1.296364 -0.059555 11.00000 -1.20000 AFIX 0 C3C 1 0.751269 0.944704 -0.029049 11.00000 0.03667 0.05322 = 0.05813 0.02969 0.00791 0.01413 C2C 1 0.752725 1.019104 -0.084275 11.00000 0.04149 0.03057 = 0.03495 0.00479 0.01458 0.00583 AFIX 23 H2C1 2 0.724630 0.975398 -0.137811 11.00000 -1.20000 H2C2 2 0.700010 1.059013 -0.079186 11.00000 -1.20000 AFIX 0 N2C 3 1.080935 1.340405 0.057632 11.00000 0.04894 0.06355 = 0.09586 -0.01121 0.03368 -0.01097 AFIX 33 H2C3 2 1.148769 1.381828 0.056736 11.00000 -1.50000 H2C4 2 1.037951 1.382271 0.064190 11.00000 -1.50000 H2C5 2 1.091581 1.306712 0.097317 11.00000 -1.50000 AFIX 0 O2C 4 0.831693 0.950666 0.026622 11.00000 0.09568 0.10316 = 0.10329 0.05662 0.01688 0.02326 H1DA 2 0.963237 0.355982 0.202606 11.00000 0.07671 H1DB 2 0.985284 0.304131 0.264727 11.00000 0.11915 H1BA 2 0.690639 0.806710 0.638889 11.00000 0.07133 H7DA 2 0.889046 0.715750 0.611978 11.00000 0.15168 H1CA 2 0.646724 0.840543 -0.026327 11.00000 0.03534 H7DB 2 0.940763 0.614967 0.605650 11.00000 0.27753 H1AA 2 0.062030 0.855714 0.272345 11.00000 0.11273 HKLF 4 REM GG1PMo_200709_0m in P-1 REM wR2 = 0.0686, GooF = S = 1.062, Restrained GooF = 1.040 for all data REM R1 = 0.0263 for 8786 Fo > 4sig(Fo) and 0.0296 for all 9555 data REM 812 parameters refined using 801 restraints END WGHT 0.0317 4.2522 REM Instructions for potential hydrogen bonds EQIV $1 -x+1, -y+2, -z+1 HTAB N1A O34_$1 HTAB N2A O3B EQIV $2 -x, -y+1, -z+1 HTAB N2A O3A_$2 EQIV $3 -x+1, -y+1, -z+1 HTAB N2A O32_$3 EQIV $4 x, y, z+1 HTAB N1B O1C_$4 EQIV $5 -x+2, -y+2, -z HTAB N1C O5D_$5 HTAB N2B O3C_$1 HTAB N2B O38_$1 HTAB N2B O1D_$3 HTAB C4A O6 HTAB C4A O34_$1 EQIV $6 x-1, y, z HTAB C4A O37_$6 HTAB C2B O25_$1 HTAB C2B O32_$3 HTAB C2A O24_$6 HTAB C2A O1 HTAB C4B O3D_$4 HTAB C4B O1C_$4 EQIV $7 -x+1, -y+2, -z HTAB C4C O2A_$7 EQIV $8 x, y, z-1 HTAB C2C O1B_$8 HTAB C2C O4_$7 EQIV $9 x+1, y+1, z HTAB N2C O33_$9 HTAB N2C O2D_$9 HTAB N2C O6D_$9 EQIV $10 x+1, y, z HTAB O1D O2D_$10 EQIV $11 -x+2, -y+1, -z+1 HTAB O1D O7D_$11 HTAB O2B O4D HTAB O7D O40 HTAB O7D O4D HTAB O1C O10 EQIV $12 -x+1, -y+1, -z HTAB O1C O22_$12 HTAB O7D O3A_$3 HTAB O1A O5D_$6 REM Highest difference peak 1.086, deepest hole -0.862, 1-sigma level 0.120 Q1 1 0.8320 0.9094 -0.0170 11.00000 0.05 1.09 Q2 1 0.8133 0.9948 0.0532 11.00000 0.05 1.02 Q3 1 0.5986 0.9011 0.4455 11.00000 0.05 0.91 Q4 1 0.4547 0.7811 0.1228 11.00000 0.05 0.87 Q5 1 0.5237 0.5401 0.1246 11.00000 0.05 0.80 Q6 1 0.2929 0.4319 0.3007 11.00000 0.05 0.74 Q7 1 0.6798 0.5354 0.3229 11.00000 0.05 0.72 Q8 1 0.3455 0.7005 0.1471 11.00000 0.05 0.69 Q9 1 0.8441 1.0053 0.2564 11.00000 0.05 0.68 Q10 1 0.7880 0.7545 0.4362 11.00000 0.05 0.63 Q11 1 0.3724 0.7257 0.4600 11.00000 0.05 0.63 Q12 1 0.7201 0.8920 0.2743 11.00000 0.05 0.62 Q13 1 0.5080 0.8133 0.4346 11.00000 0.05 0.61 Q14 1 0.4736 0.9296 0.2640 11.00000 0.05 0.60 Q15 1 0.7063 0.6441 0.4334 11.00000 0.05 0.59 Q16 1 0.5789 0.8816 0.1057 11.00000 0.05 0.59 Q17 1 0.6787 0.4762 0.2895 11.00000 0.05 0.58 Q18 1 0.4025 0.4217 0.1347 11.00000 0.05 0.57 Q19 1 0.4690 0.9715 0.2967 11.00000 0.05 0.57 Q20 1 0.7984 0.6169 0.2905 11.00000 0.05 0.56 Q21 1 0.7187 1.0390 0.4457 11.00000 0.05 0.56 Q22 1 0.3426 0.8183 0.2886 11.00000 0.05 0.56 Q23 1 0.3451 0.6479 0.1173 11.00000 0.05 0.55 Q24 1 0.4170 0.5445 0.2825 11.00000 0.05 0.55 Q25 1 0.7668 0.7873 0.1367 11.00000 0.05 0.55 Q26 1 0.3672 0.6675 0.4292 11.00000 0.05 0.54 Q27 1 0.6417 0.6642 0.1446 11.00000 0.05 0.53 Q28 1 0.5759 0.5206 0.4439 11.00000 0.05 0.52 Q29 1 1.0968 0.9968 0.2550 11.00000 0.05 0.51 Q30 1 0.7033 0.6085 0.4148 11.00000 0.05 0.51 Q31 1 0.7301 1.0203 0.4329 11.00000 0.05 0.50 Q32 1 0.3452 0.8824 0.3227 11.00000 0.05 0.50 Q33 1 0.7689 0.7182 0.1063 11.00000 0.05 0.50 Q34 1 1.0564 1.3800 0.0089 11.00000 0.05 0.49 Q35 1 0.2207 0.5762 0.1614 11.00000 0.05 0.48 Q36 1 0.7954 0.5807 0.3417 11.00000 0.05 0.47 Q37 1 0.1318 0.2581 0.1530 11.00000 0.05 0.46 Q38 1 -0.1230 0.4588 0.0977 11.00000 0.05 0.46 Q39 1 0.8046 0.7046 0.4027 11.00000 0.05 0.45 Q40 1 0.2216 0.6133 0.1787 11.00000 0.05 0.45 Q41 1 0.3868 0.7036 0.3736 11.00000 0.05 0.44 Q42 1 0.7044 0.6393 0.0712 11.00000 0.05 0.44 Q43 1 0.3983 0.8370 0.2287 11.00000 0.05 0.44 Q44 1 0.3351 0.5933 -0.0687 11.00000 0.05 0.43 Q45 1 0.3611 0.8707 0.2422 11.00000 0.05 0.42 Q46 1 0.9266 0.8696 0.4152 11.00000 0.05 0.42 Q47 1 0.5842 0.6139 0.1399 11.00000 0.05 0.42 Q48 1 0.6057 0.9236 0.3762 11.00000 0.05 0.42 Q49 1 0.0434 0.1411 0.1217 11.00000 0.05 0.42 Q50 1 0.7218 0.9666 0.4046 11.00000 0.05 0.42 Q51 1 0.2627 0.6260 -0.0419 11.00000 0.05 0.42 Q52 1 0.7004 1.0032 0.4897 11.00000 0.05 0.41 Q53 1 0.8741 0.9183 0.6053 11.00000 0.05 0.41 Q54 1 0.8255 0.9876 0.3228 11.00000 0.05 0.41 Q55 1 0.2322 0.5999 0.0961 11.00000 0.05 0.40 Q56 1 0.8068 0.5534 0.2554 11.00000 0.05 0.40 Q57 1 0.3441 0.7575 0.2012 11.00000 0.05 0.40 Q58 1 0.7583 0.7439 0.1924 11.00000 0.05 0.40 Q59 1 0.5770 0.5803 0.4786 11.00000 0.05 0.40 Q60 1 0.7786 0.8815 0.2040 11.00000 0.05 0.39 Q61 1 0.8499 0.7131 0.3554 11.00000 0.05 0.39 Q62 1 0.6594 0.7784 0.7551 11.00000 0.05 0.39 Q63 1 0.5651 0.5335 0.3623 11.00000 0.05 0.38 Q64 1 0.5092 0.6537 0.2805 11.00000 0.05 0.38 Q65 1 0.4629 0.5655 0.2421 11.00000 0.05 0.38 Q66 1 0.2851 0.7053 0.2182 11.00000 0.05 0.38 Q67 1 0.5093 0.5056 0.1840 11.00000 0.05 0.38 Q68 1 0.3568 0.5652 0.3644 11.00000 0.05 0.38 Q69 1 0.6631 0.6844 0.0805 11.00000 0.05 0.37 Q70 1 0.6812 0.5042 0.2260 11.00000 0.05 0.37 Q71 1 -0.0262 0.5439 0.1366 11.00000 0.05 0.37 Q72 1 0.4750 0.9425 0.3632 11.00000 0.05 0.37 Q73 1 0.5844 0.5519 0.3763 11.00000 0.05 0.37 Q74 1 0.4179 0.5198 0.3499 11.00000 0.05 0.36 Q75 1 0.4848 0.7775 0.4868 11.00000 0.05 0.36 Q76 1 0.5683 0.8166 0.3797 11.00000 0.05 0.36 Q77 1 0.1679 0.1973 0.2110 11.00000 0.05 0.35 Q78 1 0.9471 0.9273 0.1828 11.00000 0.05 0.35 Q79 1 0.4614 0.8238 0.0654 11.00000 0.05 0.35 Q80 1 0.7728 0.6397 0.3470 11.00000 0.05 0.34 Q81 1 0.7819 1.0375 0.3385 11.00000 0.05 0.34 Q82 1 0.3133 0.5858 -0.0188 11.00000 0.05 0.34 Q83 1 0.6543 0.6636 0.5108 11.00000 0.05 0.34 Q84 1 0.9502 0.9587 0.6518 11.00000 0.05 0.33 Q85 1 0.3027 0.7406 0.7424 11.00000 0.05 0.33 Q86 1 0.2813 0.5341 0.1797 11.00000 0.05 0.33 Q87 1 0.7459 0.5796 0.3824 11.00000 0.05 0.33 Q88 1 0.2214 0.5448 -0.0583 11.00000 0.05 0.33 Q89 1 0.4013 0.5367 0.0692 11.00000 0.05 0.33 Q90 1 0.3007 0.5499 -0.0259 11.00000 0.05 0.33 Q91 1 0.3347 0.4089 0.2263 11.00000 0.05 0.33 Q92 1 0.4288 0.4407 0.0794 11.00000 0.05 0.33 Q93 1 0.8051 0.7657 0.3600 11.00000 0.05 0.33 Q94 1 0.7231 0.8791 0.4336 11.00000 0.05 0.32 Q95 1 0.6008 0.4704 0.3122 11.00000 0.05 0.32 Q96 1 0.4206 0.7091 0.1185 11.00000 0.05 0.32 Q97 1 1.0315 1.0172 0.1789 11.00000 0.05 0.32 Q98 1 0.4292 0.7158 0.0851 11.00000 0.05 0.32 Q99 1 0.3354 0.7576 0.2652 11.00000 0.05 0.32 Q100 1 1.0375 0.9516 0.1748 11.00000 0.05 0.32 Q101 1 0.8224 0.9127 0.3292 11.00000 0.05 0.32 Q102 1 0.1855 0.2225 0.1721 11.00000 0.05 0.32 Q103 1 0.5107 0.8025 0.5002 11.00000 0.05 0.32 Q104 1 0.7226 0.4670 0.2255 11.00000 0.05 0.32 Q105 1 0.6406 0.8969 0.1893 11.00000 0.05 0.31 Q106 1 0.3145 0.4506 0.2411 11.00000 0.05 0.31 Q107 1 0.4603 0.4181 0.0700 11.00000 0.05 0.31 Q108 1 0.4239 0.8153 0.5026 11.00000 0.05 0.31 Q109 1 0.6953 0.9066 0.2015 11.00000 0.05 0.31 Q110 1 0.6630 0.8266 0.2557 11.00000 0.05 0.31 Q111 1 0.6647 0.8588 0.2827 11.00000 0.05 0.31 Q112 1 0.4334 0.6123 0.2743 11.00000 0.05 0.31 Q113 1 0.0349 0.5600 0.4553 11.00000 0.05 0.30 Q114 1 0.8765 0.7185 0.2959 11.00000 0.05 0.30 Q115 1 0.5998 0.8773 0.3243 11.00000 0.05 0.30 Q116 1 0.5976 0.5814 0.0975 11.00000 0.05 0.30 Q117 1 0.5179 0.9612 0.2019 11.00000 0.05 0.30 Q118 1 0.2165 0.4796 0.1638 11.00000 0.05 0.30 Q119 1 -0.0277 0.4658 0.1447 11.00000 0.05 0.30 Q120 1 0.4199 0.6624 0.3649 11.00000 0.05 0.30 Q121 1 0.9607 0.2425 0.1733 11.00000 0.05 0.30 Q122 1 0.3702 0.5457 0.1344 11.00000 0.05 0.30 Q123 1 0.9053 0.8346 0.4713 11.00000 0.05 0.30 Q124 1 0.0426 0.2002 0.1982 11.00000 0.05 0.30 Q125 1 0.2933 0.5563 0.2020 11.00000 0.05 0.29 Q126 1 0.8773 0.6511 0.2721 11.00000 0.05 0.29 Q127 1 0.7341 0.8300 0.4505 11.00000 0.05 0.29 Q128 1 0.8507 0.9486 0.6499 11.00000 0.05 0.29 Q129 1 0.9226 1.0937 -0.0275 11.00000 0.05 0.29 Q130 1 0.5017 0.7745 0.0633 11.00000 0.05 0.29 Q131 1 0.4669 0.5704 0.2043 11.00000 0.05 0.29 Q132 1 0.8685 0.6922 0.2881 11.00000 0.05 0.29 Q133 1 0.9295 0.7253 0.6233 11.00000 0.05 0.28 Q134 1 0.7641 1.0235 0.3919 11.00000 0.05 0.28 Q135 1 1.1749 1.2455 0.1170 11.00000 0.05 0.28 Q136 1 0.0787 0.8700 0.5789 11.00000 0.05 0.28 Q137 1 0.5018 0.6759 0.4353 11.00000 0.05 0.28 Q138 1 0.8085 0.8410 0.3498 11.00000 0.05 0.28 Q139 1 0.8129 0.9239 0.6348 11.00000 0.05 0.28 Q140 1 0.3300 0.4646 0.0862 11.00000 0.05 0.28 Q141 1 0.7135 0.8053 0.2676 11.00000 0.05 0.28 Q142 1 0.0000 0.5000 0.5000 10.50000 0.05 0.28 Q143 1 0.7995 1.0308 -0.0883 11.00000 0.05 0.28 Q144 1 0.4933 1.0237 0.3566 11.00000 0.05 0.28 Q145 1 0.3277 0.8665 0.1906 11.00000 0.05 0.28 Q146 1 0.1651 0.2555 0.2186 11.00000 0.05 0.28 Q147 1 0.5594 0.9593 0.5428 11.00000 0.05 0.27 Q148 1 0.8530 0.8711 0.4875 11.00000 0.05 0.27 Q149 1 0.5503 0.8989 0.1789 11.00000 0.05 0.27 Q150 1 0.8960 1.2562 0.0385 11.00000 0.05 0.27 Q151 1 0.7830 0.8399 0.2873 11.00000 0.05 0.27 Q152 1 0.2345 0.5353 -0.1463 11.00000 0.05 0.27 Q153 1 0.5429 0.5272 0.2271 11.00000 0.05 0.27 Q154 1 0.0204 0.7215 0.1702 11.00000 0.05 0.27 Q155 1 0.7407 1.0161 0.5536 11.00000 0.05 0.26 Q156 1 0.6322 0.7375 0.2393 11.00000 0.05 0.26 Q157 1 0.1867 0.3055 0.3056 11.00000 0.05 0.26 Q158 1 0.1621 0.8001 0.6367 11.00000 0.05 0.26 Q159 1 0.9140 0.6268 0.6143 11.00000 0.05 0.26 Q160 1 0.8019 0.8479 0.6340 11.00000 0.05 0.26 Q161 1 0.8577 1.0161 0.3820 11.00000 0.05 0.26 Q162 1 0.7791 1.0356 0.5145 11.00000 0.05 0.26 Q163 1 0.2762 0.7852 0.5116 11.00000 0.05 0.26 Q164 1 0.6017 0.7222 0.4425 11.00000 0.05 0.26 Q165 1 0.2742 0.7637 0.2850 11.00000 0.05 0.26 Q166 1 0.9770 1.3450 -0.1163 11.00000 0.05 0.26 Q167 1 0.6773 0.5023 0.1776 11.00000 0.05 0.26 Q168 1 -0.0443 0.6423 0.1182 11.00000 0.05 0.26 Q169 1 0.6033 0.7424 -0.0727 11.00000 0.05 0.26 Q170 1 0.2240 0.7590 0.7475 11.00000 0.05 0.26 Q171 1 0.3211 0.5225 -0.1060 11.00000 0.05 0.26 Q172 1 0.1235 0.5059 0.2921 11.00000 0.05 0.26 Q173 1 0.2445 0.7817 0.4599 11.00000 0.05 0.26 Q174 1 0.2235 0.3956 0.3133 11.00000 0.05 0.26 Q175 1 -0.0583 0.1437 0.1713 11.00000 0.05 0.26 Q176 1 0.7066 0.3713 0.2846 11.00000 0.05 0.26 Q177 1 0.3762 0.5835 0.4368 11.00000 0.05 0.26 Q178 1 0.5418 0.8987 0.4944 11.00000 0.05 0.26 Q179 1 0.4181 0.3034 0.0274 11.00000 0.05 0.25 Q180 1 0.4142 0.8019 0.9074 11.00000 0.05 0.25 Q181 1 1.0343 1.3620 0.0851 11.00000 0.05 0.25 Q182 1 0.6213 0.7714 0.6880 11.00000 0.05 0.25 Q183 1 0.6228 1.0506 0.2877 11.00000 0.05 0.25 Q184 1 0.8438 1.1012 0.3907 11.00000 0.05 0.25 Q185 1 0.8249 0.8757 0.1476 11.00000 0.05 0.25 Q186 1 0.7920 0.7002 0.2831 11.00000 0.05 0.25 Q187 1 0.6820 0.5982 0.4905 11.00000 0.05 0.25 Q188 1 0.5570 0.8084 0.7020 11.00000 0.05 0.25 Q189 1 0.6788 0.8272 0.8020 11.00000 0.05 0.25 Q190 1 0.8212 1.1879 -0.0178 11.00000 0.05 0.24 Q191 1 0.5167 0.6213 0.2221 11.00000 0.05 0.24 Q192 1 0.3151 0.5279 -0.0842 11.00000 0.05 0.24 Q193 1 0.3404 0.6564 0.6175 11.00000 0.05 0.24 Q194 1 0.2031 0.5197 0.0269 11.00000 0.05 0.24 Q195 1 0.5413 0.4694 0.2295 11.00000 0.05 0.24 Q196 1 0.9980 1.0288 0.1206 11.00000 0.05 0.24 Q197 1 0.2946 0.9772 0.8696 11.00000 0.05 0.24 Q198 1 0.9182 0.8349 0.5238 11.00000 0.05 0.24 Q199 1 0.3063 1.0351 0.9173 11.00000 0.05 0.24 Q200 1 0.4166 0.9833 0.3627 11.00000 0.05 0.24 ; _shelx_res_checksum 31178 _shelx_hkl_file ; -2 0 0 435.148 17.852 4 2 0 0 471.979 18.969 1 2 0 0 426.127 18.600 2 -3 0 0 219.112 9.180 4 3 0 0 204.316 9.399 2 3 0 0 217.155 9.947 3 3 0 0 234.051 9.590 1 -4 0 0 15.1637 1.4072 4 4 0 0 14.9332 1.2649 2 4 0 0 18.3683 1.0396 3 4 0 0 16.7831 1.2083 1 -5 0 0 259.481 11.668 4 5 0 0 286.780 12.526 3 5 0 0 283.298 12.162 1 5 0 0 259.517 11.927 2 -6 0 0 3.17417 0.95033 4 6 0 0 3.49499 0.51408 3 6 0 0 3.01367 0.66633 1 6 0 0 3.16929 0.71749 2 -7 0 0 55.3197 3.6028 4 7 0 0 54.4866 3.2586 1 7 0 0 60.3973 3.0191 3 7 0 0 58.0181 3.3435 2 -8 0 0 131.996 6.439 4 8 0 0 128.097 6.296 2 8 0 0 117.946 6.264 1 -9 0 0 11.2290 1.7718 4 9 0 0 11.6813 1.5565 2 -10 0 0 339.419 15.081 4 10 0 0 349.620 15.448 2 10 0 0 325.359 15.594 1 -11 0 0 27.4099 3.8206 1 -11 0 0 29.9408 3.0759 4 11 0 0 26.1635 2.4464 2 11 0 0 27.4461 2.4748 1 -12 0 0 30.3275 4.2056 1 12 0 0 32.7917 2.9415 1 12 0 0 34.0100 2.9946 2 -13 0 0 4.68899 2.35541 1 13 0 0 5.01118 1.53978 2 13 0 0 5.76098 1.53437 1 -14 0 0 159.854 10.868 1 14 0 0 171.009 9.142 2 -15 0 0 0.60298 2.24261 1 15 0 0 0.30987 1.42560 2 15 -1 0 100.667 6.453 2 -15 1 0 101.165 8.195 1 14 -1 0 8.15657 1.89872 2 -14 1 0 9.05332 2.80724 1 13 -1 0 9.30926 1.86838 2 -13 1 0 9.60115 2.76506 1 12 -1 0 7.58521 1.58995 1 12 -1 0 6.99968 1.50217 2 -12 1 0 8.24629 2.39920 1 11 -1 0 729.708 31.435 2 11 -1 0 744.326 32.153 1 -11 1 0 692.260 33.591 1 10 -1 0 293.248 13.208 2 10 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4.3781 1 3 1 0 88.5309 4.4493 2 -4 -1 0 2.76413 0.80936 4 4 1 0 0.92633 0.52416 2 -5 -1 0 355.355 14.818 4 5 1 0 348.605 15.258 1 5 1 0 337.160 15.094 2 -6 -1 0 12.3704 1.6921 4 6 1 0 12.2469 1.2408 1 6 1 0 11.9643 1.4528 2 6 1 0 15.8464 0.9452 3 -7 -1 0 87.2584 4.8422 4 7 1 0 83.3848 4.4792 1 7 1 0 83.9271 4.5627 2 -8 -1 0 13.8850 1.9378 4 8 1 0 16.1812 1.7965 2 8 1 0 9.51278 1.42003 1 -9 -1 0 44.5019 3.3210 4 9 1 0 40.4482 2.8492 1 9 1 0 41.5856 3.0064 2 -10 -1 0 235.400 11.403 4 10 1 0 236.130 11.549 1 10 1 0 252.599 11.594 2 -11 -1 0 521.953 23.194 4 11 1 0 532.158 24.219 1 11 1 0 553.351 23.904 2 -12 -1 0 213.857 12.583 1 12 1 0 222.512 10.850 2 12 1 0 209.674 10.847 1 -13 -1 0 20.9649 3.7739 1 13 1 0 20.6062 2.6294 1 13 1 0 24.0244 2.8883 2 -14 -1 0 2.25636 2.14240 1 14 1 0 1.13569 1.22145 1 14 1 0 1.66440 1.35306 2 15 1 0 2.54537 1.72838 2 16 -2 0 24.6751 3.3419 2 15 -2 0 188.399 9.932 2 -15 2 0 178.050 11.964 1 14 -2 0 90.6584 5.5581 2 -14 2 0 77.7822 6.8145 1 13 -2 0 29.5548 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197.488 10.256 4 12 2 0 195.987 10.114 2 12 2 0 195.187 10.089 1 -13 -2 0 5.52981 2.54612 1 13 2 0 4.89861 1.61366 2 13 2 0 7.13805 1.77714 1 -14 -2 0 78.9189 7.1950 1 14 2 0 80.9547 5.4737 1 14 2 0 74.2757 5.4095 2 15 2 0 2.07673 1.76453 2 16 -3 0 11.2072 2.3058 2 -16 3 0 7.28682 2.99455 1 15 -3 0 87.2366 5.6822 2 -15 3 0 83.2239 7.2083 1 14 -3 0 42.8872 3.6385 2 -14 3 0 49.0363 5.7111 1 13 -3 0 13.8401 2.0739 2 -13 3 0 8.53850 2.47020 1 12 -3 0 29.7580 2.6562 2 -12 3 0 26.4656 3.9379 1 11 -3 0 414.970 18.864 2 -11 3 0 429.530 20.782 1 10 -3 0 184.126 9.241 2 -10 3 0 207.010 10.817 1 9 -3 0 929.927 39.813 3 9 -3 0 853.847 37.078 2 -9 3 0 860.348 39.022 1 -9 3 0 834.462 35.300 4 8 -3 0 2936.15 124.46 2 8 -3 0 3240.80 134.65 3 -8 3 0 2820.94 118.40 4 -8 3 0 2969.73 128.10 1 7 -3 0 394.080 17.580 3 7 -3 0 386.838 16.458 2 -7 3 0 368.639 17.589 1 -7 3 0 354.984 15.637 4 6 -3 0 20.3024 1.5326 3 6 -3 0 19.2446 1.5295 2 -6 3 0 17.7479 1.5282 4 -6 3 0 16.9470 2.1430 1 5 -3 0 4.59358 0.81574 2 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80.4903 5.2717 1 8 -4 0 427.705 18.839 2 8 -4 0 465.619 20.228 3 -8 4 0 424.108 17.837 4 -8 4 0 401.874 20.084 1 7 -4 0 49.0456 2.9408 2 7 -4 0 54.1166 3.1055 3 -7 4 0 49.3977 3.8096 1 -7 4 0 46.9078 2.9130 4 6 -4 0 135.872 6.729 2 6 -4 0 147.847 7.232 3 6 -4 0 146.351 5.922 4 -6 4 0 148.230 7.615 1 5 -4 0 30.0135 1.9974 3 5 -4 0 26.4258 1.8449 2 5 -4 0 32.2358 1.4191 4 -5 4 0 28.4309 2.3830 1 4 -4 0 169.607 7.925 2 4 -4 0 177.008 8.601 3 4 -4 0 184.507 7.240 4 -4 4 0 179.758 8.660 1 3 -4 0 356.766 15.973 2 3 -4 0 383.131 15.182 4 3 -4 0 387.333 17.381 3 -3 4 0 383.519 16.769 1 -3 4 0 364.283 16.266 2 2 -4 0 50.3472 2.9203 3 2 -4 0 54.1744 2.5967 4 -2 4 0 53.1636 2.9097 2 -2 4 0 56.6421 2.8085 1 1 -4 0 255.893 11.972 3 1 -4 0 249.676 10.676 4 -1 4 0 260.253 11.307 2 -1 4 0 263.502 11.150 1 0 -4 0 566.145 27.194 3 0 -4 0 563.633 24.261 4 0 4 0 609.186 25.500 2 0 4 0 657.709 25.577 1 -1 -4 0 177.060 8.589 3 1 4 0 193.006 8.621 2 1 4 0 184.394 8.145 1 -2 -4 0 128.101 6.109 3 2 4 0 129.476 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2139.72 76.96 4 -5 6 0 1865.85 83.54 1 -5 6 0 1941.68 81.69 2 4 -6 0 0.70426 0.51819 4 4 -6 0 2.37351 0.72796 3 -4 6 0 0.52222 0.61753 2 -4 6 0 1.56969 0.81689 1 3 -6 0 170.236 7.153 4 3 -6 0 157.380 8.079 3 -3 6 0 166.266 7.566 1 -3 6 0 159.798 7.778 2 2 -6 0 99.1115 4.6465 4 2 -6 0 90.9767 5.0416 3 -2 6 0 104.426 4.617 1 -2 6 0 96.4318 5.0247 2 1 -6 0 8.36011 1.16689 3 1 -6 0 6.67447 1.18806 4 -1 6 0 10.6669 0.9025 1 -1 6 0 8.15292 1.28877 2 0 -6 0 34.5092 2.3187 4 0 -6 0 28.6290 2.0183 3 0 6 0 34.7289 1.8664 1 0 6 0 34.7616 2.4275 2 -1 -6 0 192.048 9.414 3 -1 -6 0 203.034 9.170 4 1 6 0 204.641 8.914 1 1 6 0 200.490 9.550 2 -2 -6 0 55.2707 3.0157 3 -2 -6 0 58.4332 3.6261 4 2 6 0 58.6024 3.0076 1 2 6 0 59.0625 3.9027 2 -3 -6 0 421.671 17.411 4 -3 -6 0 394.197 18.120 3 3 6 0 390.458 17.402 1 3 6 0 387.023 18.118 2 -4 -6 0 483.618 20.207 4 4 6 0 450.084 20.280 1 4 6 0 460.728 21.040 2 -5 -6 0 1.00241 1.10985 4 5 6 0 0.66895 1.10864 2 5 6 0 1.56686 0.61893 1 -6 -6 0 75.3582 4.8219 4 6 6 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3 424.904 19.985 3 6 -8 3 435.874 18.384 2 -7 8 -3 248.750 12.828 1 7 -8 3 232.488 11.169 2 7 -8 3 247.961 12.224 3 -8 8 -3 6.44973 2.00659 1 8 -8 3 4.46155 1.14817 2 8 -8 3 5.70577 1.28652 3 -9 8 -3 15.0293 2.9624 1 9 -8 3 15.7499 2.0271 2 9 -8 3 18.7720 2.2258 3 -10 8 -3 36.6441 4.4617 1 10 -8 3 34.3883 2.8288 3 10 -8 3 33.5031 2.7902 2 -11 8 -3 35.5605 4.6307 1 11 -8 3 37.7460 3.1215 3 11 -8 3 36.6007 3.0688 2 -12 8 -3 88.2507 6.9506 1 12 -8 3 91.0742 5.4827 3 12 -8 3 77.7338 5.2135 2 -13 8 -3 128.545 8.926 1 13 -8 3 120.183 7.025 2 -14 8 -3 50.5445 6.1047 1 14 -8 3 37.4073 3.5583 2 -15 8 -3 39.4720 5.7034 1 15 -8 3 38.4080 3.6860 2 12 7 -3 10.6000 2.0877 1 -12 -7 3 12.1328 3.1776 4 11 7 -3 -0.5396 1.0492 1 -11 -7 3 0.22353 1.82055 4 10 7 -3 13.2645 2.0145 1 -10 -7 3 14.3898 2.8428 4 9 7 -3 12.5140 1.8394 1 9 7 -3 14.1738 2.2597 2 -9 -7 3 11.5659 2.5787 4 8 7 -3 3.08224 1.35260 2 8 7 -3 2.46019 1.06411 1 -8 -7 3 2.94856 1.51910 4 7 7 -3 256.882 12.223 1 7 7 -3 266.028 12.662 2 -7 -7 3 262.176 12.884 4 6 7 -3 1088.24 47.23 2 6 7 -3 1103.45 47.41 1 -6 -7 3 1106.40 45.72 4 5 7 -3 15.4171 2.2639 2 5 7 -3 19.4281 1.6500 1 -5 -7 3 15.9817 2.3801 4 4 7 -3 354.466 14.829 1 4 7 -3 297.655 15.255 2 -4 -7 3 332.040 15.023 4 3 7 -3 11.5678 1.9064 2 3 7 -3 8.63044 1.14575 1 -3 -7 3 8.13290 1.68348 4 -3 -7 3 8.71595 1.19889 3 2 7 -3 2.73797 0.72888 1 2 7 -3 1.87354 0.95991 2 -2 -7 3 3.49433 0.93101 3 -2 -7 3 2.95777 1.07763 4 1 7 -3 4.49827 1.10011 2 1 7 -3 6.78750 0.96367 1 -1 -7 3 3.45577 1.04778 4 -1 -7 3 3.75755 0.98636 3 0 7 -3 78.5789 3.9600 1 0 7 -3 77.9583 4.2766 2 0 -7 3 71.7941 4.2967 3 0 -7 3 84.0053 4.3101 4 -1 7 -3 226.829 9.791 1 -1 7 -3 212.618 9.888 2 1 -7 3 212.359 10.525 3 1 -7 3 203.328 9.386 4 -2 7 -3 374.423 16.933 2 -2 7 -3 393.604 17.076 1 2 -7 3 383.487 15.936 4 2 -7 3 384.615 18.213 3 -3 7 -3 318.233 14.326 1 -3 7 -3 308.335 14.078 2 3 -7 3 303.378 12.918 4 3 -7 3 321.628 15.086 3 -4 7 -3 842.004 41.340 1 -4 7 -3 888.073 40.410 2 4 -7 3 1007.05 40.07 2 4 -7 3 994.249 43.612 3 4 -7 3 1006.46 37.78 4 -5 7 -3 208.322 11.385 1 5 -7 3 220.904 11.229 3 5 -7 3 244.942 10.341 2 -6 7 -3 80.9391 5.9391 1 6 -7 3 99.1053 5.3916 3 -7 7 -3 3.07086 1.50613 1 7 -7 3 6.04874 1.26336 3 7 -7 3 2.41483 0.88929 2 -8 7 -3 92.0767 6.3159 1 8 -7 3 88.8895 5.2747 3 8 -7 3 89.6546 4.9028 2 -9 7 -3 120.820 7.685 1 9 -7 3 114.670 6.510 3 9 -7 3 119.100 6.274 2 -10 7 -3 374.867 18.940 1 10 -7 3 366.676 16.988 2 10 -7 3 381.642 18.160 3 -11 7 -3 396.624 21.129 1 11 -7 3 447.607 20.502 3 11 -7 3 420.220 19.242 2 -12 7 -3 48.9839 4.9831 1 12 -7 3 51.4295 3.8323 2 -13 7 -3 33.5527 4.7241 1 13 -7 3 29.1873 3.2877 2 -14 7 -3 21.9817 4.0160 1 14 -7 3 16.7394 2.5954 2 -15 7 -3 2.10536 2.53458 1 15 -7 3 1.61402 1.59316 2 13 6 -3 51.6464 4.2361 1 -13 -6 3 58.1526 5.9104 4 12 6 -3 46.3991 3.7845 1 -12 -6 3 45.1552 5.0320 4 11 6 -3 63.2254 4.3080 1 -11 -6 3 55.2460 4.9620 4 10 6 -3 79.7743 4.9493 1 10 6 -3 91.2910 5.3139 2 -10 -6 3 70.4037 5.5921 4 9 6 -3 107.557 5.959 2 9 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225.177 12.059 1 -7 3 -3 256.022 10.174 4 7 -3 3 237.585 10.969 2 7 -3 3 239.257 11.551 3 -8 3 -3 8.70269 1.86644 1 8 -3 3 4.99861 0.98537 3 8 -3 3 6.10245 1.19115 2 -9 3 -3 21.9995 3.0673 1 9 -3 3 19.4731 1.9502 2 -10 3 -3 133.946 8.254 1 10 -3 3 127.659 6.894 2 -11 3 -3 80.8729 6.2674 1 11 -3 3 83.4261 5.0810 2 -12 3 -3 20.7930 3.6117 1 12 -3 3 24.6200 2.8423 2 -13 3 -3 147.620 9.225 1 13 -3 3 112.628 7.095 2 -14 3 -3 37.2612 5.2005 1 14 -3 3 47.1442 4.0826 2 -15 3 -3 3.21830 2.39078 1 15 -3 3 2.66035 1.77341 2 15 2 -3 19.5050 2.8687 1 14 2 -3 33.3681 3.1671 2 14 2 -3 27.5163 3.1829 1 13 2 -3 10.2332 1.8694 2 13 2 -3 6.05796 1.58468 1 -13 -2 3 8.43445 2.38114 4 12 2 -3 464.621 21.865 1 12 2 -3 488.982 21.459 2 -12 -2 3 486.259 21.691 4 11 2 -3 259.931 12.269 1 11 2 -3 269.200 12.012 2 -11 -2 3 226.863 12.310 4 10 2 -3 85.5731 4.6864 2 10 2 -3 79.6161 4.7373 1 -10 -2 3 81.9974 5.4894 4 9 2 -3 84.7119 4.8077 1 9 2 -3 89.4748 4.7667 2 -9 -2 3 89.5639 5.5211 4 8 2 -3 268.550 11.985 2 8 2 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560.511 26.609 3 -7 7 -4 53.7888 4.5213 1 7 -7 4 51.0195 3.3015 2 7 -7 4 55.7089 3.6679 3 -8 7 -4 7.85077 2.11654 1 8 -7 4 7.19711 1.36568 2 8 -7 4 5.83588 1.24337 3 -9 7 -4 23.5817 3.5390 1 9 -7 4 27.3686 2.3652 2 9 -7 4 27.5266 2.4732 3 -10 7 -4 91.6729 6.5131 1 10 -7 4 82.9622 4.9699 2 10 -7 4 80.1066 5.0801 3 -11 7 -4 490.160 23.624 1 11 -7 4 478.687 22.651 3 11 -7 4 453.062 21.271 2 -12 7 -4 13.2287 3.0649 1 12 -7 4 5.31452 1.51593 2 -13 7 -4 13.0092 3.1993 1 13 -7 4 16.6129 2.4948 2 -14 7 -4 25.9889 4.4928 1 14 -7 4 25.5942 3.1733 2 -15 7 -4 72.7874 7.1947 1 15 -7 4 75.5505 5.5855 2 13 6 -4 8.98816 2.04863 1 -13 -6 4 6.44173 2.82346 4 12 6 -4 273.399 13.575 1 -12 -6 4 276.822 14.413 4 11 6 -4 369.724 17.416 1 -11 -6 4 370.201 17.942 4 10 6 -4 4.78313 1.32840 1 -10 -6 4 4.41163 1.93346 4 9 6 -4 7.65661 1.43010 1 9 6 -4 7.88244 1.64711 2 -9 -6 4 6.41866 1.93831 4 8 6 -4 4.58372 1.15552 1 8 6 -4 5.26660 1.35269 2 -8 -6 4 3.58011 1.64370 4 7 6 -4 130.681 6.700 2 7 6 -4 120.802 6.467 1 -7 -6 4 133.505 7.477 4 6 6 -4 2.45674 0.79266 1 6 6 -4 2.46495 1.05471 2 -6 -6 4 2.94453 1.30944 4 5 6 -4 2.28164 0.95669 2 5 6 -4 2.74034 0.75755 1 -5 -6 4 1.12616 1.04241 4 4 6 -4 449.011 21.062 2 4 6 -4 462.018 20.946 1 -4 -6 4 487.792 20.771 4 -4 -6 4 512.306 22.148 3 3 6 -4 1048.64 48.38 2 3 6 -4 1174.13 48.83 1 -3 -6 4 1174.83 51.82 3 -3 -6 4 1164.82 46.62 4 2 6 -4 106.025 5.225 1 2 6 -4 108.023 5.578 2 -2 -6 4 107.247 5.663 4 -2 -6 4 110.011 5.661 3 1 6 -4 14.6711 1.4315 2 1 6 -4 12.3380 1.1201 1 -1 -6 4 11.7281 1.5950 4 -1 -6 4 12.1584 1.4478 3 0 6 -4 13.9662 1.2543 1 0 6 -4 14.5643 1.3422 2 0 -6 4 11.0563 1.4903 4 0 -6 4 10.7592 1.4273 3 -1 6 -4 493.383 20.797 1 -1 6 -4 470.320 20.392 2 1 -6 4 461.484 22.096 3 1 -6 4 468.061 19.469 4 -2 6 -4 592.907 24.935 1 -2 6 -4 570.328 24.284 2 2 -6 4 547.969 26.256 3 2 -6 4 551.423 22.848 4 -3 6 -4 36.2469 2.7820 1 3 -6 4 36.2449 2.5729 3 3 -6 4 32.2693 1.8230 4 3 -6 4 39.0691 2.1961 2 -4 6 -4 233.369 12.381 1 4 -6 4 280.293 11.293 2 4 -6 4 240.403 12.339 3 -5 6 -4 24.5450 3.1270 1 5 -6 4 25.3839 2.1776 3 5 -6 4 21.7993 1.8250 2 -6 6 -4 0.16684 1.28601 1 6 -6 4 -0.0319 0.7938 3 6 -6 4 0.69425 0.77602 2 -7 6 -4 298.423 15.438 1 7 -6 4 322.786 13.929 2 7 -6 4 301.818 14.968 3 -8 6 -4 16.4820 2.7741 1 8 -6 4 17.2184 1.8410 3 8 -6 4 16.7269 1.9259 2 -9 6 -4 16.6486 2.8836 1 9 -6 4 10.1627 1.5831 3 9 -6 4 10.9286 1.6885 2 -10 6 -4 376.785 19.223 1 10 -6 4 362.462 17.281 2 10 -6 4 400.747 18.406 3 -11 6 -4 209.752 12.332 1 11 -6 4 220.432 10.765 2 -12 6 -4 6.64028 2.35716 1 12 -6 4 4.67049 1.50124 2 -13 6 -4 45.1976 5.5019 1 13 -6 4 40.3697 3.6435 2 -14 6 -4 1.29447 2.05579 1 14 -6 4 1.37200 1.47640 2 -15 6 -4 184.338 12.333 1 15 -6 4 184.652 10.303 2 -14 -5 4 19.5556 3.8026 4 13 5 -4 14.6550 2.3999 1 -13 -5 4 22.9427 3.7045 4 12 5 -4 4.85641 1.44047 1 -12 -5 4 7.93633 2.41985 4 11 5 -4 24.4618 2.3700 1 -11 -5 4 18.5292 3.0910 4 10 5 -4 19.8024 2.3086 1 10 5 -4 23.2415 2.2985 2 -10 -5 4 21.1884 3.1206 4 9 5 -4 202.528 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63.1324 3.7452 3 2 -5 4 66.8888 3.0759 4 3 -5 4 86.0122 4.8048 3 -4 5 -4 603.949 27.939 1 4 -5 4 667.552 26.261 2 4 -5 4 579.201 28.556 3 -5 5 -4 46.7356 3.7118 1 5 -5 4 45.7855 3.0092 3 5 -5 4 45.0895 2.7281 2 -6 5 -4 1392.81 62.43 1 6 -5 4 1464.99 65.04 3 -7 5 -4 275.012 14.461 1 7 -5 4 308.342 14.075 3 7 -5 4 280.190 13.028 2 -8 5 -4 297.711 15.171 1 8 -5 4 288.441 13.576 2 8 -5 4 311.506 14.546 3 -9 5 -4 26.8080 3.5321 1 9 -5 4 27.9733 2.3918 2 9 -5 4 29.4655 2.3672 3 -10 5 -4 -1.2979 1.1770 1 10 -5 4 1.17477 0.83897 3 10 -5 4 0.35750 0.94759 2 -11 5 -4 48.1939 4.6792 1 11 -5 4 40.3672 3.2765 2 -12 5 -4 54.1124 5.1982 1 12 -5 4 56.0189 4.0803 2 -13 5 -4 114.853 8.517 1 13 -5 4 119.463 6.985 2 -14 5 -4 73.5024 6.6939 1 14 -5 4 63.8972 4.9360 2 -15 5 -4 -0.3279 2.2045 1 15 -5 4 2.81945 1.75490 2 14 4 -4 34.0578 3.3562 1 -14 -4 4 25.8424 4.1489 4 13 4 -4 80.0355 5.3942 1 -13 -4 4 90.9910 6.4231 4 12 4 -4 140.703 7.855 1 -12 -4 4 151.936 8.745 4 11 4 -4 42.6685 3.1091 2 11 4 -4 37.7636 3.0574 1 -11 -4 4 37.6378 4.1864 4 10 4 -4 64.4626 4.2329 1 10 4 -4 78.1378 4.3638 2 -10 -4 4 69.9536 5.1887 4 9 4 -4 1.30179 0.89175 1 9 4 -4 0.30955 0.83956 2 -9 -4 4 3.25460 1.75060 4 8 4 -4 164.691 7.690 2 8 4 -4 155.572 7.791 1 -8 -4 4 154.395 8.483 4 7 4 -4 76.6696 4.2884 1 7 4 -4 81.3960 4.2915 2 -7 -4 4 81.1848 5.1787 4 6 4 -4 6.65302 1.08583 2 6 4 -4 6.07317 1.00857 1 -6 -4 4 4.73809 1.39961 4 5 4 -4 1837.11 81.58 1 5 4 -4 1928.20 80.03 2 -5 -4 4 2024.85 86.73 3 -5 -4 4 1888.28 77.16 4 4 4 -4 4587.51 188.14 2 4 4 -4 4384.70 191.85 1 -4 -4 4 4876.37 203.96 3 -4 -4 4 4311.12 179.80 4 3 4 -4 86.2587 4.2313 1 3 4 -4 85.4376 4.3603 2 -3 -4 4 90.7294 4.7462 3 -3 -4 4 80.9486 4.6564 4 2 4 -4 648.677 26.167 1 2 4 -4 592.443 25.765 2 -2 -4 4 580.714 27.926 3 -2 -4 4 604.702 25.059 4 1 4 -4 0.72958 0.41177 1 1 4 -4 1.00855 0.56024 2 -1 -4 4 0.58310 0.65045 4 -1 -4 4 2.07904 0.75444 3 0 4 -4 23.1238 1.5163 1 0 4 -4 19.9931 1.3921 2 0 -4 4 20.8951 1.6667 4 0 -4 4 18.0534 1.7384 3 -1 4 -4 41.9821 2.6176 1 -1 4 -4 41.8920 2.4342 2 1 -4 4 44.6772 2.3714 4 1 -4 4 41.7990 2.1625 2 1 -4 4 38.2973 2.6672 3 -2 4 -4 4.00076 0.99298 1 2 -4 4 4.67084 0.92487 3 2 -4 4 4.01283 0.60388 2 2 -4 4 2.99025 0.52115 4 -3 4 -4 1181.51 54.32 1 3 -4 4 1319.18 52.28 2 -4 4 -4 2251.48 99.89 1 4 -4 4 2482.92 96.87 2 4 -4 4 2252.72 105.08 3 -5 4 -4 262.584 13.564 1 5 -4 4 283.108 13.464 3 5 -4 4 291.047 12.408 2 -6 4 -4 1.09693 1.10312 1 6 -4 4 4.91264 1.02491 2 6 -4 4 1.96239 0.81462 3 -7 4 -4 42.9503 3.7788 1 7 -4 4 44.0497 2.9203 3 7 -4 4 42.7915 2.8417 2 -8 4 -4 110.837 6.728 1 8 -4 4 98.7555 5.5917 3 8 -4 4 106.207 5.567 2 -9 4 -4 18.4858 2.8504 1 9 -4 4 22.9084 1.9639 3 9 -4 4 17.4008 2.1620 2 -10 4 -4 151.078 9.384 1 10 -4 4 165.249 8.231 2 -11 4 -4 -0.5005 1.1889 1 11 -4 4 1.98499 1.09131 2 -12 4 -4 5.34628 2.16586 1 12 -4 4 4.41818 1.46153 2 -13 4 -4 45.4944 5.4968 1 13 -4 4 50.0026 4.1159 2 -14 4 -4 1.31341 1.97125 1 14 -4 4 0.44189 1.44240 2 -15 4 -4 0.81314 2.20976 1 15 -4 4 2.25134 1.59917 2 14 3 -4 45.6667 3.8018 1 -14 -3 4 53.1243 4.9647 4 13 3 -4 282.769 13.767 1 -13 -3 4 274.809 14.140 4 12 3 -4 3.54040 1.22726 1 12 3 -4 3.52056 1.23517 2 -12 -3 4 2.52784 1.85298 4 11 3 -4 22.3019 2.1849 1 11 3 -4 22.4056 2.3735 2 -11 -3 4 23.8016 3.4307 4 10 3 -4 34.1981 2.6929 1 10 3 -4 36.3944 2.6299 2 -10 -3 4 29.6054 3.6343 4 9 3 -4 80.0228 4.3691 2 9 3 -4 75.4264 4.4852 1 -9 -3 4 85.8973 5.3975 4 8 3 -4 57.3762 3.3252 2 8 3 -4 55.9107 3.3665 1 -8 -3 4 55.9158 4.0980 4 7 3 -4 724.898 30.313 2 7 3 -4 702.480 30.982 1 -7 -3 4 713.919 30.080 4 6 3 -4 254.603 12.081 1 6 3 -4 265.211 11.821 2 -6 -3 4 259.072 12.340 4 -6 -3 4 298.452 13.724 3 5 3 -4 27.2763 1.7812 2 5 3 -4 25.9537 1.7901 1 -5 -3 4 28.4669 2.4876 4 -5 -3 4 33.2669 2.8970 3 4 3 -4 8.74840 0.89461 1 4 3 -4 10.0693 0.9685 2 -4 -3 4 9.96337 1.65643 3 -4 -3 4 8.45743 1.42120 4 3 3 -4 89.4813 4.4702 1 3 3 -4 92.1864 4.3743 2 -3 -3 4 101.800 5.477 3 -3 -3 4 90.0624 4.8866 4 2 3 -4 256.245 11.968 2 2 3 -4 275.598 12.221 1 2 3 -4 290.935 11.379 4 -2 -3 4 281.363 12.046 4 -2 -3 4 289.386 13.536 3 1 3 -4 1900.54 73.84 2 1 3 -4 1728.64 70.25 4 1 3 -4 1788.56 75.51 1 -1 -3 4 1705.43 70.81 4 0 3 -4 8.21003 0.60935 4 0 3 -4 6.05744 0.67772 2 0 3 -4 5.95354 0.84959 1 0 -3 4 3.70667 0.93162 3 -1 3 -4 647.719 28.335 1 -1 3 -4 659.263 25.757 4 1 -3 4 639.422 27.180 2 2 -3 4 607.968 25.844 2 2 -3 4 624.780 28.358 3 -3 3 -4 434.862 20.414 1 3 -3 4 440.653 20.906 3 3 -3 4 471.676 19.136 2 -4 3 -4 552.409 25.750 1 4 -3 4 578.868 26.460 3 4 -3 4 586.843 24.351 2 -5 3 -4 549.715 21.217 4 5 -3 4 497.837 24.534 3 5 -3 4 545.341 22.764 2 -6 3 -4 1089.44 42.12 4 6 -3 4 1080.70 44.72 2 6 -3 4 1008.87 48.19 3 -7 3 -4 1879.28 82.30 1 7 -3 4 1874.66 85.90 3 7 -3 4 1950.91 79.64 2 -8 3 -4 199.530 10.589 1 8 -3 4 192.406 9.543 3 8 -3 4 192.285 9.286 2 -9 3 -4 251.164 13.105 1 9 -3 4 244.813 11.693 2 -10 3 -4 56.9937 4.9624 1 10 -3 4 59.4060 3.9410 2 -11 3 -4 54.7111 4.8797 1 11 -3 4 49.9990 3.7251 2 -12 3 -4 0.22687 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86.66 1 -5 -5 5 1984.31 81.97 4 -5 -5 5 2061.04 92.03 3 4 5 -5 3272.98 141.46 1 4 5 -5 3342.02 138.74 2 -4 -5 5 3526.27 150.43 3 -4 -5 5 3220.08 132.94 4 3 5 -5 12.0805 1.1667 1 3 5 -5 8.28515 1.23141 2 -3 -5 5 9.66358 1.57145 4 -3 -5 5 8.96133 1.37622 3 2 5 -5 106.976 4.776 1 2 5 -5 94.0796 4.7712 2 -2 -5 5 88.6802 5.1948 3 -2 -5 5 90.3668 5.0236 4 1 5 -5 161.528 6.743 2 -1 -5 5 140.254 6.858 4 -1 -5 5 133.008 7.412 3 0 5 -5 67.8440 3.4142 1 0 5 -5 65.4665 3.1972 2 0 -5 5 52.9134 3.6109 3 0 -5 5 61.5705 3.3891 4 -1 5 -5 379.053 16.274 1 -1 5 -5 368.044 15.666 2 1 -5 5 366.656 15.026 4 1 -5 5 334.410 17.135 3 -2 5 -5 278.410 12.873 1 2 -5 5 270.607 11.348 4 2 -5 5 274.229 11.863 2 -3 5 -5 102.092 5.923 1 3 -5 5 106.700 5.663 3 3 -5 5 99.1022 4.8726 2 3 -5 5 104.103 4.375 4 -4 5 -5 9.70418 1.84118 1 4 -5 5 0.70309 0.58874 2 -5 5 -5 751.562 35.762 1 5 -5 5 839.111 33.846 2 5 -5 5 795.715 36.783 3 -6 5 -5 2.70470 1.51752 1 6 -5 5 1.54590 0.87293 3 6 -5 5 2.07330 0.85306 2 -7 5 -5 113.421 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1401.54 63.02 1 0 -5 9 1547.88 67.75 3 0 -5 9 1424.28 60.85 2 -1 5 -9 4085.93 152.88 4 -1 5 -9 3597.60 164.79 1 1 -5 9 3959.01 175.45 3 1 -5 9 3864.33 160.46 2 -2 5 -9 469.855 19.118 4 -2 5 -9 482.928 21.989 1 2 -5 9 459.734 20.310 2 2 -5 9 499.264 23.265 3 -3 5 -9 109.228 6.789 1 3 -5 9 110.571 5.570 2 3 -5 9 128.953 7.039 3 -4 5 -9 22.3275 2.9893 1 4 -5 9 25.8456 2.5934 3 4 -5 9 21.4829 1.8749 2 -5 5 -9 69.6291 5.1291 1 5 -5 9 64.4579 4.5126 3 5 -5 9 61.4434 3.7576 2 -6 5 -9 144.245 8.658 1 6 -5 9 137.150 7.806 3 6 -5 9 134.686 6.996 2 -7 5 -9 85.3502 6.0939 1 7 -5 9 77.6734 4.6610 2 7 -5 9 71.7933 4.9932 3 -8 5 -9 77.3672 6.2267 1 8 -5 9 86.7501 5.1634 2 8 -5 9 84.9043 5.4215 3 -9 5 -9 17.1018 3.1420 1 9 -5 9 16.9811 2.4353 2 -10 5 -9 209.082 12.620 1 10 -5 9 217.864 11.096 2 -11 5 -9 26.2086 4.1985 1 11 -5 9 26.2744 3.3809 2 -12 5 -9 40.0153 5.4484 1 12 -5 9 40.1971 4.3520 2 -13 5 -9 4.81184 2.44260 1 13 -5 9 1.58770 1.86628 2 -15 -4 9 7.76986 3.22797 4 14 4 -9 43.8493 3.7001 1 -14 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18.4574 2.7817 4 4 7 -10 542.456 24.330 1 -4 -7 10 556.689 26.655 3 -4 -7 10 547.455 24.097 4 3 7 -10 51.9675 3.2615 1 -3 -7 10 47.0616 3.8629 4 -3 -7 10 53.1430 4.1706 3 2 7 -10 29.4293 2.3193 1 -2 -7 10 24.4083 2.8898 4 -2 -7 10 27.4811 3.2814 3 1 7 -10 8.96497 1.48853 1 -1 -7 10 11.0985 1.8929 4 -1 -7 10 8.66379 1.87627 3 0 7 -10 50.1444 2.6533 4 0 7 -10 50.0173 3.4989 1 0 -7 10 55.2046 3.6169 4 0 -7 10 50.8922 4.0988 3 -1 7 -10 115.522 5.063 4 -1 7 -10 112.255 6.396 1 1 -7 10 118.439 6.003 4 1 -7 10 111.931 6.990 3 -2 7 -10 1.07905 0.95997 1 2 -7 10 1.72019 0.74010 2 2 -7 10 4.16339 1.40787 3 -3 7 -10 161.832 8.938 1 3 -7 10 152.904 7.532 2 3 -7 10 171.983 9.277 3 -4 7 -10 879.693 38.880 1 4 -7 10 871.707 40.531 3 4 -7 10 833.753 36.532 2 -5 7 -10 13.2918 2.5573 1 5 -7 10 13.0164 2.1765 3 5 -7 10 14.7567 1.7974 2 -6 7 -10 110.947 7.568 1 6 -7 10 110.363 6.054 2 6 -7 10 120.284 7.128 3 -7 7 -10 2.93174 1.71844 1 7 -7 10 0.05117 1.06046 3 7 -7 10 -0.0690 1.1158 2 -8 7 -10 34.5360 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10 56.5051 4.6894 3 2 6 -10 14.8982 1.3302 4 2 6 -10 17.1870 1.6505 1 -2 -6 10 15.2388 2.5670 3 1 6 -10 65.9358 4.0958 1 1 6 -10 68.7996 3.3664 4 -1 -6 10 74.7906 5.2362 3 0 6 -10 1.67032 0.87691 1 0 6 -10 4.29590 0.72586 4 0 -6 10 4.49491 1.62418 3 -1 6 -10 87.0119 5.4975 1 -1 6 -10 101.264 4.303 4 1 -6 10 104.408 6.418 3 1 -6 10 90.4096 4.5397 2 -2 6 -10 320.293 15.319 1 2 -6 10 319.791 16.221 3 2 -6 10 312.512 13.786 2 -3 6 -10 227.294 11.298 1 3 -6 10 218.207 11.542 3 3 -6 10 199.965 9.626 2 -4 6 -10 10.8961 2.1892 1 4 -6 10 14.2504 2.2006 3 4 -6 10 9.65087 1.41810 2 -5 6 -10 41.7822 3.8323 1 5 -6 10 29.2109 2.5004 2 5 -6 10 39.0469 3.3908 3 -6 6 -10 2.83880 1.53341 1 6 -6 10 2.69165 1.35685 3 6 -6 10 3.98274 1.22960 2 -7 6 -10 481.066 23.762 1 7 -6 10 478.785 21.568 2 7 -6 10 489.373 23.628 3 -8 6 -10 223.395 13.022 1 8 -6 10 227.073 12.189 3 8 -6 10 233.247 11.297 2 -9 6 -10 2.24633 1.77925 1 9 -6 10 3.37100 1.55043 2 -10 6 -10 14.5870 3.3083 1 10 -6 10 1.47730 1.47460 2 -11 6 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2.28111 3 1 5 -10 149.942 7.633 1 1 5 -10 147.237 6.569 4 -1 -5 10 161.350 9.353 3 0 5 -10 127.262 6.822 1 0 5 -10 132.880 5.650 4 0 -5 10 122.783 5.727 2 0 -5 10 132.518 8.083 3 -1 5 -10 123.601 5.443 4 -1 5 -10 119.542 6.837 1 1 -5 10 137.500 7.939 3 1 -5 10 123.160 5.733 2 -2 5 -10 260.438 10.966 4 -2 5 -10 273.450 13.277 1 2 -5 10 253.463 11.716 2 2 -5 10 289.827 14.274 3 -3 5 -10 376.422 17.837 1 3 -5 10 341.304 16.068 2 3 -5 10 398.219 18.727 3 -4 5 -10 67.2663 4.9204 1 4 -5 10 66.6474 4.7755 3 4 -5 10 59.7349 3.6262 2 -5 5 -10 129.131 7.722 1 5 -5 10 119.371 6.206 2 5 -5 10 116.479 7.212 3 -6 5 -10 83.5133 6.2594 1 6 -5 10 91.9808 5.0142 2 6 -5 10 81.6741 5.5137 3 -7 5 -10 8.41567 2.35919 1 7 -5 10 9.43482 2.00452 3 7 -5 10 10.7512 1.8342 2 -8 5 -10 9.24719 2.38826 1 8 -5 10 11.5920 2.0382 2 8 -5 10 7.13948 1.79312 3 -9 5 -10 69.0340 5.8458 1 9 -5 10 65.9540 4.6058 2 -10 5 -10 25.7049 4.0373 1 10 -5 10 15.6206 2.6457 2 -11 5 -10 335.710 18.630 1 11 -5 10 346.347 16.825 2 -12 5 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6.0273 1 -15 -3 10 90.5179 7.5933 4 14 3 -10 76.9480 5.3122 1 -14 -3 10 91.7689 7.1203 4 13 3 -10 110.937 6.426 1 -13 -3 10 105.526 7.689 4 12 3 -10 219.842 11.231 1 -12 -3 10 241.229 12.745 4 11 3 -10 131.474 7.191 1 -11 -3 10 146.590 8.754 4 10 3 -10 219.903 10.702 1 -10 -3 10 225.347 11.980 4 9 3 -10 146.044 6.871 4 9 3 -10 142.749 7.295 1 -9 -3 10 144.895 8.538 4 8 3 -10 315.353 13.224 4 8 3 -10 320.778 14.170 1 -8 -3 10 270.050 18.627 3 -8 -3 10 308.231 15.012 4 7 3 -10 127.627 5.934 4 7 3 -10 127.308 6.346 1 -7 -3 10 116.185 10.392 3 6 3 -10 21.2353 1.6038 4 6 3 -10 18.9851 1.6443 1 -6 -3 10 15.2541 4.2800 3 5 3 -10 117.082 6.197 1 5 3 -10 134.600 5.837 4 -5 -3 10 128.835 10.294 3 4 3 -10 145.240 6.317 4 4 3 -10 141.801 6.820 1 -4 -3 10 120.904 10.265 3 3 3 -10 91.4761 4.7604 1 3 3 -10 89.0058 4.2821 4 -3 -3 10 89.8331 8.0510 3 2 3 -10 46.0528 2.5288 4 2 3 -10 47.8768 2.9206 1 -2 -3 10 35.3024 5.1313 3 1 3 -10 143.183 7.438 1 1 3 -10 150.053 6.573 4 -1 -3 10 155.392 6.488 2 -1 -3 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11.2706 2.2370 1 -15 -2 10 10.4198 3.2737 4 14 2 -10 3.01181 1.39106 1 -14 -2 10 3.20494 2.37717 4 13 2 -10 -0.3817 1.0175 1 -13 -2 10 -0.2742 1.6942 4 12 2 -10 291.768 13.996 1 -12 -2 10 296.472 15.244 4 11 2 -10 425.182 18.987 1 -11 -2 10 400.486 19.646 4 10 2 -10 95.1663 5.0060 4 10 2 -10 98.9083 5.4211 1 -10 -2 10 105.412 6.920 4 9 2 -10 64.9107 3.5287 4 9 2 -10 61.5702 3.7295 1 -9 -2 10 55.6584 8.2691 3 8 2 -10 2.29871 0.76824 4 8 2 -10 0.73469 0.70370 1 -8 -2 10 4.73953 3.81352 3 7 2 -10 33.6567 2.0960 4 7 2 -10 27.1478 2.0849 1 -7 -2 10 26.9182 5.7744 3 6 2 -10 924.137 35.450 4 6 2 -10 896.417 37.929 1 -6 -2 10 788.285 44.978 3 5 2 -10 1361.91 51.70 4 5 2 -10 1338.35 55.42 1 -5 -2 10 1151.28 63.32 3 4 2 -10 11.3685 1.3134 1 4 2 -10 14.4022 1.2520 4 -4 -2 10 10.9938 4.2915 3 3 2 -10 41.1801 2.4175 4 3 2 -10 40.5367 2.5896 1 -3 -2 10 44.0343 6.2659 3 2 2 -10 64.4529 3.2210 4 2 2 -10 57.1061 3.4947 1 -2 -2 10 51.8709 6.7115 3 -2 -2 10 63.9199 2.8316 2 1 2 -10 325.578 13.447 4 1 2 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15.756 4 7 -12 -10 316.290 16.616 3 -7 12 10 326.002 16.486 2 6 -12 -10 381.303 16.865 4 6 -12 -10 348.480 17.779 3 -6 12 10 345.547 17.662 2 5 -12 -10 10.1771 2.3825 4 5 -12 -10 9.45053 1.96763 3 -5 12 10 9.71374 2.48738 2 4 -12 -10 40.0520 3.5027 3 4 -12 -10 41.2181 3.8556 4 -4 12 10 36.0050 4.2712 2 3 -12 -10 26.4142 3.4079 4 -3 12 10 22.2925 3.4481 2 2 -12 -10 1.60553 1.53676 4 -2 12 10 1.18781 1.56955 2 1 -12 -10 1.89283 1.58241 4 -1 12 10 -0.0676 1.4624 2 0 -12 -10 15.7604 2.9652 4 0 12 10 9.14478 2.50964 2 -1 -12 -10 0.76013 1.78758 4 1 12 10 2.17944 2.08162 2 12 -13 -10 165.818 9.797 3 -12 13 10 157.604 9.752 2 11 -13 -10 1.98898 1.55385 3 -11 13 10 1.79883 1.63147 2 10 -13 -10 72.2858 5.2840 3 -10 13 10 68.9500 5.6355 2 9 -13 -10 144.810 8.643 3 -9 13 10 145.169 8.954 2 8 -13 -10 4.65942 1.66479 3 -8 13 10 7.34183 2.20188 2 7 -13 -10 25.9688 3.1160 3 7 -13 -10 36.2850 3.9203 4 -7 13 10 27.3815 3.7351 2 6 -13 -10 9.30659 2.37009 4 6 -13 -10 1.12418 1.31797 3 -6 13 10 3.63861 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3.5273 1 0 14 -11 584.017 27.282 1 0 -14 11 621.653 29.363 3 -1 14 -11 134.130 7.356 1 1 -14 11 121.510 7.940 3 -2 14 -11 21.0709 2.6875 1 2 -14 11 16.6733 2.7975 3 -3 14 -11 1.04067 1.23440 1 3 -14 11 0.33573 1.27532 3 -4 14 -11 12.5801 2.3306 1 4 -14 11 9.54720 2.33668 3 -5 14 -11 9.62602 2.39970 1 5 -14 11 15.0038 2.7018 3 -6 14 -11 182.251 10.848 1 6 -14 11 201.164 11.278 3 -7 14 -11 96.3846 7.1452 1 7 -14 11 113.141 7.323 3 -8 14 -11 30.8330 4.2588 1 8 -14 11 29.9439 3.8352 3 -9 14 -11 13.9792 3.2878 1 9 -14 11 13.3438 2.6520 3 -10 14 -11 45.6606 5.5556 1 7 13 -11 0.73102 1.19906 1 -7 -13 11 3.29200 2.20778 4 6 13 -11 -0.2266 0.9853 1 -6 -13 11 1.73962 1.80142 4 5 13 -11 184.133 9.825 1 -5 -13 11 198.353 11.028 4 4 13 -11 202.788 10.654 1 -4 -13 11 224.953 11.749 4 3 13 -11 2.90034 1.25385 1 -3 -13 11 5.16556 2.03883 4 2 13 -11 27.8075 2.6235 1 1 13 -11 122.666 7.047 1 -1 -13 11 133.031 7.946 3 0 13 -11 22.2223 2.6184 1 0 -13 11 22.3898 3.1075 3 -1 13 -11 162.943 8.571 1 1 -13 11 152.032 9.246 3 -2 13 -11 14.8959 2.2818 1 2 -13 11 11.0910 2.2699 3 -3 13 -11 4.82408 1.58976 1 3 -13 11 7.69018 2.00529 3 -4 13 -11 22.2628 3.0730 1 4 -13 11 20.8473 3.0527 3 -5 13 -11 80.8207 5.8909 1 5 -13 11 85.5417 6.1228 3 -6 13 -11 1.00052 1.63558 1 6 -13 11 1.39686 1.43533 3 -7 13 -11 1.95404 1.77441 1 7 -13 11 4.00219 1.80553 3 -8 13 -11 9.21450 2.75124 1 8 -13 11 6.93643 2.08523 3 -9 13 -11 96.6785 7.6719 1 9 -13 11 110.432 7.409 3 -10 13 -11 253.601 14.857 1 10 -13 11 259.804 14.419 3 -11 13 -11 106.664 8.030 2 11 -13 11 116.850 7.327 2 8 12 -11 22.4345 2.8797 1 -8 -12 11 27.7893 4.3134 4 7 12 -11 1.06228 1.17069 1 -7 -12 11 3.99035 2.10020 4 6 12 -11 222.803 11.293 1 -6 -12 11 228.434 12.438 4 5 12 -11 298.950 14.455 1 -5 -12 11 302.807 15.247 4 4 12 -11 173.109 8.931 1 -4 -12 11 169.388 9.793 4 3 12 -11 154.669 8.478 1 -3 -12 11 179.464 9.483 4 2 12 -11 6.09173 1.46470 1 -2 -12 11 4.35445 1.80596 3 1 12 -11 82.9149 5.0802 1 -1 -12 11 81.0600 5.7044 3 0 12 -11 19.2226 2.4109 1 0 -12 11 17.2157 2.6860 3 -1 12 -11 3.03276 1.28032 1 1 -12 11 5.62588 1.71698 3 -2 12 -11 30.7193 2.9494 1 2 -12 11 24.2936 3.1579 3 -3 12 -11 10.5832 1.9974 1 3 -12 11 8.63724 2.14789 3 -4 12 -11 47.5119 4.1174 1 4 -12 11 51.4816 4.3657 3 -5 12 -11 51.7663 4.4898 1 5 -12 11 56.3925 4.5551 3 -6 12 -11 -0.6861 1.5526 1 6 -12 11 2.19434 1.54537 3 -7 12 -11 468.948 23.232 1 7 -12 11 472.465 23.660 3 -8 12 -11 69.3578 5.8282 1 8 -12 11 61.7962 5.2204 3 -9 12 -11 34.8457 4.7842 1 -9 12 -11 28.6348 4.0988 2 9 -12 11 41.0360 4.0667 3 9 -12 11 41.8780 3.7120 2 -10 12 -11 39.3087 5.2461 1 10 -12 11 36.7410 4.4315 3 10 -12 11 43.4016 4.0204 2 -11 12 -11 9.36162 3.13449 1 11 -12 11 6.92179 2.37503 2 11 -12 11 9.49069 2.44520 3 9 11 -11 128.415 7.401 1 -9 -11 11 125.056 8.739 4 8 11 -11 250.460 12.704 1 -8 -11 11 266.060 14.209 4 7 11 -11 3.05696 1.28657 1 -7 -11 11 -0.6250 1.5205 4 6 11 -11 0.47945 0.96551 1 -6 -11 11 0.45602 1.69375 4 5 11 -11 23.6463 2.4049 1 -5 -11 11 22.9803 3.5295 4 4 11 -11 63.1767 4.2030 1 -4 -11 11 73.7110 5.4072 4 3 11 -11 5.56315 1.32776 1 -3 -11 11 5.13360 1.79128 3 -3 -11 11 0.97657 1.44203 4 2 11 -11 276.959 13.876 1 -2 -11 11 294.365 15.147 3 -2 -11 11 310.559 14.257 4 1 11 -11 48.1925 3.4715 1 -1 -11 11 48.9730 4.0374 3 0 11 -11 8.20398 1.67637 1 0 -11 11 9.86006 2.20216 3 -1 11 -11 104.708 6.150 1 1 -11 11 101.569 6.605 3 -2 11 -11 27.2802 2.7205 1 2 -11 11 21.5230 3.0098 3 -3 11 -11 95.3041 6.2806 1 3 -11 11 105.306 6.706 3 -4 11 -11 117.883 7.444 1 4 -11 11 126.114 7.748 3 -5 11 -11 76.1114 5.8093 1 5 -11 11 85.5101 5.8363 3 -6 11 -11 256.623 13.768 1 6 -11 11 251.289 13.756 3 -7 11 -11 28.8406 4.1118 1 7 -11 11 34.8659 3.6508 3 -8 11 -11 0.83987 1.68623 1 8 -11 11 1.47694 1.45840 3 8 -11 11 1.99885 1.56495 2 -9 11 -11 3.38229 2.27603 1 9 -11 11 1.95314 1.68934 2 9 -11 11 2.17998 1.51208 3 -10 11 -11 16.0209 3.4375 1 10 -11 11 18.6138 3.0744 3 10 -11 11 14.2414 2.6614 2 -11 11 -11 17.4203 3.9199 1 11 -11 11 17.5539 3.0356 3 11 -11 11 22.5854 3.2886 2 12 -11 11 153.791 9.172 2 10 10 -11 14.4307 2.2880 1 -10 -10 11 18.6179 3.7966 4 9 10 -11 6.14834 1.63873 1 -9 -10 11 13.8331 3.1914 4 8 10 -11 189.247 9.858 1 -8 -10 11 194.623 11.334 4 7 10 -11 292.547 14.148 1 -7 -10 11 298.524 15.264 4 6 10 -11 30.9912 2.6052 1 -6 -10 11 24.1727 3.6724 4 5 10 -11 17.0553 2.1220 1 -5 -10 11 21.4220 3.2347 4 4 10 -11 98.0115 5.7670 1 -4 -10 11 102.419 6.601 3 -4 -10 11 112.539 6.905 4 3 10 -11 82.0845 4.9939 1 -3 -10 11 83.7362 5.7771 3 -3 -10 11 83.4820 5.7015 4 2 10 -11 5.38048 1.28232 1 -2 -10 11 5.65927 1.80924 4 -2 -10 11 4.94086 1.84673 3 1 10 -11 19.3191 2.3306 1 -1 -10 11 20.2120 2.7094 4 -1 -10 11 20.0836 2.7341 3 0 10 -11 95.7965 5.6755 1 0 -10 11 98.5454 6.3799 3 -1 10 -11 110.714 6.425 1 1 -10 11 109.622 6.902 3 -2 10 -11 249.813 12.533 1 2 -10 11 248.706 13.271 3 -3 10 -11 41.0484 3.7055 1 3 -10 11 46.1321 3.9683 3 -4 10 -11 5.44458 1.74493 1 4 -10 11 2.41266 1.38511 3 -5 10 -11 24.4690 3.3944 1 5 -10 11 24.3174 3.1075 3 -6 10 -11 66.0464 5.3607 1 6 -10 11 66.7398 5.0010 3 6 -10 11 60.2867 4.1203 2 -7 10 -11 0.77558 1.53951 1 7 -10 11 -0.2843 1.1091 3 7 -10 11 1.92471 1.37024 2 -8 10 -11 55.9254 5.3399 1 8 -10 11 50.3869 3.9961 2 8 -10 11 54.3610 4.5689 3 -9 10 -11 34.0295 4.8723 1 9 -10 11 44.0211 4.0897 3 9 -10 11 42.0963 3.7310 2 -10 10 -11 31.2944 4.7381 1 10 -10 11 31.7524 3.6088 2 10 -10 11 33.4369 3.9928 3 -11 10 -11 0.61605 2.18436 1 11 -10 11 0.65974 1.68490 2 11 -10 11 2.38681 1.75922 3 12 -10 11 18.9401 3.1984 2 11 9 -11 176.879 9.657 1 -11 -9 11 181.876 11.286 4 10 9 -11 1.62724 1.13047 1 -10 -9 11 0.98526 2.02654 4 9 9 -11 39.5201 3.2515 1 -9 -9 11 44.9207 5.2906 4 8 9 -11 51.9008 3.7107 1 -8 -9 11 49.2047 5.4548 4 7 9 -11 385.674 17.925 1 -7 -9 11 387.457 18.697 4 6 9 -11 276.709 13.616 1 -6 -9 11 304.402 14.649 4 5 9 -11 1.93022 0.99008 1 -5 -9 11 1.78334 1.48470 4 4 9 -11 53.1180 3.7192 1 -4 -9 11 60.2775 4.6907 3 -4 -9 11 63.5414 4.7166 4 3 9 -11 629.901 28.474 1 -3 -9 11 651.889 30.801 3 -3 -9 11 641.117 27.797 4 2 9 -11 49.8601 3.5829 1 -2 -9 11 58.0998 4.2535 4 -2 -9 11 57.0512 4.3935 3 1 9 -11 497.534 22.784 1 -1 -9 11 498.019 24.661 3 -1 -9 11 516.134 22.021 4 0 9 -11 71.5387 4.4883 1 0 -9 11 63.9384 4.9190 3 -1 9 -11 3.36937 1.24700 1 1 -9 11 -0.5579 1.2140 3 -2 9 -11 16.9274 2.4019 1 2 -9 11 18.9343 2.6954 3 -3 9 -11 120.253 7.365 1 3 -9 11 128.806 7.670 3 -4 9 -11 647.563 29.630 1 4 -9 11 630.257 30.793 3 -5 9 -11 376.618 18.612 1 5 -9 11 376.442 18.931 3 5 -9 11 363.495 16.655 2 -6 9 -11 22.2538 3.4509 1 6 -9 11 24.2880 3.0750 3 6 -9 11 18.0358 2.2982 2 -7 9 -11 84.9999 6.2918 1 7 -9 11 75.6917 4.7762 2 7 -9 11 69.3505 5.3542 3 -8 9 -11 137.994 9.305 1 8 -9 11 136.837 7.624 2 8 -9 11 149.240 8.747 3 -9 9 -11 2.21773 1.91475 1 9 -9 11 0.30301 1.59069 2 9 -9 11 0.57504 1.46394 3 -10 9 -11 80.7322 6.9347 1 10 -9 11 80.7266 5.9702 3 10 -9 11 84.6283 5.6158 2 -11 9 -11 0.01647 1.91670 1 11 -9 11 0.67184 1.60627 2 -12 9 -11 1.11506 2.35380 1 12 -9 11 1.60844 1.69098 2 11 8 -11 4.13952 1.55546 1 -11 -8 11 5.43665 2.67709 4 10 8 -11 154.060 8.484 1 -10 -8 11 168.931 10.253 4 9 8 -11 0.46342 0.99959 1 -9 -8 11 0.85724 1.88127 4 8 8 -11 65.1222 4.2200 1 -8 -8 11 67.2832 5.4763 4 7 8 -11 51.8249 3.4984 1 -7 -8 11 43.6016 4.8638 4 6 8 -11 3.04634 1.08717 1 -6 -8 11 3.46370 1.73856 4 5 8 -11 45.5163 3.2288 1 -5 -8 11 49.6552 4.3492 3 -5 -8 11 47.1446 4.2861 4 4 8 -11 4.31594 1.18894 1 -4 -8 11 4.08730 1.61823 4 -4 -8 11 3.40747 1.73234 3 3 8 -11 1.72373 0.88088 1 -3 -8 11 0.43859 1.05872 4 -3 -8 11 -0.5353 1.1059 3 2 8 -11 52.6532 3.5328 1 -2 -8 11 54.0409 4.0900 4 -2 -8 11 53.6289 4.4304 3 1 8 -11 45.5065 3.3563 1 -1 -8 11 48.0501 3.7167 4 -1 -8 11 53.0956 4.1934 3 0 8 -11 21.6828 2.1800 1 0 -8 11 17.2816 2.6737 3 0 -8 11 22.0091 2.5704 4 -1 8 -11 93.3826 5.7289 1 1 -8 11 98.5961 6.4627 3 -2 8 -11 78.6980 5.2845 1 2 -8 11 87.2214 5.8129 3 -3 8 -11 357.648 17.754 1 3 -8 11 372.512 18.614 3 -4 8 -11 391.346 19.126 1 4 -8 11 414.176 19.775 3 4 -8 11 368.617 17.171 2 -5 8 -11 20.1237 3.1551 1 5 -8 11 18.3296 2.7344 3 5 -8 11 15.9803 1.9947 2 -6 8 -11 50.0377 4.5974 1 6 -8 11 49.6551 4.1329 3 6 -8 11 47.0795 3.4470 2 -7 8 -11 190.935 11.232 1 7 -8 11 188.310 10.642 3 7 -8 11 186.266 9.454 2 -8 8 -11 94.6843 7.2142 1 8 -8 11 96.2649 6.4355 3 8 -8 11 95.3758 5.7538 2 -9 8 -11 0.31022 1.77624 1 9 -8 11 5.84209 1.89128 3 9 -8 11 3.33658 1.63168 2 -10 8 -11 42.7074 5.4323 1 10 -8 11 39.8709 3.7480 2 -11 8 -11 51.5947 6.2010 1 11 -8 11 54.2748 4.4655 2 -12 8 -11 64.3575 6.5137 1 12 -8 11 57.5951 5.0534 2 12 7 -11 13.2064 2.1468 1 -12 -7 11 8.70043 3.07493 4 11 7 -11 20.2350 2.6037 1 -11 -7 11 24.2083 4.1135 4 10 7 -11 321.207 15.729 1 -10 -7 11 348.007 17.052 4 9 7 -11 4.40004 1.26011 1 -9 -7 11 2.71092 1.81643 4 8 7 -11 41.8237 3.0574 1 -8 -7 11 41.9075 4.7991 4 7 7 -11 26.1752 2.2845 1 -7 -7 11 24.0219 3.4723 4 6 7 -11 91.5980 5.1933 1 -6 -7 11 94.5382 6.5911 3 -6 -7 11 92.6715 6.2774 4 5 7 -11 55.2975 3.5875 1 -5 -7 11 52.2091 4.4505 4 -5 -7 11 63.7439 4.9927 3 4 7 -11 74.2259 4.4625 1 -4 -7 11 76.2765 5.7227 3 -4 -7 11 84.0578 5.4092 4 3 7 -11 -0.0003 0.6237 1 -3 -7 11 0.25471 1.11392 4 -3 -7 11 1.08761 1.28572 3 2 7 -11 30.6311 2.0007 4 2 7 -11 28.4398 2.3815 1 -2 -7 11 30.4986 3.7061 3 -2 -7 11 32.2374 3.0183 4 1 7 -11 89.8041 4.1201 4 1 7 -11 78.5435 4.8714 1 -1 -7 11 82.2231 5.2077 4 -1 -7 11 85.7681 6.0430 3 0 7 -11 15.2406 1.2556 4 0 7 -11 14.6479 1.9797 1 0 -7 11 16.2485 2.2453 4 0 -7 11 14.2291 2.5653 3 -1 7 -11 22.9494 2.3254 1 -1 7 -11 21.0689 1.4652 4 1 -7 11 21.9180 3.0031 3 -2 7 -11 24.6014 2.9134 1 2 -7 11 22.9408 3.0425 3 -3 7 -11 0.12726 1.01236 1 3 -7 11 -0.0316 1.0478 3 3 -7 11 0.76665 0.77278 2 -4 7 -11 635.486 29.200 1 4 -7 11 608.894 27.057 2 4 -7 11 648.737 30.500 3 5 -7 11 263.605 12.782 2 5 -7 11 301.053 14.873 3 -6 7 -11 132.731 8.348 1 6 -7 11 121.304 6.654 2 6 -7 11 127.892 7.770 3 -7 7 -11 17.1279 3.1106 1 7 -7 11 18.0923 2.7530 3 7 -7 11 12.5471 2.0938 2 -8 7 -11 37.9982 4.8145 1 8 -7 11 41.8968 3.8748 3 8 -7 11 42.7550 3.4816 2 -9 7 -11 67.9955 6.2440 1 9 -7 11 71.4698 5.2456 3 9 -7 11 68.4351 4.8774 2 -10 7 -11 -2.2352 1.7154 1 10 -7 11 -0.4132 1.3948 2 -11 7 -11 173.738 11.555 1 11 -7 11 167.119 9.558 2 -12 7 -11 3.88114 2.48936 1 12 -7 11 4.55683 2.20681 2 13 6 -11 36.4462 3.2981 1 -13 -6 11 21.4542 4.1484 4 12 6 -11 208.968 11.142 1 -12 -6 11 238.685 12.910 4 11 6 -11 539.880 24.763 1 -11 -6 11 548.661 25.469 4 10 6 -11 173.411 9.160 1 -10 -6 11 191.216 10.741 4 9 6 -11 1.14803 0.86832 1 -9 -6 11 -2.2337 1.4433 4 8 6 -11 84.4411 4.9082 1 -8 -6 11 86.4451 6.2171 4 7 6 -11 9.66264 1.54664 1 -7 -6 11 11.4745 2.4289 4 6 6 -11 8.74912 1.36582 1 -6 -6 11 10.1398 2.7019 3 -6 -6 11 10.3510 2.3899 4 5 6 -11 76.7028 4.1515 1 5 6 -11 64.2414 3.6315 4 -5 -6 11 68.4374 4.9653 4 -5 -6 11 63.6304 5.5888 3 4 6 -11 1.51451 0.75155 1 4 6 -11 0.71214 0.61167 4 -4 -6 11 0.67511 1.55482 3 -4 -6 11 0.72544 1.29307 4 3 6 -11 219.975 9.457 4 3 6 -11 211.960 10.439 1 -3 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1 11 -6 11 138.748 8.418 2 -12 6 -11 10.0825 3.3535 1 12 -6 11 10.7372 2.6812 2 14 5 -11 52.5370 4.1898 1 -14 -5 11 45.8681 5.8569 4 13 5 -11 34.9194 3.2914 1 -13 -5 11 34.2636 4.9433 4 12 5 -11 -0.4945 0.9373 1 -12 -5 11 -0.0763 1.9274 4 11 5 -11 35.3614 2.9759 1 -11 -5 11 32.0004 4.3476 4 10 5 -11 24.2820 2.2969 1 -10 -5 11 27.6908 4.0396 4 9 5 -11 88.0880 5.2146 1 -9 -5 11 98.5218 6.7323 4 8 5 -11 0.89865 0.79640 1 -8 -5 11 1.42368 1.47982 4 7 5 -11 97.3971 4.9393 4 7 5 -11 96.7210 5.2835 1 -7 -5 11 90.2710 7.4595 3 -7 -5 11 98.2768 6.5214 4 6 5 -11 25.8547 1.9650 4 6 5 -11 22.9756 2.0231 1 -6 -5 11 23.8474 3.3498 4 -6 -5 11 24.6301 4.0329 3 5 5 -11 4.41102 0.93229 4 5 5 -11 10.3890 1.3780 1 -5 -5 11 3.87384 2.24070 3 4 5 -11 13.3897 1.4078 4 4 5 -11 13.8940 1.6851 1 -4 -5 11 13.4770 3.0089 3 3 5 -11 156.836 7.074 4 3 5 -11 160.276 7.963 1 -3 -5 11 165.190 10.314 3 2 5 -11 890.987 39.612 1 2 5 -11 918.603 36.466 4 -2 -5 11 919.793 43.886 3 1 5 -11 1203.75 54.16 1 1 5 -11 1275.52 49.89 4 -1 -5 11 1280.97 59.15 3 0 5 -11 488.351 19.090 4 0 5 -11 432.857 21.252 1 0 -5 11 486.843 23.882 3 -1 5 -11 262.455 13.664 1 -1 5 -11 285.139 11.780 4 1 -5 11 311.793 15.517 3 1 -5 11 283.374 12.353 2 -2 5 -11 4.56215 1.38515 1 -2 5 -11 6.75782 0.86620 4 2 -5 11 6.44577 1.03138 2 2 -5 11 7.67238 2.02695 3 -3 5 -11 19.0230 2.7108 1 3 -5 11 13.6382 2.5070 3 3 -5 11 19.5068 1.7306 2 -4 5 -11 47.3021 3.8926 1 4 -5 11 33.6624 2.5965 2 4 -5 11 37.9347 3.5891 3 -5 5 -11 22.3415 3.2276 1 5 -5 11 21.9940 2.2953 2 5 -5 11 20.6334 2.8702 3 -6 5 -11 405.019 20.307 1 6 -5 11 405.729 20.406 3 6 -5 11 412.127 18.402 2 -7 5 -11 452.695 22.399 1 7 -5 11 458.049 22.264 3 7 -5 11 436.694 20.256 2 -8 5 -11 170.845 10.343 1 8 -5 11 158.076 8.634 2 -9 5 -11 223.884 12.887 1 9 -5 11 208.106 11.009 2 -10 5 -11 1.70044 1.83264 1 10 -5 11 -0.2993 1.4651 2 -11 5 -11 28.0054 4.5309 1 11 -5 11 23.6268 3.4352 2 -12 5 -11 13.9245 3.5509 1 12 -5 11 21.3011 3.4229 2 14 4 -11 9.15170 2.05119 1 -14 -4 11 8.92312 3.17164 4 13 4 -11 96.1424 6.0392 1 -13 -4 11 111.224 7.928 4 12 4 -11 420.083 19.744 1 -12 -4 11 434.444 20.873 4 11 4 -11 5.76381 1.32864 1 -11 -4 11 4.29117 2.13548 4 10 4 -11 151.724 8.007 1 -10 -4 11 163.616 9.591 4 9 4 -11 66.4415 4.0817 1 -9 -4 11 63.9311 5.2701 4 8 4 -11 8.81010 1.30047 4 8 4 -11 5.50110 1.19340 1 -8 -4 11 7.43662 3.59684 3 -8 -4 11 7.41203 2.14795 4 7 4 -11 76.1609 4.2334 1 7 4 -11 75.0209 3.9338 4 -7 -4 11 59.3274 7.4818 3 6 4 -11 19.3202 1.7333 1 6 4 -11 19.5655 1.6780 4 -6 -4 11 23.1737 4.6287 3 5 4 -11 564.047 24.663 1 5 4 -11 585.010 22.917 4 -5 -4 11 514.242 29.123 3 4 4 -11 2951.67 123.28 1 4 4 -11 2964.38 114.74 4 -4 -4 11 2775.20 133.90 3 3 4 -11 263.826 11.042 4 3 4 -11 265.445 12.147 1 -3 -4 11 246.191 15.303 3 2 4 -11 391.743 16.022 4 2 4 -11 392.852 17.614 1 -2 -4 11 376.795 20.905 3 1 4 -11 12.7816 1.6567 1 1 4 -11 10.4165 1.1667 4 -1 -4 11 14.0925 2.9704 3 0 4 -11 56.3295 2.7169 4 0 4 -11 43.0727 3.3705 1 0 -4 11 48.0803 2.5493 2 0 -4 11 46.5400 4.7026 3 -1 4 -11 14.9137 2.0950 1 -1 4 -11 13.5111 1.2123 4 1 -4 11 13.3678 1.3188 2 1 -4 11 11.6661 2.5082 3 -2 4 -11 14.1176 1.3174 4 -2 4 -11 14.8130 2.2332 1 2 -4 11 14.9000 2.6939 3 2 -4 11 16.8402 1.5549 2 -3 4 -11 417.171 19.577 1 3 -4 11 387.410 17.836 2 3 -4 11 427.753 20.870 3 -4 4 -11 4.26328 1.62462 1 4 -4 11 2.47180 1.35416 3 4 -4 11 0.48830 0.85098 2 -5 4 -11 58.2413 4.7757 1 5 -4 11 56.8146 4.5747 3 5 -4 11 59.2894 3.7967 2 -6 4 -11 7.44227 2.26385 1 6 -4 11 9.20254 1.98123 3 6 -4 11 10.3985 1.8523 2 -7 4 -11 38.3651 4.6770 1 7 -4 11 43.9941 3.5680 2 7 -4 11 46.9514 3.8884 3 -8 4 -11 -0.0475 1.3266 1 8 -4 11 -0.1778 1.2144 2 -9 4 -11 0.74599 1.73608 1 9 -4 11 1.62656 1.48698 2 -10 4 -11 206.059 12.119 1 10 -4 11 177.212 10.112 2 -11 4 -11 54.3212 6.2331 1 11 -4 11 50.2846 4.5862 2 -12 4 -11 10.6348 3.3854 1 12 -4 11 9.15121 2.45287 2 15 3 -11 56.8974 4.4996 1 -15 -3 11 58.7975 6.5724 4 14 3 -11 14.6728 2.3558 1 -14 -3 11 22.3178 4.0432 4 13 3 -11 438.473 20.472 1 -13 -3 11 442.732 21.541 4 12 3 -11 107.024 6.099 1 -12 -3 11 99.7296 7.4455 4 11 3 -11 0.84494 0.86057 1 -11 -3 11 0.87948 1.84837 4 10 3 -11 21.2000 1.9313 4 10 3 -11 18.6816 2.1265 1 -10 -3 11 19.8728 3.3468 4 9 3 -11 126.029 6.010 4 9 3 -11 121.553 6.378 1 -9 -3 11 124.570 7.739 4 -9 -3 11 102.071 10.255 3 8 3 -11 -0.1296 0.5653 1 8 3 -11 1.63498 0.72109 4 -8 -3 11 5.61737 3.61252 3 7 3 -11 248.006 10.465 4 7 3 -11 248.108 11.222 1 -7 -3 11 202.711 15.580 3 6 3 -11 618.721 26.277 1 6 3 -11 633.344 24.528 4 -6 -3 11 512.684 31.701 3 -5 -3 11 6.84460 3.44369 3 4 3 -11 69.8241 3.9443 1 4 3 -11 72.4829 3.6150 4 -4 -3 11 66.7994 8.0130 3 3 3 -11 16.7106 1.4819 4 3 3 -11 19.1508 1.6868 1 -3 -3 11 15.4545 3.9315 3 2 3 -11 157.747 6.856 4 2 3 -11 156.028 7.648 1 -2 -3 11 138.232 10.487 3 1 3 -11 693.578 31.274 1 1 3 -11 767.912 28.767 4 -1 -3 11 658.553 35.496 3 0 3 -11 99.1587 5.5003 1 0 3 -11 94.6096 4.5246 4 0 -3 11 94.9397 4.4710 2 0 -3 11 83.5365 7.0549 3 -1 3 -11 569.873 24.413 1 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6 -14 15.7133 2.0842 1 -8 -6 14 12.1339 2.8051 4 7 6 -14 62.5300 3.7530 4 7 6 -14 63.3995 4.1140 1 -7 -6 14 61.5310 7.1949 3 -7 -6 14 66.0595 5.5124 4 6 6 -14 23.0335 2.2332 1 6 6 -14 22.6084 1.9933 4 -6 -6 14 23.9502 3.6203 4 -6 -6 14 21.3767 4.4701 3 5 6 -14 59.2535 3.8727 1 5 6 -14 59.3651 3.3929 4 -5 -6 14 48.5349 6.2092 3 4 6 -14 305.083 12.797 4 4 6 -14 297.761 14.123 1 -4 -6 14 283.504 17.209 3 3 6 -14 547.957 25.001 1 3 6 -14 587.190 22.833 4 -3 -6 14 515.650 28.589 3 2 6 -14 58.3072 3.2230 4 2 6 -14 53.3524 3.8604 1 -2 -6 14 58.3768 5.7385 3 1 6 -14 404.025 20.011 1 1 6 -14 464.827 17.995 4 -1 -6 14 423.907 23.034 3 0 6 -14 49.8273 2.8260 4 0 6 -14 46.0409 3.6885 1 0 -6 14 51.1325 5.0675 3 -1 6 -14 37.6336 3.3596 1 1 -6 14 29.2318 4.3270 3 -2 6 -14 36.9358 3.4151 1 2 -6 14 30.3701 4.3001 3 -3 6 -14 1.30225 1.22095 1 3 -6 14 -2.1628 1.1849 3 -4 6 -14 185.113 10.429 1 4 -6 14 182.180 11.211 3 -5 6 -14 55.0183 4.6616 1 5 -6 14 42.6809 4.6770 3 -6 6 -14 12.3183 2.6597 1 6 -6 14 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3.0028 1 3 -4 21 17.6654 4.4197 3 -4 4 -21 48.6447 4.5966 1 -5 4 -21 0.18603 1.80986 1 -11 -3 21 34.4345 8.2921 3 10 3 -21 30.9439 3.3293 4 -10 -3 21 43.7789 8.8556 3 9 3 -21 43.2306 3.6188 4 -9 -3 21 38.8621 8.1709 3 8 3 -21 5.33856 1.65522 4 -8 -3 21 3.91914 4.21651 3 7 3 -21 -0.7338 1.1194 4 -7 -3 21 2.46596 4.18478 3 6 3 -21 23.3339 2.8623 4 -6 -3 21 27.2565 6.4207 3 5 3 -21 46.1810 3.7195 4 -5 -3 21 51.0041 8.1427 3 4 3 -21 83.9031 5.3206 4 -4 -3 21 96.3050 9.8523 3 3 3 -21 250.732 12.000 4 -3 -3 21 266.221 17.751 3 2 3 -21 67.9716 4.5488 4 -2 -3 21 73.3736 8.8817 3 -1 -3 21 8.55185 3.56218 3 0 -3 21 173.617 12.772 3 1 -3 21 14.9044 4.4131 3 2 -3 21 39.4856 6.1750 3 3 -3 21 10.9992 3.7760 3 -12 -2 21 19.0222 7.4593 3 11 2 -21 44.6119 3.8304 4 -11 -2 21 55.6735 10.2298 3 10 2 -21 34.2724 3.2269 4 -10 -2 21 38.4376 8.7589 3 9 2 -21 25.0722 2.9623 4 -9 -2 21 41.0346 8.5325 3 8 2 -21 114.303 6.703 4 -8 -2 21 131.509 13.223 3 7 2 -21 357.743 16.265 4 6 2 -21 441.566 19.871 4 -6 -2 21 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10.2240 3 9 -3 -21 55.1987 4.3568 4 -9 3 21 29.8071 9.3245 3 8 -3 -21 9.39783 2.22737 4 -8 3 21 11.8697 6.3247 3 7 -3 -21 105.038 6.506 4 -7 3 21 96.1227 14.1437 3 6 -3 -21 5.89002 1.94057 4 -6 3 21 9.54076 6.04004 3 5 -3 -21 11.3138 2.3789 4 -5 3 21 14.4978 6.2117 3 4 -3 -21 61.8787 4.6164 4 -4 3 21 58.8515 10.4155 3 3 -3 -21 5.09869 1.88248 4 -3 3 21 4.10049 4.51427 3 2 -3 -21 1.41607 1.48199 4 -2 3 21 0.62213 4.18742 3 1 -3 -21 37.7874 3.9370 4 0 -3 -21 62.9746 4.8263 4 -1 -3 -21 19.3905 3.0012 4 10 -4 -21 7.58660 2.20634 4 -10 4 21 3.26025 5.75213 3 9 -4 -21 2.23354 1.48153 4 -9 4 21 1.63283 5.33552 3 8 -4 -21 6.73519 1.92282 4 -8 4 21 7.24574 6.01619 3 7 -4 -21 24.6936 3.2880 4 -7 4 21 32.7066 8.9565 3 6 -4 -21 41.3039 3.7338 4 -6 4 21 21.2106 8.0665 3 5 -4 -21 130.388 7.552 4 -5 4 21 142.907 14.965 3 4 -4 -21 7.79095 2.05162 4 -4 4 21 3.61150 5.24223 3 3 -4 -21 16.3712 2.7074 4 -3 4 21 20.5658 7.0388 3 2 -4 -21 17.4645 2.7531 4 -2 4 21 20.2508 6.7059 3 1 -4 -21 56.4051 4.5827 4 0 -4 -21 75.1100 5.4326 4 9 -5 -21 162.969 8.940 4 -9 5 21 154.013 19.055 3 8 -5 -21 -0.6229 1.3813 4 -8 5 21 -0.7565 5.6490 3 7 -5 -21 12.8860 2.5077 4 -7 5 21 17.1883 7.7935 3 6 -5 -21 8.76628 2.11110 4 -6 5 21 2.24810 5.37310 3 5 -5 -21 1.33525 1.59159 4 -5 5 21 6.62635 6.33498 3 4 -5 -21 4.14177 1.73838 4 -4 5 21 -3.4553 5.0092 3 3 -5 -21 108.479 6.663 4 -3 5 21 104.903 14.054 3 2 -5 -21 215.724 11.130 4 -7 6 21 2.05541 6.08765 3 -6 6 21 190.573 18.972 3 -5 6 21 376.006 28.084 3 -4 6 21 14.5667 7.6167 3 -5 7 21 5.29068 6.58638 3 3 9 -22 -0.9827 1.2110 1 2 9 -22 77.6491 5.7627 1 1 9 -22 19.1244 3.0942 1 7 8 -22 122.153 6.798 4 -7 -8 22 106.153 9.330 4 -7 -8 22 120.385 10.939 3 6 8 -22 23.0025 2.8461 4 6 8 -22 19.1411 2.9664 1 -6 -8 22 20.7386 4.7445 4 -6 -8 22 27.3533 5.8465 3 5 8 -22 61.5588 4.9662 1 -5 -8 22 70.1292 8.4993 3 4 8 -22 0.66292 1.38298 1 -4 -8 22 2.09724 3.20541 3 3 8 -22 0.76401 1.43830 1 -3 -8 22 1.95983 3.05385 3 2 8 -22 -0.1444 1.2781 1 -2 -8 22 -0.4362 2.7663 3 1 8 -22 0.44702 1.27018 1 -1 -8 22 -1.3507 2.3442 3 0 8 -22 25.9542 3.5003 1 0 -8 22 33.0784 5.6121 3 -1 8 -22 13.7999 2.6659 1 8 7 -22 2.69171 1.57177 4 8 7 -22 3.19501 1.76782 1 -8 -7 22 2.74596 4.01526 3 7 7 -22 -0.1348 1.2850 4 7 7 -22 1.39753 1.63722 1 -7 -7 22 0.86120 3.75631 3 6 7 -22 3.07191 1.72095 1 6 7 -22 5.00193 1.69065 4 -6 -7 22 8.88174 4.40266 3 5 7 -22 69.7083 5.3546 1 -5 -7 22 76.6382 9.3632 3 4 7 -22 -0.0066 1.2742 1 -4 -7 22 3.23762 3.27423 3 3 7 -22 168.389 9.922 1 -3 -7 22 195.538 13.753 3 2 7 -22 104.737 6.825 1 -2 -7 22 109.946 9.720 3 1 7 -22 -0.0300 1.3337 1 -1 -7 22 -0.5431 2.4028 3 0 7 -22 4.46524 1.74216 1 0 -7 22 1.69880 2.93839 3 -1 7 -22 1.72974 1.53662 1 1 -7 22 2.32887 2.84871 3 -2 7 -22 2.07511 1.64926 1 9 6 -22 15.2635 2.7203 1 -9 -6 22 13.2323 5.4061 3 8 6 -22 6.91800 1.88018 4 8 6 -22 3.72672 1.83075 1 -8 -6 22 7.21016 4.35358 3 7 6 -22 39.8153 3.3378 4 7 6 -22 37.0006 4.1614 1 -7 -6 22 45.1673 7.6498 3 6 6 -22 229.542 11.032 4 6 6 -22 215.665 11.966 1 -6 -6 22 249.725 16.943 3 5 6 -22 165.160 8.564 4 5 6 -22 156.877 9.317 1 -5 -6 22 196.166 13.943 3 4 6 -22 1.39599 1.42339 1 -4 -6 22 -3.5021 2.4078 3 3 6 -22 11.1677 2.2987 1 -3 -6 22 16.6389 4.9535 3 2 6 -22 3.14591 1.65383 1 -2 -6 22 9.20496 3.96424 3 1 6 -22 54.7951 4.3002 1 -1 -6 22 40.4264 6.6047 3 0 6 -22 47.9676 4.2578 1 0 -6 22 53.0303 7.0973 3 -1 6 -22 56.1485 4.5034 1 1 -6 22 47.3807 6.8623 3 -2 6 -22 72.6429 5.4893 1 2 -6 22 79.4147 7.8867 3 -3 6 -22 23.9285 3.4699 1 3 -6 22 19.2535 4.4727 3 -10 -5 22 65.0544 9.7468 3 9 5 -22 34.9365 3.3253 4 -9 -5 22 29.8674 6.8599 3 8 5 -22 0.90063 1.41200 1 8 5 -22 -0.3896 1.2680 4 -8 -5 22 1.44729 4.01152 3 7 5 -22 24.5478 2.8832 4 7 5 -22 18.3581 2.9302 1 -7 -5 22 31.1767 6.6422 3 6 5 -22 2.25631 1.52074 1 6 5 -22 0.80384 1.29049 4 -6 -5 22 -0.0023 3.4795 3 5 5 -22 29.8164 3.4298 1 5 5 -22 25.5978 2.9355 4 -5 -5 22 30.4875 6.2966 3 4 5 -22 9.01495 2.10590 1 4 5 -22 10.6832 2.0211 4 -4 -5 22 16.6264 5.0755 3 3 5 -22 16.7128 2.6728 1 -3 -5 22 17.8703 5.0648 3 2 5 -22 142.030 8.398 1 -2 -5 22 156.486 12.078 3 1 5 -22 29.0837 3.3984 1 -1 -5 22 24.0083 5.3861 3 0 5 -22 0.07874 1.29919 1 0 -5 22 1.48957 2.97327 3 -1 5 -22 5.44606 1.83002 1 1 -5 22 12.6841 3.9390 3 -2 5 -22 4.69960 1.76105 1 2 -5 22 12.9768 4.1106 3 -3 5 -22 82.1082 6.1159 1 3 -5 22 88.7173 8.3343 3 -10 -4 22 53.7269 9.0908 3 9 4 -22 5.59545 1.72603 4 -9 -4 22 7.93915 5.09420 3 8 4 -22 14.6056 2.3375 4 -8 -4 22 13.6071 5.3977 3 7 4 -22 72.6369 4.8998 4 -7 -4 22 91.2353 10.9210 3 6 4 -22 1.32744 1.46554 4 -6 -4 22 6.02044 4.34938 3 5 4 -22 154.662 8.560 4 -5 -4 22 206.667 14.770 3 4 4 -22 41.1972 3.5063 4 -4 -4 22 48.0467 7.4306 3 3 4 -22 -1.0146 1.2457 4 -3 -4 22 -0.5409 2.8517 3 -2 -4 22 6.50234 3.76234 3 -1 -4 22 13.8013 4.3046 3 0 -4 22 53.2518 7.1928 3 1 -4 22 101.103 9.281 3 2 -4 22 135.710 10.828 3 3 -4 22 21.4213 4.8209 3 -11 -3 22 83.1861 11.8624 3 -10 -3 22 -0.3756 4.2550 3 9 3 -22 14.8028 2.5013 4 -9 -3 22 17.0427 5.9288 3 8 3 -22 86.3839 5.5278 4 -8 -3 22 96.9885 11.9534 3 7 3 -22 31.0277 3.4378 4 -7 -3 22 39.2776 7.7477 3 6 3 -22 17.0545 2.5948 4 -6 -3 22 16.3505 5.3954 3 5 3 -22 15.5962 2.4813 4 -5 -3 22 22.3761 5.7410 3 4 3 -22 26.8021 3.2105 4 -4 -3 22 30.7719 6.5065 3 3 3 -22 3.81676 1.66482 4 -3 -3 22 -2.6930 2.8991 3 -2 -3 22 0.91957 3.15829 3 -1 -3 22 51.5881 7.4880 3 0 -3 22 35.8151 6.3354 3 1 -3 22 43.5719 6.4305 3 2 -3 22 -0.2638 2.7729 3 -11 -2 22 29.1271 8.1060 3 10 2 -22 20.6789 2.8341 4 -10 -2 22 24.9142 7.7846 3 9 2 -22 18.8864 2.7252 4 -9 -2 22 16.3171 6.1534 3 8 2 -22 28.5168 3.3374 4 -8 -2 22 37.2065 7.9984 3 7 2 -22 96.3446 5.9967 4 -7 -2 22 97.1699 12.3256 3 6 2 -22 112.469 6.611 4 -6 -2 22 108.384 11.490 3 5 2 -22 60.9837 4.5637 4 -5 -2 22 68.0845 9.6601 3 4 2 -22 576.091 25.233 4 -4 -2 22 602.313 33.950 3 3 2 -22 169.290 8.900 4 -3 -2 22 181.244 14.031 3 2 2 -22 25.4422 3.0327 4 -2 -2 22 27.4815 5.9585 3 -1 -2 22 19.8870 5.1283 3 0 -2 22 15.3481 4.4322 3 1 -2 22 61.2874 7.8853 3 -11 -1 22 10.9279 6.6503 3 10 1 -22 3.29086 1.70575 4 -10 -1 22 2.10347 5.07549 3 9 1 -22 45.9580 3.8867 4 -9 -1 22 56.8915 10.4021 3 8 1 -22 12.6023 2.2991 4 -8 -1 22 9.56778 5.27800 3 7 1 -22 153.723 8.427 4 -7 -1 22 151.483 14.738 3 6 1 -22 19.0738 2.8850 4 -6 -1 22 38.0350 7.9611 3 5 1 -22 26.8508 3.2421 4 -5 -1 22 24.8389 6.6845 3 4 1 -22 7.76476 2.05848 4 -4 -1 22 2.72891 4.04596 3 3 1 -22 16.1017 2.5643 4 -3 -1 22 19.9965 5.8125 3 2 1 -22 -1.3458 1.3229 4 -2 -1 22 -0.5076 3.1328 3 -1 -1 22 21.3780 5.3264 3 0 -1 22 -0.4951 2.9876 3 1 -1 22 30.8763 5.7815 3 10 0 -22 -2.1489 1.2135 4 -10 0 22 -2.0310 4.4868 3 9 0 -22 0.47394 1.31816 4 -9 0 22 0.15458 4.52946 3 8 0 -22 33.8909 3.7379 4 -8 0 22 39.9716 8.8015 3 7 0 -22 1.82084 1.66003 4 -7 0 22 1.44954 4.15040 3 6 0 -22 200.514 10.218 4 -6 0 22 196.656 16.851 3 5 0 -22 213.974 10.944 4 -5 0 22 230.571 18.089 3 4 0 -22 211.198 10.589 4 -4 0 22 206.290 16.815 3 3 0 -22 30.1681 3.3568 4 -3 0 22 39.3639 7.4510 3 2 0 -22 148.868 8.052 4 -2 0 22 143.176 12.750 3 1 0 -22 67.0349 4.8375 4 -1 0 22 78.4392 9.5506 3 0 0 22 -1.6994 2.5969 3 10 -1 -22 -1.8069 1.2626 4 -10 1 22 -4.4564 4.2849 3 9 -1 -22 29.7861 3.4553 4 -9 1 22 29.3608 8.4764 3 8 -1 -22 40.7497 3.8187 4 -8 1 22 47.9390 9.7974 3 7 -1 -22 22.5574 3.0776 4 -7 1 22 27.7937 7.7058 3 6 -1 -22 272.936 13.197 4 -6 1 22 272.159 21.190 3 5 -1 -22 208.429 10.642 4 -5 1 22 210.499 17.774 3 4 -1 -22 6.78293 2.08234 4 -4 1 22 3.68057 4.45942 3 3 -1 -22 0.87768 1.33101 4 -3 1 22 1.53481 3.76957 3 2 -1 -22 153.624 8.506 4 -2 1 22 172.335 14.058 3 1 -1 -22 177.793 9.121 4 -1 1 22 158.338 13.581 3 9 -2 -22 111.589 6.819 4 -9 2 22 102.200 14.812 3 8 -2 -22 71.6783 5.1690 4 -8 2 22 67.4310 11.6438 3 7 -2 -22 32.7834 3.7202 4 -7 2 22 36.1893 9.0195 3 6 -2 -22 78.4905 5.4687 4 -6 2 22 80.4973 12.3629 3 5 -2 -22 2.70503 1.74398 4 -5 2 22 1.65008 4.76959 3 4 -2 -22 79.4158 5.4585 4 -4 2 22 97.7840 12.7830 3 3 -2 -22 1.14035 1.57883 4 -3 2 22 3.99873 4.61501 3 2 -2 -22 24.0155 3.1776 4 -2 2 22 26.6644 6.6186 3 1 -2 -22 65.8676 4.8822 4 -1 2 22 61.2823 9.0410 3 0 -2 -22 42.3300 3.8989 4 9 -3 -22 33.6045 3.8070 4 -9 3 22 23.0938 8.4719 3 8 -3 -22 2.42324 1.55767 4 -8 3 22 -4.3516 4.4306 3 7 -3 -22 3.64092 1.73361 4 -7 3 22 2.33947 5.42079 3 6 -3 -22 69.8410 5.1270 4 -6 3 22 70.3196 12.1023 3 5 -3 -22 25.1054 3.1546 4 -5 3 22 19.7835 7.0772 3 4 -3 -22 28.4530 3.4443 4 -4 3 22 28.6479 7.8415 3 -3 3 22 48.8045 9.2956 3 2 -3 -22 0.49077 1.45650 4 -2 3 22 1.36382 4.20060 3 1 -3 -22 50.2565 4.2949 4 0 -3 -22 35.1552 3.9581 4 7 -4 -22 28.2482 3.5763 4 -7 4 22 26.6750 8.6571 3 6 -4 -22 118.908 6.948 4 -6 4 22 95.1043 14.3795 3 5 -4 -22 16.6949 2.6812 4 -5 4 22 17.7521 7.5289 3 4 -4 -22 8.93859 2.26097 4 -4 4 22 6.80050 5.43054 3 3 -4 -22 -1.1590 1.3244 4 -3 4 22 -2.9137 4.2621 3 -5 5 22 253.935 21.789 3 -4 5 22 70.0015 12.3379 3 4 8 -23 3.22046 1.71865 1 3 8 -23 83.0561 6.0230 1 2 8 -23 190.333 10.742 1 7 7 -23 31.7957 3.4603 4 6 7 -23 121.865 7.526 1 6 7 -23 110.246 6.520 4 5 7 -23 150.023 8.928 1 4 7 -23 35.7361 4.0289 1 3 7 -23 28.6764 3.6071 1 2 7 -23 6.15472 1.95894 1 1 7 -23 -0.2077 1.3729 1 0 7 -23 16.9056 2.8517 1 8 6 -23 1.40501 1.45153 1 7 6 -23 56.0148 4.8404 1 7 6 -23 65.4322 4.5503 4 6 6 -23 2.13794 1.61901 1 6 6 -23 2.56887 1.66585 4 -6 -6 23 2.55764 3.61647 3 5 6 -23 46.5329 4.2555 1 -5 -6 23 63.1261 8.5787 3 4 6 -23 5.88541 1.85519 1 -4 -6 23 3.08617 3.60176 3 3 6 -23 24.4289 3.2696 1 -3 -6 23 20.1793 5.2163 3 2 6 -23 6.35015 1.96707 1 -2 -6 23 4.76177 3.60766 3 1 6 -23 2.48504 1.60676 1 -1 -6 23 1.46459 2.90578 3 0 6 -23 41.0082 3.8932 1 -1 6 -23 43.5036 4.1222 1 8 5 -23 126.412 7.195 4 7 5 -23 35.9655 3.3996 4 -7 -5 23 45.5527 7.8394 3 6 5 -23 107.407 6.421 4 -6 -5 23 110.713 10.837 3 5 5 -23 162.289 8.762 4 -5 -5 23 191.707 14.225 3 -4 -5 23 42.4555 7.2786 3 -3 -5 23 12.1361 4.5701 3 -2 -5 23 -0.0798 3.0277 3 -1 -5 23 59.1360 7.9986 3 0 -5 23 96.0899 9.0190 3 8 4 -23 60.8908 4.4840 4 -8 -4 23 62.1109 9.3434 3 7 4 -23 23.8277 3.0796 4 -7 -4 23 33.9603 7.2625 3 6 4 -23 12.5455 2.3466 4 -6 -4 23 17.0961 5.4731 3 5 4 -23 32.6398 3.4866 4 -5 -4 23 30.6574 6.4815 3 4 4 -23 134.561 7.415 4 -3 -4 23 215.271 15.811 3 -2 -4 23 3.01549 3.14240 3 -1 -4 23 145.619 11.821 3 0 -4 23 2.51487 3.19807 3 1 -4 23 17.7286 4.6317 3 8 3 -23 29.1486 3.3888 4 -8 -3 23 27.1516 7.1554 3 7 3 -23 5.99400 1.90405 4 -7 -3 23 4.44997 4.21612 3 6 3 -23 32.8971 3.6004 4 -6 -3 23 45.9916 7.9834 3 5 3 -23 13.9392 2.4977 4 -5 -3 23 20.6902 5.5716 3 4 3 -23 0.44487 1.49693 4 -4 -3 23 -2.8117 3.1145 3 3 3 -23 4.68170 1.83694 4 -3 -3 23 -1.0673 3.2668 3 -2 -3 23 50.1581 7.6406 3 -1 -3 23 -0.6522 2.9351 3 0 -3 23 12.1345 4.2352 3 1 -3 23 180.732 13.256 3 8 2 -23 208.802 10.972 4 -8 -2 23 240.234 18.646 3 7 2 -23 5.51573 1.95720 4 -7 -2 23 5.12084 4.79489 3 6 2 -23 5.78149 1.93225 4 -6 -2 23 4.78722 4.51416 3 5 2 -23 31.7198 3.5376 4 -5 -2 23 30.4258 6.5538 3 4 2 -23 51.3122 4.1275 4 -4 -2 23 45.5855 7.8460 3 3 2 -23 14.7624 2.5046 4 -3 -2 23 19.1315 5.3517 3 -2 -2 23 26.0303 5.9426 3 -1 -2 23 10.7354 4.1248 3 0 -2 23 51.0797 7.5030 3 1 -2 23 9.10555 3.97846 3 8 1 -23 21.5273 3.0719 4 -8 -1 23 16.8067 6.3275 3 7 1 -23 1.12083 1.60192 4 -7 -1 23 4.47717 4.95075 3 6 1 -23 5.03821 1.91095 4 -6 -1 23 3.08252 4.37491 3 5 1 -23 28.4974 3.3734 4 -5 -1 23 29.6308 7.1493 3 4 1 -23 3.45535 1.76912 4 -4 -1 23 3.64948 4.15951 3 3 1 -23 74.6707 5.1843 4 -3 -1 23 75.8185 10.0405 3 2 1 -23 -1.9315 1.4085 4 -2 -1 23 -1.3887 3.3005 3 -1 -1 23 55.8893 8.0658 3 0 -1 23 46.6148 7.0997 3 8 0 -23 25.6649 3.3362 4 -8 0 23 14.8007 6.3298 3 7 0 -23 4.75314 1.85812 4 -7 0 23 9.80824 5.42055 3 6 0 -23 30.2928 3.5853 4 -6 0 23 44.9485 8.8199 3 5 0 -23 23.8975 3.1364 4 -5 0 23 20.8823 6.2486 3 4 0 -23 0.36921 1.63321 4 -4 0 23 3.39716 4.13347 3 3 0 -23 5.35213 2.07978 4 -3 0 23 8.10895 4.71826 3 2 0 -23 294.883 14.021 4 -2 0 23 294.797 20.039 3 -1 0 23 288.147 19.127 3 0 0 23 17.2959 4.9907 3 8 -1 -23 0.27525 1.37396 4 7 -1 -23 3.04873 1.74173 4 -7 1 23 -0.8840 4.0820 3 6 -1 -23 -0.5742 1.4577 4 -6 1 23 0.62966 3.97927 3 5 -1 -23 135.207 7.796 4 4 -1 -23 183.282 9.597 4 -4 1 23 179.744 15.869 3 3 -1 -23 26.0482 3.3196 4 -3 1 23 23.1309 6.5105 3 2 -1 -23 137.770 7.798 4 -2 1 23 145.808 13.088 3 1 -1 -23 5.81949 2.04142 4 -1 1 23 6.00243 4.15723 3 7 -2 -23 2.48336 1.71728 4 6 -2 -23 5.25326 1.98744 4 -6 2 23 7.93573 5.24188 3 5 -2 -23 100.125 6.426 4 -5 2 23 107.856 13.685 3 4 -2 -23 -2.7356 1.3622 4 -4 2 23 2.34821 4.06859 3 3 -2 -23 20.7607 3.0216 4 -3 2 23 15.1467 5.7959 3 2 -2 -23 2.09808 1.78734 4 -2 2 23 -1.0075 3.8790 3 1 -2 -23 4.60513 2.09039 4 -4 3 23 111.604 14.235 3 -3 3 23 201.072 17.128 3 6 6 -24 76.9456 5.2284 4 6 5 -24 26.6636 3.2444 4 6 4 -24 23.5388 3.1100 4 5 4 -24 48.2845 4.0910 4 6 3 -24 22.5260 3.0085 4 5 3 -24 100.336 6.263 4 4 3 -24 11.2778 2.4183 4 7 2 -24 9.04858 2.19938 4 6 2 -24 48.6963 4.2396 4 5 2 -24 44.1497 4.0118 4 4 2 -24 39.0665 3.7280 4 6 1 -24 82.3151 5.5932 4 5 1 -24 46.1327 4.1081 4 4 1 -24 15.4636 2.6254 4 3 1 -24 27.1659 3.3322 4 6 0 -24 3.02096 1.66072 4 5 0 -24 9.55602 2.34738 4 4 0 -24 100.357 6.349 4 3 0 -24 1.74996 1.80268 4 2 0 -24 7.37869 2.18349 4 0 0 0 0.00 0.00 0 ; _shelx_hkl_checksum 97848 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' 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 Mo1 Mo 0.46038(3) 0.47851(3) 0.13259(2) 0.02003(8) Uani 1 1 d . U . . . Mo2 Mo 0.51574(3) 0.85223(3) 0.12677(2) 0.02115(8) Uani 1 1 d . U . . . Mo3 Mo 0.35615(3) 0.48271(3) 0.28893(2) 0.02050(8) Uani 1 1 d . U . . . Mo4 Mo 0.64290(3) 0.58910(3) 0.44195(2) 0.02153(8) Uani 1 1 d . U . . . Mo5 Mo 0.74255(3) 0.54646(3) 0.28619(2) 0.02088(8) Uani 1 1 d . U . . . Mo6 Mo 0.77927(3) 0.95552(3) 0.26964(2) 0.02232(8) Uani 1 1 d . U . . . Mo7 Mo 0.43750(3) 0.74338(3) 0.43312(2) 0.02037(8) Uani 1 1 d . U . . . Mo8 Mo 0.28508(3) 0.63026(3) 0.15243(2) 0.02015(8) Uani 1 1 d . U . . . Mo9 Mo 0.40701(3) 0.89898(3) 0.29642(2) 0.02092(8) Uani 1 1 d . U . . . Mo10 Mo 0.85610(3) 0.79441(3) 0.41626(2) 0.02328(8) Uani 1 1 d . U . . . Mo11 Mo 0.66455(3) 0.95906(3) 0.43845(2) 0.02115(8) Uani 1 1 d . U . . . Mo12 Mo 0.70943(3) 0.71347(3) 0.13685(2) 0.02067(8) Uani 1 1 d . U . . . P13 P 0.57114(7) 0.72026(7) 0.28375(5) 0.0154(2) Uani 1 1 d . U . . . O1 O 0.3590(2) 0.6152(2) 0.35849(16) 0.0228(6) Uani 1 1 d . U . . . O2 O 0.3797(2) 0.4093(2) 0.20293(16) 0.0245(6) Uani 1 1 d . U . . . O3 O 0.3947(2) 0.7285(2) 0.11031(16) 0.0230(6) Uani 1 1 d . U . . . O4 O 0.4672(3) 0.9154(2) 0.05624(17) 0.0298(6) Uani 1 1 d . U . . . O5 O 0.5614(2) 0.6801(2) 0.46260(16) 0.0232(6) Uani 1 1 d . U . . . O6 O 0.3778(2) 0.7284(2) 0.50495(16) 0.0274(6) Uani 1 1 d . U . . . O7 O 0.3620(2) 0.8266(2) 0.37696(16) 0.0220(6) Uani 1 1 d . U . . . O8 O 0.4951(2) 0.4984(2) 0.35993(15) 0.0224(6) Uani 1 1 d . U . . . O9 O 0.7638(2) 0.6425(2) 0.21238(16) 0.0248(6) Uani 1 1 d . U . . . O10 O 0.6017(2) 0.7832(2) 0.08066(15) 0.0227(6) Uani 1 1 d . U . . . O11 O 0.8910(2) 1.0661(2) 0.27997(19) 0.0338(7) Uani 1 1 d . U . . . O12 O 0.8077(2) 0.8517(2) 0.18831(16) 0.0237(6) Uani 1 1 d . U . . . O13 O 0.7213(2) 0.9917(2) 0.34717(16) 0.0255(6) Uani 1 1 d . U . . . O14 O 0.2614(2) 0.3834(2) 0.31002(18) 0.0294(6) Uani 1 1 d . U . . . O15 O 0.1594(2) 0.6131(2) 0.08427(17) 0.0303(7) Uani 1 1 d . U . . . O16 O 0.5364(2) 0.79655(19) 0.33749(15) 0.0184(5) Uani 1 1 d . U . . . O17 O 0.8719(2) 0.6724(2) 0.36156(17) 0.0262(6) Uani 1 1 d . U . . . O18 O 0.5990(2) 0.4776(2) 0.21719(16) 0.0242(6) Uani 1 1 d . U . . . O19 O 0.5648(2) 0.8844(2) 0.48417(16) 0.0240(6) Uani 1 1 d . U . . . O20 O 0.8520(2) 0.8723(2) 0.33931(16) 0.0255(6) Uani 1 1 d . U . . . O21 O 0.6216(2) 0.78238(19) 0.22817(15) 0.0188(5) Uani 1 1 d . U . . . O22 O 0.4432(2) 0.3658(2) 0.06784(17) 0.0297(6) Uani 1 1 d . U . . . O23 O 0.6616(2) 0.6791(2) 0.33360(15) 0.0195(5) Uani 1 1 d . U . . . O24 O 0.8176(2) 0.4638(2) 0.26673(17) 0.0294(6) Uani 1 1 d . U . . . O25 O 0.5329(2) 0.9971(2) 0.37385(16) 0.0228(6) Uani 1 1 d . U . . . O26 O 0.7630(2) 0.6784(2) 0.06567(17) 0.0295(6) Uani 1 1 d . U . . . O27 O 0.6473(3) 0.5196(2) 0.51311(17) 0.0328(7) Uani 1 1 d . U . . . O28 O 0.5636(2) 0.5863(2) 0.10861(16) 0.0227(6) Uani 1 1 d . U . . . O29 O 0.3089(2) 0.7514(2) 0.22518(16) 0.0225(6) Uani 1 1 d . U . . . O30 O 0.4702(2) 0.9125(2) 0.21403(16) 0.0232(6) Uani 1 1 d . U . . . O31 O 0.3134(2) 0.9680(2) 0.27829(18) 0.0296(6) Uani 1 1 d . U . . . O32 O 0.7088(2) 0.5063(2) 0.37490(16) 0.0233(6) Uani 1 1 d . U . . . O33 O 0.3300(2) 0.5154(2) 0.09139(15) 0.0230(6) Uani 1 1 d . U . . . O34 O 0.7356(2) 1.0774(2) 0.50507(17) 0.0300(6) Uani 1 1 d . U . . . O35 O 0.7665(2) 0.8824(2) 0.45463(16) 0.0248(6) Uani 1 1 d . U . . . O36 O 0.4654(2) 0.62266(19) 0.23479(15) 0.0185(5) Uani 1 1 d . U . . . O37 O 0.9870(2) 0.8569(2) 0.48190(18) 0.0350(7) Uani 1 1 d . U . . . O38 O 0.6673(2) 0.9688(2) 0.18521(16) 0.0243(6) Uani 1 1 d . U . . . O39 O 0.2432(2) 0.5279(2) 0.20920(16) 0.0221(6) Uani 1 1 d . U . . . O40 O 0.7858(2) 0.6960(2) 0.47823(16) 0.0266(6) Uani 1 1 d . U . . . O1B O 0.6890(3) 0.8209(2) 0.76648(19) 0.0371(7) Uani 1 1 d . U . . . O3B O 0.2884(3) 0.7795(3) 0.72618(19) 0.0397(8) Uani 1 1 d . U . . . O1A O 0.0856(4) 0.8238(3) 0.2978(2) 0.0478(9) Uani 1 1 d . U . . . N1A N 0.1272(3) 0.6992(3) 0.3993(2) 0.0311(8) Uani 1 1 d . U . . . H1A H 0.158460 0.768967 0.414830 0.037 Uiso 1 1 calc R U . . . O1C O 0.6485(4) 0.8734(4) -0.0464(3) 0.0521(11) Uani 1 1 d . U . . . O3C O 0.8595(3) 1.2145(3) 0.0289(2) 0.0446(8) Uani 1 1 d . U . . . O2A O 0.0224(3) 0.6867(3) 0.1919(2) 0.0464(8) Uani 1 1 d . U . . . O2B O 0.6275(4) 0.7880(3) 0.6351(2) 0.0463(9) Uani 1 1 d . U . . . O1D O 0.9622(4) 0.3031(4) 0.2195(3) 0.0567(11) Uani 1 1 d . . . . . O3A O 0.0704(3) 0.5402(3) 0.4354(2) 0.0469(9) Uani 1 1 d . U . . . N2A N 0.1418(3) 0.6292(3) 0.5887(2) 0.0392(9) Uani 1 1 d . U . . . H2A1 H 0.161756 0.666697 0.638115 0.059 Uiso 1 1 calc R U . . . H2A2 H 0.070969 0.581842 0.575279 0.059 Uiso 1 1 calc R U . . . H2A3 H 0.190830 0.593089 0.584797 0.059 Uiso 1 1 calc R U . . . C3B C 0.3729(4) 0.7887(3) 0.7817(3) 0.0308(9) Uani 1 1 d . U . . . N1B N 0.4727(3) 0.7854(3) 0.7733(2) 0.0362(9) Uani 1 1 d . U . . . H1B H 0.529512 0.794324 0.814582 0.043 Uiso 1 1 calc R U . . . N1C N 0.8640(3) 1.0962(3) -0.0719(2) 0.0406(10) Uani 1 1 d . U . . . H1C H 0.903749 1.082151 -0.101384 0.049 Uiso 1 1 calc R U . . . C1A C 0.0628(4) 0.7219(4) 0.2626(3) 0.0340(10) Uani 1 1 d . U . . . O2D O -0.0420(3) 0.4601(3) 0.1251(2) 0.0607(11) Uani 1 1 d . . . . . C3A C 0.1108(3) 0.6412(3) 0.4519(3) 0.0282(9) Uani 1 1 d . U . . . C1B C 0.6129(4) 0.7955(3) 0.7044(3) 0.0315(10) Uani 1 1 d . U . . . O3D O 0.2831(4) 0.5874(3) -0.0630(2) 0.0616(11) Uani 1 1 d . . . . . N2B N 0.2635(3) 0.8322(3) 0.8661(2) 0.0389(9) Uani 1 1 d . U . . . H2B1 H 0.259699 0.840950 0.915070 0.058 Uiso 1 1 calc R U . . . H2B2 H 0.266892 0.894166 0.850019 0.058 Uiso 1 1 calc R U . . . H2B3 H 0.201187 0.778865 0.834202 0.058 Uiso 1 1 calc R U . . . C4A C 0.1447(4) 0.7046(3) 0.5358(3) 0.0309(9) Uani 1 1 d . U . . . H4A1 H 0.221519 0.756869 0.550569 0.037 Uiso 1 1 calc R U . . . H4A2 H 0.091898 0.744706 0.540276 0.037 Uiso 1 1 calc R U . . . O4D O 0.8476(4) 0.8714(4) 0.6346(3) 0.0731(13) Uani 1 1 d . . . . . C2B C 0.4881(4) 0.7672(4) 0.6967(3) 0.0361(10) Uani 1 1 d . U . . . H2B4 H 0.454517 0.811714 0.665241 0.043 Uiso 1 1 calc R U . . . H2B5 H 0.448663 0.691057 0.669742 0.043 Uiso 1 1 calc R U . . . C1C C 0.9076(4) 1.1876(4) -0.0172(3) 0.0312(9) Uani 1 1 d . U . . . C2A C 0.0945(4) 0.6496(4) 0.3163(3) 0.0321(9) Uani 1 1 d . U . . . H2A4 H 0.029520 0.583228 0.303749 0.039 Uiso 1 1 calc R U . . . H2A5 H 0.157924 0.629020 0.306143 0.039 Uiso 1 1 calc R U . . . O5D O 1.0375(3) 0.9601(3) 0.1960(3) 0.0668(12) Uani 1 1 d . . . . . C4B C 0.3670(4) 0.8034(4) 0.8646(3) 0.0376(10) Uani 1 1 d . U . . . H4B1 H 0.364109 0.736245 0.882511 0.045 Uiso 1 1 calc R U . . . H4B2 H 0.435186 0.860974 0.899621 0.045 Uiso 1 1 calc R U . . . O6D O 0.0925(4) 0.1874(4) 0.1625(3) 0.0788(14) Uani 1 1 d . . . . . O7D O 0.9469(4) 0.6859(5) 0.6250(3) 0.0663(12) Uani 1 1 d D . . . . C4C C 1.0231(4) 1.2596(4) -0.0163(3) 0.0473(13) Uani 1 1 d . U . . . H4C1 H 1.070574 1.214759 -0.023777 0.057 Uiso 1 1 calc R U . . . H4C2 H 1.012654 1.296364 -0.059555 0.057 Uiso 1 1 calc R U . . . C3C C 0.7513(4) 0.9447(4) -0.0290(3) 0.0491(13) Uani 1 1 d . U . . . C2C C 0.7527(4) 1.0191(4) -0.0843(3) 0.0367(10) Uani 1 1 d . U . . . H2C1 H 0.724630 0.975398 -0.137811 0.044 Uiso 1 1 calc R U . . . H2C2 H 0.700010 1.059013 -0.079186 0.044 Uiso 1 1 calc R U . . . N2C N 1.0809(4) 1.3404(4) 0.0576(4) 0.0765(17) Uani 1 1 d . U . . . H2C3 H 1.148769 1.381828 0.056736 0.115 Uiso 1 1 calc R U . . . H2C4 H 1.037951 1.382271 0.064190 0.115 Uiso 1 1 calc R U . . . H2C5 H 1.091581 1.306712 0.097317 0.115 Uiso 1 1 calc R U . . . O2C O 0.8317(5) 0.9507(5) 0.0266(3) 0.1021(16) Uani 1 1 d . U . . . H1DA H 0.963(6) 0.356(6) 0.203(4) 0.08(3) Uiso 1 1 d . . . . . H1DB H 0.985(8) 0.304(7) 0.265(6) 0.12(4) Uiso 1 1 d . . . . . H1BA H 0.691(6) 0.807(5) 0.639(4) 0.07(2) Uiso 1 1 d . . . . . H7DA H 0.889(6) 0.716(7) 0.612(6) 0.15(4) Uiso 1 1 d D . . . . H1CA H 0.647(5) 0.841(5) -0.026(3) 0.035(19) Uiso 1 1 d . . . . . H7DB H 0.941(13) 0.615(4) 0.606(9) 0.28(8) Uiso 1 1 d D . . . . H1AA H 0.062(7) 0.856(7) 0.272(5) 0.11(3) Uiso 1 1 d . . . . . 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 Mo1 0.02092(17) 0.01755(16) 0.01889(18) -0.00009(13) 0.00572(14) 0.00455(13) Mo2 0.02258(17) 0.02143(17) 0.02101(18) 0.00846(14) 0.00722(14) 0.00747(14) Mo3 0.02116(17) 0.01740(16) 0.02210(18) 0.00480(13) 0.00770(14) 0.00394(13) Mo4 0.02434(18) 0.02424(18) 0.01853(18) 0.00776(14) 0.00631(14) 0.01079(14) Mo5 0.02100(17) 0.02126(17) 0.02251(19) 0.00480(14) 0.00661(14) 0.01047(14) Mo6 0.02107(17) 0.01855(17) 0.02527(19) 0.00396(14) 0.00846(14) 0.00259(13) Mo7 0.02268(17) 0.02109(17) 0.01915(18) 0.00393(13) 0.00906(14) 0.00787(14) Mo8 0.01713(16) 0.02078(17) 0.02002(18) 0.00318(13) 0.00342(13) 0.00523(13) Mo9 0.02384(17) 0.01876(17) 0.02217(19) 0.00457(13) 0.00674(14) 0.01054(14) Mo10 0.01843(17) 0.02421(18) 0.02340(19) 0.00293(14) 0.00155(14) 0.00696(14) Mo11 0.02330(17) 0.01680(16) 0.02001(18) -0.00042(13) 0.00504(14) 0.00525(13) Mo12 0.02136(17) 0.02173(17) 0.02061(18) 0.00466(13) 0.00985(14) 0.00661(13) P13 0.0158(5) 0.0144(5) 0.0156(5) 0.0026(4) 0.0048(4) 0.0046(4) O1 0.0246(14) 0.0228(13) 0.0219(14) 0.0050(11) 0.0078(11) 0.0085(11) O2 0.0265(14) 0.0184(13) 0.0268(15) 0.0034(11) 0.0084(12) 0.0049(11) O3 0.0232(13) 0.0252(14) 0.0214(14) 0.0065(11) 0.0074(11) 0.0080(11) O4 0.0390(17) 0.0331(16) 0.0255(16) 0.0152(13) 0.0137(13) 0.0171(13) O5 0.0243(14) 0.0245(14) 0.0208(14) 0.0039(11) 0.0062(11) 0.0092(11) O6 0.0301(15) 0.0319(15) 0.0244(15) 0.0068(12) 0.0121(12) 0.0130(12) O7 0.0236(14) 0.0228(13) 0.0240(15) 0.0073(11) 0.0103(12) 0.0105(11) O8 0.0240(13) 0.0216(13) 0.0213(14) 0.0050(11) 0.0063(11) 0.0077(11) O9 0.0225(14) 0.0263(14) 0.0268(15) 0.0070(12) 0.0080(12) 0.0091(11) O10 0.0260(14) 0.0237(14) 0.0192(14) 0.0053(11) 0.0081(11) 0.0081(11) O11 0.0303(16) 0.0245(15) 0.0409(19) 0.0043(13) 0.0127(14) -0.0001(12) O12 0.0207(13) 0.0232(14) 0.0270(15) 0.0059(11) 0.0097(12) 0.0045(11) O13 0.0272(14) 0.0214(14) 0.0264(15) 0.0040(11) 0.0079(12) 0.0066(11) O14 0.0271(15) 0.0242(14) 0.0337(17) 0.0067(12) 0.0105(13) 0.0023(12) O15 0.0215(14) 0.0338(16) 0.0293(16) 0.0057(13) 0.0008(12) 0.0064(12) O16 0.0211(13) 0.0174(12) 0.0167(13) 0.0025(10) 0.0066(11) 0.0064(10) O17 0.0192(13) 0.0276(14) 0.0303(16) 0.0030(12) 0.0067(12) 0.0079(11) O18 0.0266(14) 0.0209(13) 0.0253(15) 0.0065(11) 0.0076(12) 0.0079(11) O19 0.0285(14) 0.0217(13) 0.0203(14) 0.0005(11) 0.0086(12) 0.0072(11) O20 0.0217(14) 0.0251(14) 0.0274(15) 0.0035(12) 0.0059(12) 0.0070(11) O21 0.0207(13) 0.0168(12) 0.0190(14) 0.0039(10) 0.0070(11) 0.0057(10) O22 0.0323(16) 0.0256(15) 0.0256(16) -0.0031(12) 0.0062(13) 0.0077(12) O23 0.0197(13) 0.0196(13) 0.0197(14) 0.0050(10) 0.0065(11) 0.0066(10) O24 0.0314(15) 0.0301(15) 0.0330(17) 0.0076(13) 0.0110(13) 0.0186(13) O25 0.0276(14) 0.0185(13) 0.0229(15) 0.0029(11) 0.0074(12) 0.0097(11) O26 0.0291(15) 0.0356(16) 0.0258(16) 0.0056(13) 0.0131(13) 0.0102(13) O27 0.0413(17) 0.0360(16) 0.0276(16) 0.0175(13) 0.0100(14) 0.0184(14) O28 0.0220(13) 0.0232(13) 0.0223(15) 0.0050(11) 0.0076(11) 0.0059(11) O29 0.0214(13) 0.0238(13) 0.0222(14) 0.0048(11) 0.0065(11) 0.0079(11) O30 0.0258(14) 0.0208(13) 0.0251(15) 0.0056(11) 0.0098(12) 0.0091(11) O31 0.0333(16) 0.0283(15) 0.0346(17) 0.0102(13) 0.0137(13) 0.0172(13) O32 0.0278(14) 0.0227(13) 0.0248(15) 0.0082(11) 0.0096(12) 0.0137(11) O33 0.0208(13) 0.0232(14) 0.0197(14) 0.0003(11) 0.0040(11) 0.0036(11) O34 0.0333(16) 0.0218(14) 0.0279(16) -0.0036(12) 0.0083(13) 0.0037(12) O35 0.0260(14) 0.0250(14) 0.0218(15) 0.0042(11) 0.0035(12) 0.0101(11) O36 0.0181(12) 0.0167(12) 0.0183(13) 0.0016(10) 0.0044(10) 0.0043(10) O37 0.0266(15) 0.0336(16) 0.0355(18) 0.0029(14) -0.0020(13) 0.0086(13) O38 0.0267(14) 0.0196(13) 0.0265(15) 0.0064(11) 0.0098(12) 0.0055(11) O39 0.0195(13) 0.0219(13) 0.0228(14) 0.0046(11) 0.0052(11) 0.0051(11) O40 0.0262(14) 0.0275(14) 0.0260(15) 0.0070(12) 0.0051(12) 0.0107(12) O1B 0.0433(18) 0.0350(17) 0.0321(18) 0.0048(14) 0.0077(15) 0.0164(15) O3B 0.0377(18) 0.0429(19) 0.0310(18) 0.0007(14) 0.0030(15) 0.0127(15) O1A 0.060(2) 0.041(2) 0.039(2) 0.0063(17) 0.0127(18) 0.0167(18) N1A 0.0278(18) 0.0253(18) 0.032(2) 0.0002(15) 0.0063(16) 0.0023(15) O1C 0.048(2) 0.050(2) 0.059(3) 0.033(2) 0.0169(19) 0.0070(18) O3C 0.0424(19) 0.0439(19) 0.040(2) -0.0026(15) 0.0234(16) -0.0018(15) O2A 0.052(2) 0.051(2) 0.0299(19) 0.0038(15) 0.0076(16) 0.0150(17) O2B 0.046(2) 0.062(2) 0.033(2) 0.0047(17) 0.0151(17) 0.0215(19) O1D 0.054(2) 0.063(3) 0.049(3) 0.015(2) 0.010(2) 0.017(2) O3A 0.058(2) 0.0281(17) 0.045(2) 0.0037(15) 0.0151(18) 0.0022(15) N2A 0.042(2) 0.036(2) 0.032(2) 0.0109(17) 0.0013(18) 0.0092(18) C3B 0.038(2) 0.021(2) 0.031(2) 0.0038(17) 0.010(2) 0.0075(18) N1B 0.040(2) 0.040(2) 0.027(2) 0.0088(17) 0.0078(17) 0.0120(18) N1C 0.040(2) 0.040(2) 0.044(2) 0.0034(18) 0.0263(19) 0.0070(18) C1A 0.024(2) 0.040(3) 0.033(2) 0.0004(19) 0.0102(19) 0.0052(19) O2D 0.059(2) 0.052(2) 0.058(3) 0.0021(19) 0.019(2) 0.0024(19) C3A 0.022(2) 0.028(2) 0.034(2) 0.0051(18) 0.0086(18) 0.0072(17) C1B 0.044(3) 0.020(2) 0.033(3) 0.0025(18) 0.012(2) 0.0150(19) O3D 0.076(3) 0.075(3) 0.046(2) 0.023(2) 0.026(2) 0.032(2) N2B 0.046(2) 0.038(2) 0.037(2) 0.0127(18) 0.0202(19) 0.0111(18) C4A 0.034(2) 0.029(2) 0.034(2) 0.0113(18) 0.014(2) 0.0131(18) O4D 0.054(2) 0.104(4) 0.064(3) 0.016(3) 0.023(2) 0.026(2) C2B 0.041(2) 0.035(2) 0.031(2) 0.002(2) 0.010(2) 0.013(2) C1C 0.031(2) 0.033(2) 0.031(2) 0.0110(18) 0.0105(19) 0.0091(18) C2A 0.028(2) 0.037(2) 0.029(2) 0.0011(18) 0.0083(18) 0.0106(19) O5D 0.063(3) 0.057(2) 0.098(3) 0.017(2) 0.051(3) 0.022(2) C4B 0.042(3) 0.042(3) 0.031(2) 0.013(2) 0.013(2) 0.013(2) O6D 0.059(3) 0.089(3) 0.078(3) -0.005(3) 0.005(2) 0.035(2) O7D 0.055(3) 0.099(4) 0.046(3) 0.015(2) 0.014(2) 0.029(3) C4C 0.032(3) 0.050(3) 0.059(3) 0.017(3) 0.022(2) 0.003(2) C3C 0.037(3) 0.053(3) 0.058(4) 0.030(3) 0.008(2) 0.014(2) C2C 0.041(3) 0.031(2) 0.035(3) 0.0048(19) 0.015(2) 0.0058(19) N2C 0.049(3) 0.064(3) 0.096(4) -0.011(3) 0.034(3) -0.011(2) O2C 0.096(2) 0.103(2) 0.103(2) 0.0566(18) 0.0169(16) 0.0233(17) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Mo Mo -1.6832 0.6857 '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 O22 Mo1 O28 103.67(13) . . ? O22 Mo1 O33 103.87(13) . . ? O28 Mo1 O33 98.07(12) . . ? O22 Mo1 O2 99.10(13) . . ? O28 Mo1 O2 154.92(11) . . ? O33 Mo1 O2 86.44(11) . . ? O22 Mo1 O18 98.62(13) . . ? O28 Mo1 O18 84.63(11) . . ? O33 Mo1 O18 155.95(11) . . ? O2 Mo1 O18 81.66(11) . . ? O22 Mo1 O36 170.96(12) . . ? O28 Mo1 O36 85.36(10) . . ? O33 Mo1 O36 74.94(10) . . ? O2 Mo1 O36 71.93(9) . . ? O18 Mo1 O36 81.50(10) . . ? O4 Mo2 O3 103.90(13) . . ? O4 Mo2 O10 100.84(13) . . ? O3 Mo2 O10 95.94(11) . . ? O4 Mo2 O30 102.46(13) . . ? O3 Mo2 O30 86.73(11) . . ? O10 Mo2 O30 155.17(11) . . ? O4 Mo2 O38 98.42(13) . . ? O3 Mo2 O38 156.96(11) . . ? O10 Mo2 O38 85.30(11) . . ? O30 Mo2 O38 82.93(11) . . ? O4 Mo2 O21 168.93(12) . . ? O3 Mo2 O21 86.40(10) . . ? O10 Mo2 O21 73.67(10) . . ? O30 Mo2 O21 81.89(10) . . ? O38 Mo2 O21 71.82(9) . . ? O14 Mo3 O8 104.58(13) . . ? O14 Mo3 O2 102.48(13) . . ? O8 Mo3 O2 96.32(12) . . ? O14 Mo3 O1 102.16(12) . . ? O8 Mo3 O1 86.05(11) . . ? O2 Mo3 O1 153.77(11) . . ? O14 Mo3 O39 98.35(12) . . ? O8 Mo3 O39 155.87(11) . . ? O2 Mo3 O39 85.82(11) . . ? O1 Mo3 O39 81.84(11) . . ? O14 Mo3 O36 169.11(12) . . ? O8 Mo3 O36 86.00(10) . . ? O2 Mo3 O36 73.33(10) . . ? O1 Mo3 O36 80.81(10) . . ? O39 Mo3 O36 71.54(9) . . ? O27 Mo4 O5 104.22(13) . . ? O27 Mo4 O40 102.72(14) . . ? O5 Mo4 O40 96.07(12) . . ? O27 Mo4 O8 102.17(13) . . ? O5 Mo4 O8 84.46(11) . . ? O40 Mo4 O8 154.15(12) . . ? O27 Mo4 O32 99.01(13) . . ? O5 Mo4 O32 155.30(11) . . ? O40 Mo4 O32 86.79(12) . . ? O8 Mo4 O32 82.55(11) . . ? O27 Mo4 O23 170.35(12) . . ? O5 Mo4 O23 85.15(10) . . ? O40 Mo4 O23 73.57(10) . . ? O8 Mo4 O23 80.75(10) . . ? O32 Mo4 O23 72.10(9) . . ? O24 Mo5 O18 103.77(13) . . ? O24 Mo5 O32 101.44(13) . . ? O18 Mo5 O32 96.24(12) . . ? O24 Mo5 O9 101.37(13) . . ? O18 Mo5 O9 86.32(11) . . ? O32 Mo5 O9 155.72(11) . . ? O24 Mo5 O17 99.04(13) . . ? O18 Mo5 O17 155.98(11) . . ? O32 Mo5 O17 86.42(12) . . ? O9 Mo5 O17 81.89(11) . . ? O24 Mo5 O23 170.54(12) . . ? O18 Mo5 O23 85.43(10) . . ? O32 Mo5 O23 74.99(10) . . ? O9 Mo5 O23 81.18(10) . . ? O17 Mo5 O23 72.17(9) . . ? O11 Mo6 O13 104.83(13) . . ? O11 Mo6 O38 101.67(13) . . ? O13 Mo6 O38 98.25(12) . . ? O11 Mo6 O20 102.09(13) . . ? O13 Mo6 O20 85.98(12) . . ? O38 Mo6 O20 153.89(11) . . ? O11 Mo6 O12 98.02(13) . . ? O13 Mo6 O12 155.42(11) . . ? O38 Mo6 O12 85.69(11) . . ? O20 Mo6 O12 80.44(11) . . ? O11 Mo6 O21 168.07(12) . . ? O13 Mo6 O21 86.80(10) . . ? O38 Mo6 O21 73.53(10) . . ? O20 Mo6 O21 81.04(10) . . ? O12 Mo6 O21 70.97(9) . . ? O6 Mo7 O1 103.69(13) . . ? O6 Mo7 O7 103.18(12) . . ? O1 Mo7 O7 94.58(11) . . ? O6 Mo7 O5 102.44(12) . . ? O1 Mo7 O5 85.98(11) . . ? O7 Mo7 O5 153.47(11) . . ? O6 Mo7 O19 100.35(13) . . ? O1 Mo7 O19 155.27(11) . . ? O7 Mo7 O19 85.49(11) . . ? O5 Mo7 O19 83.23(11) . . ? O6 Mo7 O16 170.87(11) . . ? O1 Mo7 O16 84.99(10) . . ? O7 Mo7 O16 72.89(10) . . ? O5 Mo7 O16 80.76(10) . . ? O19 Mo7 O16 71.36(10) . . ? O15 Mo8 O29 104.97(13) . . ? O15 Mo8 O39 102.34(13) . . ? O29 Mo8 O39 98.08(12) . . ? O15 Mo8 O3 100.54(13) . . ? O29 Mo8 O3 85.92(11) . . ? O39 Mo8 O3 154.84(11) . . ? O15 Mo8 O33 96.96(13) . . ? O29 Mo8 O33 156.18(11) . . ? O39 Mo8 O33 85.99(11) . . ? O3 Mo8 O33 80.97(10) . . ? O15 Mo8 O36 168.80(12) . . ? O29 Mo8 O36 86.22(10) . . ? O39 Mo8 O36 75.27(10) . . ? O3 Mo8 O36 80.25(10) . . ? O33 Mo8 O36 72.05(9) . . ? O31 Mo9 O25 103.78(13) . . ? O31 Mo9 O30 102.15(13) . . ? O25 Mo9 O30 96.03(12) . . ? O31 Mo9 O7 100.97(12) . . ? O25 Mo9 O7 89.35(12) . . ? O30 Mo9 O7 154.24(11) . . ? O31 Mo9 O29 99.94(13) . . ? O25 Mo9 O29 155.93(11) . . ? O30 Mo9 O29 82.84(11) . . ? O7 Mo9 O29 82.13(11) . . ? O31 Mo9 O16 172.88(12) . . ? O25 Mo9 O16 74.59(10) . . ? O30 Mo9 O16 84.95(10) . . ? O7 Mo9 O16 72.20(9) . . ? O29 Mo9 O16 81.37(9) . . ? O37 Mo10 O20 104.01(14) . . ? O37 Mo10 O17 103.31(13) . . ? O20 Mo10 O17 97.58(12) . . ? O37 Mo10 O40 99.58(14) . . ? O20 Mo10 O40 154.35(11) . . ? O17 Mo10 O40 86.55(12) . . ? O37 Mo10 O35 100.79(13) . . ? O20 Mo10 O35 85.03(12) . . ? O17 Mo10 O35 154.31(11) . . ? O40 Mo10 O35 80.76(11) . . ? O37 Mo10 O23 170.18(12) . . ? O20 Mo10 O23 85.72(10) . . ? O17 Mo10 O23 73.59(10) . . ? O40 Mo10 O23 71.11(10) . . ? O35 Mo10 O23 81.17(10) . . ? O34 Mo11 O19 103.12(13) . . ? O34 Mo11 O35 103.12(13) . . ? O19 Mo11 O35 97.99(12) . . ? O34 Mo11 O25 100.20(13) . . ? O19 Mo11 O25 87.31(12) . . ? O35 Mo11 O25 154.16(11) . . ? O34 Mo11 O13 100.87(13) . . ? O19 Mo11 O13 154.53(12) . . ? O35 Mo11 O13 84.71(12) . . ? O25 Mo11 O13 80.11(11) . . ? O34 Mo11 O16 171.43(12) . . ? O19 Mo11 O16 74.30(10) . . ? O35 Mo11 O16 85.38(10) . . ? O25 Mo11 O16 71.67(9) . . ? O13 Mo11 O16 80.72(10) . . ? O26 Mo12 O12 103.41(13) . . ? O26 Mo12 O9 102.78(13) . . ? O12 Mo12 O9 96.80(12) . . ? O26 Mo12 O10 100.02(13) . . ? O12 Mo12 O10 87.58(11) . . ? O9 Mo12 O10 155.05(11) . . ? O26 Mo12 O28 100.90(12) . . ? O12 Mo12 O28 154.91(11) . . ? O9 Mo12 O28 83.73(11) . . ? O10 Mo12 O28 82.14(11) . . ? O26 Mo12 O21 171.33(12) . . ? O12 Mo12 O21 74.31(10) . . ? O9 Mo12 O21 85.84(10) . . ? O10 Mo12 O21 71.67(10) . . ? O28 Mo12 O21 80.73(9) . . ? O16 P13 O36 109.65(14) . . ? O16 P13 O21 109.37(14) . . ? O36 P13 O21 109.20(14) . . ? O16 P13 O23 109.81(14) . . ? O36 P13 O23 109.42(14) . . ? O21 P13 O23 109.38(14) . . ? Mo7 O1 Mo3 151.10(15) . . ? Mo3 O2 Mo1 125.77(13) . . ? Mo2 O3 Mo8 149.49(15) . . ? Mo4 O5 Mo7 153.26(16) . . ? Mo7 O7 Mo9 126.03(13) . . ? Mo3 O8 Mo4 151.91(15) . . ? Mo12 O9 Mo5 152.39(15) . . ? Mo2 O10 Mo12 124.70(14) . . ? Mo12 O12 Mo6 124.98(13) . . ? Mo6 O13 Mo11 151.37(15) . . ? P13 O16 Mo9 126.65(14) . . ? P13 O16 Mo11 126.82(14) . . ? Mo9 O16 Mo11 88.60(8) . . ? P13 O16 Mo7 125.46(13) . . ? Mo9 O16 Mo7 88.74(8) . . ? Mo11 O16 Mo7 88.18(8) . . ? Mo10 O17 Mo5 125.22(14) . . ? Mo5 O18 Mo1 150.86(15) . . ? Mo11 O19 Mo7 126.16(14) . . ? Mo10 O20 Mo6 151.91(15) . . ? P13 O21 Mo2 125.09(14) . . ? P13 O21 Mo12 125.92(13) . . ? Mo2 O21 Mo12 89.93(9) . . ? P13 O21 Mo6 125.22(14) . . ? Mo2 O21 Mo6 89.79(8) . . ? Mo12 O21 Mo6 89.66(8) . . ? P13 O23 Mo5 126.72(14) . . ? P13 O23 Mo4 125.98(14) . . ? Mo5 O23 Mo4 89.21(8) . . ? P13 O23 Mo10 125.09(13) . . ? Mo5 O23 Mo10 88.99(8) . . ? Mo4 O23 Mo10 88.95(8) . . ? Mo9 O25 Mo11 124.77(13) . . ? Mo1 O28 Mo12 152.97(16) . . ? Mo8 O29 Mo9 152.83(15) . . ? Mo9 O30 Mo2 152.51(15) . . ? Mo5 O32 Mo4 123.67(13) . . ? Mo1 O33 Mo8 123.17(13) . . ? Mo11 O35 Mo10 152.14(16) . . ? P13 O36 Mo8 126.55(14) . . ? P13 O36 Mo1 125.97(14) . . ? Mo8 O36 Mo1 89.79(8) . . ? P13 O36 Mo3 124.88(14) . . ? Mo8 O36 Mo3 88.95(8) . . ? Mo1 O36 Mo3 88.94(8) . . ? Mo6 O38 Mo2 124.85(13) . . ? Mo8 O39 Mo3 124.23(13) . . ? Mo4 O40 Mo10 126.28(15) . . ? C1A O1A H1AA 114(7) . . ? C3A N1A C2A 122.3(4) . . ? C3A N1A H1A 118.9 . . ? C2A N1A H1A 118.9 . . ? C3C O1C H1CA 113(6) . . ? C1B O2B H1BA 111(5) . . ? H1DA O1D H1DB 124(8) . . ? C4A N2A H2A1 109.5 . . ? C4A N2A H2A2 109.5 . . ? H2A1 N2A H2A2 109.5 . . ? C4A N2A H2A3 109.5 . . ? H2A1 N2A H2A3 109.5 . . ? H2A2 N2A H2A3 109.5 . . ? O3B C3B N1B 123.3(4) . . ? O3B C3B C4B 120.4(4) . . ? N1B C3B C4B 116.3(4) . . ? C3B N1B C2B 121.8(4) . . ? C3B N1B H1B 119.1 . . ? C2B N1B H1B 119.1 . . ? C1C N1C C2C 122.7(4) . . ? C1C N1C H1C 118.7 . . ? C2C N1C H1C 118.7 . . ? O2A C1A O1A 124.1(5) . . ? O2A C1A C2A 120.9(4) . . ? O1A C1A C2A 115.0(4) . . ? O3A C3A N1A 123.3(4) . . ? O3A C3A C4A 120.4(4) . . ? N1A C3A C4A 116.3(4) . . ? O1B C1B O2B 125.2(4) . . ? O1B C1B C2B 124.1(4) . . ? O2B C1B C2B 110.7(4) . . ? C4B N2B H2B1 109.5 . . ? C4B N2B H2B2 109.5 . . ? H2B1 N2B H2B2 109.5 . . ? C4B N2B H2B3 109.5 . . ? H2B1 N2B H2B3 109.5 . . ? H2B2 N2B H2B3 109.5 . . ? N2A C4A C3A 109.6(4) . . ? N2A C4A H4A1 109.8 . . ? C3A C4A H4A1 109.8 . . ? N2A C4A H4A2 109.8 . . ? C3A C4A H4A2 109.8 . . ? H4A1 C4A H4A2 108.2 . . ? N1B C2B C1B 110.7(4) . . ? N1B C2B H2B4 109.5 . . ? C1B C2B H2B4 109.5 . . ? N1B C2B H2B5 109.5 . . ? C1B C2B H2B5 109.5 . . ? H2B4 C2B H2B5 108.1 . . ? O3C C1C N1C 124.1(4) . . ? O3C C1C C4C 121.6(4) . . ? N1C C1C C4C 114.3(4) . . ? N1A C2A C1A 114.2(4) . . ? N1A C2A H2A4 108.7 . . ? C1A C2A H2A4 108.7 . . ? N1A C2A H2A5 108.7 . . ? C1A C2A H2A5 108.7 . . ? H2A4 C2A H2A5 107.6 . . ? N2B C4B C3B 109.2(4) . . ? N2B C4B H4B1 109.8 . . ? C3B C4B H4B1 109.8 . . ? N2B C4B H4B2 109.8 . . ? C3B C4B H4B2 109.8 . . ? H4B1 C4B H4B2 108.3 . . ? H7DA O7D H7DB 125(10) . . ? N2C C4C C1C 111.1(4) . . ? N2C C4C H4C1 109.4 . . ? C1C C4C H4C1 109.4 . . ? N2C C4C H4C2 109.4 . . ? C1C C4C H4C2 109.4 . . ? H4C1 C4C H4C2 108.0 . . ? O2C C3C O1C 123.7(5) . . ? O2C C3C C2C 125.4(5) . . ? O1C C3C C2C 110.8(4) . . ? N1C C2C C3C 114.3(4) . . ? N1C C2C H2C1 108.7 . . ? C3C C2C H2C1 108.7 . . ? N1C C2C H2C2 108.7 . . ? C3C C2C H2C2 108.7 . . ? H2C1 C2C H2C2 107.6 . . ? C4C N2C H2C3 109.5 . . ? C4C N2C H2C4 109.5 . . ? H2C3 N2C H2C4 109.5 . . ? C4C N2C H2C5 109.5 . . ? H2C3 N2C H2C5 109.5 . . ? H2C4 N2C H2C5 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 Mo1 O22 1.671(3) . ? Mo1 O28 1.828(3) . ? Mo1 O33 1.851(3) . ? Mo1 O2 1.993(3) . ? Mo1 O18 2.012(3) . ? Mo1 O36 2.421(2) . ? Mo2 O4 1.683(3) . ? Mo2 O3 1.825(3) . ? Mo2 O10 1.874(3) . ? Mo2 O30 1.954(3) . ? Mo2 O38 2.008(3) . ? Mo2 O21 2.414(3) . ? Mo3 O14 1.673(3) . ? Mo3 O8 1.831(3) . ? Mo3 O2 1.845(3) . ? Mo3 O1 1.978(3) . ? Mo3 O39 2.024(3) . ? Mo3 O36 2.456(2) . ? Mo4 O27 1.668(3) . ? Mo4 O5 1.839(3) . ? Mo4 O40 1.848(3) . ? Mo4 O8 1.991(3) . ? Mo4 O32 2.002(3) . ? Mo4 O23 2.445(3) . ? Mo5 O24 1.685(3) . ? Mo5 O18 1.815(3) . ? Mo5 O32 1.867(3) . ? Mo5 O9 1.969(3) . ? Mo5 O17 1.998(3) . ? Mo5 O23 2.413(2) . ? Mo6 O11 1.674(3) . ? Mo6 O13 1.809(3) . ? Mo6 O38 1.857(3) . ? Mo6 O20 1.983(3) . ? Mo6 O12 2.030(3) . ? Mo6 O21 2.440(2) . ? Mo7 O6 1.673(3) . ? Mo7 O1 1.835(3) . ? Mo7 O7 1.870(3) . ? Mo7 O5 1.961(3) . ? Mo7 O19 1.995(3) . ? Mo7 O16 2.456(2) . ? Mo8 O15 1.678(3) . ? Mo8 O29 1.809(3) . ? Mo8 O39 1.840(3) . ? Mo8 O3 2.003(3) . ? Mo8 O33 2.033(3) . ? Mo8 O36 2.421(2) . ? Mo9 O31 1.675(3) . ? Mo9 O25 1.835(3) . ? Mo9 O30 1.873(3) . ? Mo9 O7 1.961(3) . ? Mo9 O29 2.019(3) . ? Mo9 O16 2.426(2) . ? Mo10 O37 1.672(3) . ? Mo10 O20 1.828(3) . ? Mo10 O17 1.843(3) . ? Mo10 O40 1.997(3) . ? Mo10 O35 2.003(3) . ? Mo10 O23 2.453(3) . ? Mo11 O34 1.673(3) . ? Mo11 O19 1.826(3) . ? Mo11 O35 1.834(3) . ? Mo11 O25 2.000(3) . ? Mo11 O13 2.015(3) . ? Mo11 O16 2.441(2) . ? Mo12 O26 1.671(3) . ? Mo12 O12 1.837(3) . ? Mo12 O9 1.842(3) . ? Mo12 O10 1.986(3) . ? Mo12 O28 2.011(3) . ? Mo12 O21 2.425(2) . ? P13 O16 1.526(3) . ? P13 O36 1.530(3) . ? P13 O21 1.533(3) . ? P13 O23 1.534(3) . ? O1B C1B 1.206(5) . ? O3B C3B 1.226(5) . ? O1A C1A 1.310(6) . ? O1A H1AA 0.72(8) . ? N1A C3A 1.315(5) . ? N1A C2A 1.446(5) . ? N1A H1A 0.8600 . ? O1C C3C 1.309(6) . ? O1C H1CA 0.60(5) . ? O3C C1C 1.222(5) . ? O2A C1A 1.210(6) . ? O2B C1B 1.305(6) . ? O2B H1BA 0.75(6) . ? O1D H1DA 0.79(7) . ? O1D H1DB 0.79(9) . ? O3A C3A 1.237(5) . ? N2A C4A 1.461(5) . ? N2A H2A1 0.8900 . ? N2A H2A2 0.8900 . ? N2A H2A3 0.8900 . ? C3B N1B 1.330(6) . ? C3B C4B 1.504(6) . ? N1B C2B 1.443(6) . ? N1B H1B 0.8600 . ? N1C C1C 1.315(6) . ? N1C C2C 1.435(6) . ? N1C H1C 0.8600 . ? C1A C2A 1.498(6) . ? C3A C4A 1.510(6) . ? C1B C2B 1.493(6) . ? N2B C4B 1.473(6) . ? N2B H2B1 0.8900 . ? N2B H2B2 0.8900 . ? N2B H2B3 0.8900 . ? C4A H4A1 0.9700 . ? C4A H4A2 0.9700 . ? C2B H2B4 0.9700 . ? C2B H2B5 0.9700 . ? C1C C4C 1.508(6) . ? C2A H2A4 0.9700 . ? C2A H2A5 0.9700 . ? C4B H4B1 0.9700 . ? C4B H4B2 0.9700 . ? O7D H7DA 0.917(10) . ? O7D H7DB 0.918(10) . ? C4C N2C 1.451(7) . ? C4C H4C1 0.9700 . ? C4C H4C2 0.9700 . ? C3C O2C 1.207(7) . ? C3C C2C 1.483(7) . ? C2C H2C1 0.9700 . ? C2C H2C2 0.9700 . ? N2C H2C3 0.8900 . ? N2C H2C4 0.8900 . ? N2C H2C5 0.8900 . ?