#------------------------------------------------------------------------------ #$Date: 2023-10-10 04:15:23 +0200 (Tue, 10 Oct 2023) $ #$Revision: 286863 $ #$URL: svn://www.crystallography.net/cod/cif/2/02/28/2022880.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2022880 loop_ _publ_author_name 'Poreba, Tomasz' 'Garbarino, Gaston' 'Comboni, Davide' 'Mezouar, Mohamed' _publ_section_title ; Deformation of polyiodides in Cs2I8 crystals at high pressure ; _journal_issue 6 _journal_name_full 'Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials' _journal_page_first 934 _journal_page_last 939 _journal_paper_doi 10.1107/S2052520621010192 _journal_volume 77 _journal_year 2021 _chemical_formula_moiety 'Cs I4' _chemical_formula_sum 'Cs I4' _chemical_formula_weight 640.51 _chemical_name_common 'Cesium Tetraiodide' _chemical_name_systematic 'dicesium octaiodide' _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2ybc' _space_group_name_H-M_alt 'P 1 21/c 1' _audit_creation_date 2021-07-19 _audit_creation_method ; Olex2 1.2 (compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506) ; _audit_update_record ; 2021-07-20 deposited with the CCDC. 2021-07-23 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 115.709(9) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 9.7195(12) _cell_length_b 8.6486(2) _cell_length_c 10.5900(4) _cell_measurement_pressure 2320000 _cell_measurement_reflns_used 1368 _cell_measurement_temperature 296(2) _cell_measurement_theta_max 21.3460 _cell_measurement_theta_min 2.2350 _cell_volume 802.07(12) _computing_cell_refinement 'CrysAlisPro 1.171.41.93a (Rigaku OD, 2020)' _computing_data_collection 'CrysAlisPro 1.171.41.93a (Rigaku OD, 2020)' _computing_data_reduction 'CrysAlisPro 1.171.41.93a (Rigaku OD, 2020)' _computing_molecular_graphics 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.3 (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2018/3 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' _diffrn_ambient_environment Helium _diffrn_ambient_pressure 2320000 _diffrn_ambient_temperature 296(2) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 13.3333 _diffrn_detector_type 'Eiger 9M CdTe' _diffrn_measured_fraction_theta_full 0.374 _diffrn_measured_fraction_theta_max 0.219 _diffrn_measurement_details ; List of Runs (angles in degrees, time in seconds): # Type Start End Width t~exp~ \w \q \k \f Frames #-------------------------------------------------------------------------- 1 \w -32.00 32.00 0.50 0.20 -- 0.00 0.00 0.00 128 ; _diffrn_measurement_device '1-circle goniometer' _diffrn_measurement_device_type 'esperanto-CrysAlisPro-abstract goniometer imported esperanto images' _diffrn_measurement_method 'phi scan' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 0.0440870000 _diffrn_orient_matrix_UB_12 -0.0119568000 _diffrn_orient_matrix_UB_13 0.0087109000 _diffrn_orient_matrix_UB_21 -0.0128494000 _diffrn_orient_matrix_UB_22 -0.0077814000 _diffrn_orient_matrix_UB_23 -0.0418868000 _diffrn_orient_matrix_UB_31 0.0094410000 _diffrn_orient_matrix_UB_32 0.0453186000 _diffrn_orient_matrix_UB_33 -0.0048917000 _diffrn_radiation_collimation '0.02 mm double pinhole' _diffrn_radiation_monochromator synchrotron _diffrn_radiation_probe x-ray _diffrn_radiation_type synchrotron _diffrn_radiation_wavelength 0.41077 _diffrn_reflns_av_R_equivalents 0.0135 _diffrn_reflns_av_unetI/netI 0.0168 _diffrn_reflns_Laue_measured_fraction_full 0.374 _diffrn_reflns_Laue_measured_fraction_max 0.219 _diffrn_reflns_limit_h_max 7 _diffrn_reflns_limit_h_min -6 _diffrn_reflns_limit_k_max 11 _diffrn_reflns_limit_k_min -12 _diffrn_reflns_limit_l_max 15 _diffrn_reflns_limit_l_min -16 _diffrn_reflns_number 1880 _diffrn_reflns_point_group_measured_fraction_full 0.374 _diffrn_reflns_point_group_measured_fraction_max 0.219 _diffrn_reflns_theta_full 14.268 _diffrn_reflns_theta_max 21.344 _diffrn_reflns_theta_min 2.240 _diffrn_source 'undulator, ID15B, ESRF' _exptl_absorpt_coefficient_mu 4.539 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.89538 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; CrysAlisPro 1.171.41.93a (Rigaku Oxford Diffraction, 2020) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm. ; _exptl_crystal_colour 'dark red' _exptl_crystal_colour_modifier dark _exptl_crystal_colour_primary red _exptl_crystal_density_diffrn 5.304 _exptl_crystal_description plate _exptl_crystal_F_000 1068 _exptl_crystal_size_max 0.035 _exptl_crystal_size_mid 0.015 _exptl_crystal_size_min 0.01 _refine_diff_density_max 0.681 _refine_diff_density_min -0.801 _refine_diff_density_rms 0.241 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.127 _refine_ls_hydrogen_treatment undef _refine_ls_matrix_type full _refine_ls_number_parameters 46 _refine_ls_number_reflns 1023 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.127 _refine_ls_R_factor_all 0.0207 _refine_ls_R_factor_gt 0.0194 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0357P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0585 _refine_ls_wR_factor_ref 0.0594 _reflns_Friedel_coverage 0.000 _reflns_number_gt 950 _reflns_number_total 1023 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file bm5146sup1.cif _cod_data_source_block CsI4_2p32GPa _cod_database_code 2022880 _shelx_shelxl_version_number 2017/1 _chemical_oxdiff_formula CsI4 _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. ; _diffrn_measurement_specimen_suport 'diamond anvil cell' _reflns_odcompleteness_completeness 21.54 _reflns_odcompleteness_iscentric 1 _reflns_odcompleteness_theta 21.34 _olex2_refinement_description ; ; _shelx_res_file ; TITL csi4_0111_a.res in P2(1)/c csi4_0111.res created by SHELXL-2018/3 at 16:09:11 on 19-Jul-2021 REM Old TITL csi4_0111 in P2(1)/c REM SHELXT solution in P2(1)/c REM R1 0.050, Rweak 0.002, Alpha 0.020, Orientation as input REM Formula found by SHELXT: I3 Cs2 CELL 0.41077 9.7195 8.6486 10.59 90 115.709 90 ZERR 4 0.0012 0.0002 0.0004 0 0.009 0 LATT 1 SYMM -X,0.5+Y,0.5-Z SFAC Cs I DISP Cs -1.803 0.7961 2042.8949 DISP I -2.2298 0.677 1764.6088 UNIT 4 16 L.S. 4 0 0 PLAN 8 CONF list 4 MORE -1 fmap 2 53 acta REM REM REM WGHT 0.035700 FVAR 0.27427 I2 2 0.386220 0.713595 0.395210 11.00000 0.03247 0.02798 = 0.02840 -0.00168 0.01366 0.00235 CS1 1 0.778644 0.878658 0.691779 11.00000 0.03581 0.03355 = 0.02884 0.00235 0.01261 0.00332 I1 2 0.563129 0.909658 0.311406 11.00000 0.03215 0.03744 = 0.03105 0.00226 0.01502 -0.00195 I3 2 0.173998 0.503924 0.452292 11.00000 0.03306 0.02709 = 0.03836 0.00292 0.01682 -0.00070 I4 2 1.051770 0.647757 0.998179 11.00000 0.03030 0.02941 = 0.03465 0.00232 0.01250 0.00532 HKLF 4 REM csi4_0111_a.res in P2(1)/c REM wR2 = 0.0594, GooF = S = 1.127, Restrained GooF = 1.127 for all data REM R1 = 0.0194 for 950 Fo > 4sig(Fo) and 0.0207 for all 1023 data REM 46 parameters refined using 0 restraints END WGHT 0.0357 0.0000 REM Highest difference peak 0.681, deepest hole -0.801, 1-sigma level 0.241 Q1 1 1.0064 0.4990 0.8983 11.00000 0.05 0.68 Q2 1 0.9715 0.8343 0.9999 11.00000 0.05 0.64 Q3 1 0.5229 0.6909 0.4845 11.00000 0.05 0.63 Q4 1 0.2563 0.3420 0.4404 11.00000 0.05 0.62 Q5 1 0.1726 0.6602 0.4271 11.00000 0.05 0.62 Q6 1 0.1648 0.3392 0.4962 11.00000 0.05 0.61 Q7 1 0.1782 0.3374 0.4014 11.00000 0.05 0.59 Q8 1 0.6329 0.9870 0.5026 11.00000 0.05 0.59 ; _shelx_res_checksum 76976 _shelx_hkl_file ; 0 0 2 830.63 12.13 0 0 -2 833.44 12.09 0 0 -3 0.11 0.15 0 0 -4 486.18 8.42 0 0 -5 0.12 0.29 0 0 6 1472.73 22.96 0 0 -6 1486.92 22.73 0 0 7 0.44 0.54 0 0 -7 0.07 0.46 0 0 -8 645.67 12.19 0 0 8 619.91 12.26 0 0 -9 -0.27 0.63 0 0 9 0.39 0.61 0 0 10 1712.45 28.41 0 0 -10 1671.85 27.85 0 0 11 -0.18 0.68 0 0 -11 0.61 0.72 0 0 -12 7.08 1.43 0 0 -13 -0.50 0.86 0 0 13 -0.47 0.87 0 1 2 1709.30 23.43 0 -1 -2 1709.75 23.40 0 -1 3 3599.39 48.79 0 1 3 3594.63 48.94 0 1 -3 3646.94 48.74 0 -1 4 724.21 11.78 0 1 4 691.29 11.74 0 1 -5 5573.96 77.02 0 1 5 5696.42 77.37 0 1 6 580.22 10.84 0 -1 6 569.62 10.60 0 1 -6 604.76 10.70 0 -1 7 47.34 2.43 0 1 7 42.62 2.39 0 1 -7 48.00 2.40 0 1 -8 186.75 5.40 0 1 8 171.26 5.42 0 -1 8 177.23 5.38 0 -1 -8 177.55 5.34 0 -1 9 155.68 5.30 0 1 9 170.30 5.72 0 1 -9 166.18 5.35 0 -1 -9 174.36 5.80 0 1 10 41.28 2.85 0 -1 10 38.76 2.70 0 1 -10 37.18 2.56 0 1 11 854.92 17.41 0 -1 -11 829.63 16.91 0 1 -11 858.03 16.83 0 1 -12 66.71 3.91 0 -1 -12 69.06 3.99 0 -1 12 72.34 4.16 0 -1 13 9.22 1.65 0 -1 -13 7.95 1.52 0 1 -13 6.77 1.49 0 2 1 394.53 6.02 0 -2 2 0.77 0.18 0 2 2 0.60 0.19 0 -2 3 145.57 3.14 0 -2 -3 141.72 3.29 0 -2 4 1050.84 16.02 0 2 -4 1061.94 16.05 0 -2 -4 1052.57 16.36 0 2 -5 0.63 0.36 0 -2 -5 1.07 0.44 0 2 5 0.70 0.37 0 -2 -6 143.94 4.20 0 2 -6 143.97 4.01 0 -2 6 146.13 4.17 0 2 6 131.13 4.09 0 2 -7 81.35 3.14 0 -2 -7 86.14 3.36 0 -2 7 87.20 3.33 0 2 7 89.47 3.52 0 -2 -8 1377.05 22.85 0 -2 8 1424.13 22.90 0 2 8 1366.18 23.06 0 2 -8 1412.55 22.51 0 2 9 55.15 3.14 0 2 -9 58.64 3.03 0 -2 -9 57.69 3.09 0 -2 9 58.27 3.07 0 2 -10 500.99 11.22 0 2 10 494.94 11.59 0 -2 10 487.07 11.17 0 2 -11 37.97 2.71 0 -2 -11 39.64 2.88 0 -2 11 40.29 2.85 0 2 11 39.91 3.08 0 -2 12 76.67 4.25 0 -2 -12 70.96 4.10 0 2 -12 74.79 4.12 0 2 12 73.42 4.24 0 -2 -13 1.43 0.95 0 -2 13 0.73 0.85 0 -3 -1 2220.83 30.40 0 -3 -2 480.05 7.72 0 3 3 1490.62 21.62 0 -3 3 1445.13 21.03 0 -3 -3 1519.07 21.61 0 3 4 249.73 5.38 0 -3 4 260.67 5.10 0 3 5 4792.31 66.51 0 -3 -5 4794.33 66.81 0 3 -6 367.08 7.73 0 -3 -6 358.71 7.82 0 3 6 367.02 7.87 0 3 -7 1.86 0.66 0 -3 -7 2.11 0.66 0 -3 7 1.98 0.62 0 3 7 1.84 0.73 0 -3 8 278.23 6.97 0 -3 -8 293.01 7.37 0 3 8 287.25 7.49 0 3 9 107.56 4.44 0 -3 9 111.43 4.28 0 3 -9 118.04 4.56 0 -3 -9 108.32 4.36 0 -3 -10 25.72 2.23 0 3 10 25.83 2.27 0 -3 10 29.72 2.33 0 -3 11 10.48 1.49 0 -3 -11 9.84 1.51 0 3 12 23.03 2.45 0 -3 -12 19.68 2.19 0 -3 12 24.14 2.33 0 -3 13 1.72 0.91 0 -4 -1 1561.59 21.81 0 -4 -2 2127.06 29.52 0 4 2 2100.12 29.50 0 -4 -3 179.90 3.95 0 4 3 178.98 3.99 0 -4 -4 1186.95 18.80 0 -4 4 1198.92 18.12 0 -4 5 153.91 3.89 0 4 5 145.63 4.21 0 -4 6 3315.56 46.91 0 4 6 3287.66 47.62 0 -4 -6 3305.59 47.54 0 -4 7 40.32 2.20 0 4 7 36.64 2.28 0 -4 -7 37.88 2.20 0 -4 -8 88.92 3.71 0 -4 8 85.94 3.46 0 4 8 82.88 3.71 0 4 9 200.63 6.39 0 -4 -10 822.26 15.91 0 -4 10 812.42 15.52 0 4 10 785.91 16.22 0 4 11 68.43 3.98 0 -4 -11 60.24 3.65 0 -4 11 63.20 3.43 0 -4 -12 67.69 4.02 0 4 12 67.69 4.13 0 -5 -1 5744.36 77.22 0 -5 -2 1030.61 15.30 0 -5 -3 1125.65 16.98 0 -5 -4 279.79 5.89 0 -5 -5 400.58 8.10 0 -5 6 81.97 2.92 0 -5 -6 74.10 3.03 0 -5 7 644.61 11.95 0 -5 -7 622.41 12.22 0 -5 -8 38.82 2.42 0 -5 8 41.24 2.34 0 -5 9 9.26 1.26 0 -5 -9 8.19 1.30 0 -5 -10 23.83 2.12 0 -5 10 22.79 1.94 0 -5 -11 108.72 4.85 0 -5 -12 70.30 4.01 0 -6 -1 2.31 0.36 0 -6 -2 3348.02 46.05 0 6 3 1120.52 17.08 0 -6 -3 1128.23 17.04 0 6 4 751.92 12.58 0 -6 -5 25.98 1.66 0 6 5 28.16 1.73 0 -6 -6 0.98 0.55 0 6 6 0.41 0.49 0 -6 6 0.13 0.35 0 -6 7 548.01 10.47 0 6 7 518.33 10.79 0 -6 -7 540.21 10.94 0 -6 8 156.70 4.79 0 6 8 157.45 5.33 0 6 9 53.06 3.16 0 6 10 118.76 5.08 0 6 11 17.36 2.07 0 6 12 1.26 1.01 0 -7 -1 307.21 5.36 0 -7 -2 13.55 0.89 0 -7 -3 0.31 0.30 0 7 4 0.92 0.45 0 -7 -4 0.28 0.39 0 7 5 5.16 0.82 0 -7 -5 3.36 0.70 0 7 6 22.93 1.71 0 7 7 267.28 6.99 0 -7 -7 285.82 7.09 0 -7 -8 0.94 0.62 0 7 8 1.09 0.73 0 -7 -9 750.21 14.58 0 7 9 727.03 14.61 0 -7 -10 0.89 0.65 0 7 10 0.06 0.63 0 -7 -11 240.16 7.48 0 7 11 224.60 7.45 0 -7 -12 0.96 0.79 0 -8 0 1319.23 18.60 0 -8 -1 1.21 0.31 0 -8 -2 97.08 2.63 0 -8 -3 292.50 5.81 0 -8 -4 277.22 5.87 0 -8 -5 -0.03 0.38 0 8 5 0.94 0.47 0 8 6 112.83 3.92 0 -8 -6 112.81 3.86 0 -8 -7 378.15 8.50 0 8 7 410.76 8.84 0 -8 -8 145.34 4.91 0 8 8 140.37 4.98 0 -8 -9 1.61 0.78 0 8 9 2.47 0.85 0 -8 -10 0.05 0.55 0 8 10 -0.29 0.68 0 8 11 15.38 1.94 0 -8 -11 12.89 1.76 0 -9 0 0.18 0.20 0 -9 -1 695.40 10.59 0 -9 -2 304.87 5.61 0 -9 -3 586.66 10.02 0 -9 -4 273.95 5.96 0 -9 -5 308.94 6.75 0 -9 -6 11.02 1.20 0 -9 -7 28.28 1.96 0 -9 -8 41.52 2.49 0 -9 -9 18.65 1.81 0 -9 -10 36.49 2.61 0 -9 -11 9.80 1.64 0 -10 -1 442.57 7.13 0 -10 -2 47.34 1.69 0 -10 -3 9.96 0.87 0 -10 -4 129.96 3.62 0 -10 -5 14.76 1.26 0 -10 -6 90.23 3.30 0 -10 -7 19.80 1.61 0 -10 -8 191.23 5.67 0 10 8 185.14 5.66 0 10 9 75.50 3.64 0 -10 -9 67.20 3.33 0 -10 -10 2.03 0.89 0 10 10 1.85 0.87 0 -10 -11 28.16 2.38 0 10 11 34.69 2.74 0 -11 0 0.02 0.15 0 -11 -1 103.82 2.37 0 -11 -2 10.76 0.79 0 -11 -4 165.61 4.20 0 -11 -5 62.61 2.50 0 -11 -6 41.44 2.15 0 -11 -7 2.57 0.70 0 -11 -8 4.26 0.87 0 -11 -9 12.74 1.49 0 -11 -10 9.30 1.33 0 -11 -11 5.73 1.20 0 -12 -4 59.83 2.19 0 -12 -5 10.46 1.00 0 -12 -6 6.59 0.87 0 -12 -7 9.08 1.10 0 -12 -8 13.02 1.44 0 -12 -9 3.21 0.82 0 -12 -10 41.17 2.68 1 0 -13 -1.01 0.87 -1 0 13 0.22 0.77 1 0 -12 33.86 2.64 -1 0 12 34.37 2.80 -1 0 11 0.63 0.73 1 0 -11 1.02 0.82 -1 0 10 199.48 6.33 1 0 -10 185.60 5.95 1 0 -9 0.29 0.50 -1 0 9 0.24 0.55 -1 0 8 647.97 12.35 1 0 -8 611.67 11.90 1 0 -7 -0.13 0.38 -1 0 7 0.45 0.48 1 0 -6 7.54 0.91 -1 0 6 8.73 1.01 -1 0 5 -0.30 0.29 1 0 -5 0.14 0.24 1 0 -4 2365.26 33.33 1 0 -3 0.04 0.13 1 0 -2 26.29 0.95 -1 0 -3 0.34 0.28 1 0 3 0.97 0.28 1 0 4 6292.00 86.28 -1 0 -4 6354.54 86.21 -1 0 -5 0.14 0.36 -1 0 -6 2234.31 33.26 -1 0 -7 0.23 0.51 -1 0 -8 163.56 5.31 1 0 8 169.45 5.54 1 0 9 0.44 0.66 -1 0 -9 -0.24 0.63 1 0 10 79.12 4.03 -1 0 -10 81.16 4.03 -1 0 -11 0.38 0.79 1 0 11 -0.06 0.67 1 0 12 179.63 6.89 -1 1 13 53.90 3.79 1 -1 -13 54.68 3.58 -1 -1 13 51.17 3.53 1 1 -13 54.73 3.57 1 1 -12 79.86 4.09 1 -1 -12 69.99 3.90 -1 -1 12 76.04 4.08 1 -1 -11 0.11 0.63 1 1 -11 1.01 0.70 -1 -1 11 -0.54 0.73 1 -1 -10 18.97 1.83 1 1 -10 18.28 1.73 -1 -1 10 17.88 1.82 1 -1 -9 1377.92 22.68 -1 -1 9 1395.92 22.83 1 1 -9 1356.07 22.25 1 1 -8 2489.45 37.77 -1 1 8 2494.42 38.21 -1 -1 8 2616.17 38.15 1 -1 -8 2638.35 38.43 -1 -1 7 985.87 16.26 1 -1 -7 958.41 16.29 -1 1 7 954.73 16.30 1 1 -7 939.96 15.93 -1 -1 6 364.91 7.37 1 1 -6 347.97 7.25 1 -1 -6 356.70 7.43 -1 1 6 348.03 7.48 -1 -1 5 533.27 9.36 1 1 -4 8.96 0.73 -1 1 4 8.33 0.76 -1 -1 4 9.47 0.75 -1 -1 3 6661.06 89.52 -1 1 2 0.23 0.12 -1 -1 2 0.28 0.11 1 1 3 77.62 2.38 -1 -1 -3 80.80 2.38 -1 -1 -4 585.40 9.96 1 1 4 567.15 9.96 -1 -1 -5 1199.03 18.98 1 1 5 1179.05 19.16 1 -1 5 1243.99 19.15 1 1 6 549.96 10.55 1 -1 6 562.10 10.49 1 -1 7 319.82 7.70 1 1 7 307.95 7.60 -1 1 -8 208.90 6.29 1 1 8 194.69 6.03 1 -1 8 197.65 6.03 -1 1 -9 76.27 3.85 1 -1 9 77.02 3.73 1 1 9 71.90 3.65 1 -1 10 3.53 0.97 -1 -1 -10 5.95 1.24 1 1 10 5.26 1.17 -1 -1 -11 60.88 3.64 1 1 11 69.33 4.05 -1 -1 -12 202.03 7.35 1 1 12 218.07 7.86 -1 2 13 276.18 9.00 1 2 -13 267.19 8.17 -1 -2 13 275.41 8.58 -1 2 12 20.05 2.28 1 2 -12 20.66 2.07 -1 -2 12 22.75 2.33 1 2 -11 198.04 6.34 -1 2 11 193.99 6.79 -1 -2 11 198.88 6.48 1 -2 -11 193.06 6.53 -1 -2 10 12.01 1.46 1 -2 -10 13.71 1.65 -1 2 10 11.51 1.59 1 2 -10 12.94 1.49 -1 -2 9 460.79 10.17 1 -2 -9 465.34 10.51 -1 2 9 469.93 10.65 -1 -2 8 306.14 7.25 -1 2 8 319.98 7.83 1 2 -7 11.85 1.15 -1 2 7 9.43 1.15 1 -2 -7 11.18 1.22 -1 -2 7 10.65 1.14 -1 -2 6 4375.78 61.37 1 2 -6 4449.62 61.26 -1 2 6 4421.19 61.93 1 -2 -6 4407.41 61.82 -1 -2 5 206.28 4.61 1 -2 -5 202.56 4.83 -1 2 4 2587.04 35.41 -1 -2 4 2475.98 34.92 1 2 -4 2475.52 34.88 1 -2 -4 2463.10 35.54 -1 -2 3 9908.49 132.35 1 2 -3 9999.00 132.49 1 -2 -3 9820.34 133.11 1 2 -2 1028.60 14.37 -1 -2 2 1037.39 14.43 1 -2 -2 1032.15 15.08 1 2 1 148.28 2.81 1 2 2 299.99 5.40 1 2 3 1125.30 16.60 -1 -2 -3 1062.31 16.41 -1 -2 -4 6.29 0.74 -1 -2 -5 988.49 16.19 1 2 5 1009.38 16.37 -1 -2 -6 3.82 0.76 1 2 6 5.19 0.88 -1 -2 -7 2396.57 36.21 1 2 7 2425.69 36.46 1 2 8 491.62 10.64 -1 -2 -8 448.08 10.08 -1 -2 -9 90.21 3.96 1 2 9 81.30 3.93 1 2 10 4.71 1.16 -1 -2 -10 6.49 1.26 1 2 11 81.86 4.42 -1 -2 -11 75.41 4.14 1 2 12 180.86 7.04 -1 -2 -12 165.97 6.52 1 3 -14 151.40 6.25 1 -3 -13 42.29 3.26 -1 3 13 45.16 3.51 1 3 -13 40.57 2.96 1 -3 -12 -0.71 0.83 1 3 -12 1.30 0.82 -1 3 12 0.68 0.80 -1 -3 12 0.54 0.70 1 -3 -11 74.33 3.94 -1 3 11 80.22 4.16 1 3 -11 77.78 3.69 -1 -3 11 79.38 3.91 1 -3 -10 53.15 3.08 -1 -3 10 49.23 2.89 -1 3 10 56.17 3.24 1 -3 -9 292.23 7.74 -1 3 9 276.12 7.57 -1 -3 9 301.02 7.47 -1 -3 8 136.96 4.38 1 -3 -8 133.03 4.64 -1 3 8 139.40 4.76 1 3 -8 140.19 4.33 1 3 -7 699.20 12.25 -1 -3 7 707.11 12.47 1 -3 -7 695.58 12.92 1 -3 -6 1393.92 22.23 -1 -3 6 1445.40 21.64 1 -3 -5 101.94 3.25 -1 -3 5 99.55 2.87 1 -3 -4 4236.19 57.54 1 3 -4 4091.53 56.80 -1 3 4 4173.17 57.50 -1 -3 3 1228.62 17.58 1 3 -3 1238.85 17.48 -1 3 3 1262.91 18.41 -1 -3 -1 7995.91 106.65 -1 -3 -2 1414.31 20.22 1 3 2 1410.75 20.26 1 3 3 1176.83 17.60 -1 -3 -3 1162.47 17.50 -1 -3 -4 726.26 12.03 -1 -3 -5 1041.19 16.82 1 3 5 1025.40 16.87 -1 -3 -6 429.71 8.77 1 3 6 437.43 8.98 -1 -3 -7 2161.09 32.38 1 3 7 2071.94 32.40 -1 -3 -8 472.45 10.15 1 3 8 429.23 9.93 1 3 9 124.80 5.02 -1 -3 -9 128.27 4.83 -1 -3 -10 762.24 15.23 1 3 10 729.93 15.49 -1 -3 -11 44.68 3.11 1 3 11 43.79 3.18 1 3 12 28.15 2.77 -1 -3 -12 29.94 2.75 1 -4 -13 29.23 2.71 -1 -4 13 38.49 3.04 -1 -4 12 5.41 1.15 1 4 -12 5.03 1.17 -1 4 12 5.29 1.34 1 -4 -12 5.03 1.22 -1 4 11 89.63 4.50 -1 -4 11 88.08 4.00 1 4 -11 89.55 3.95 1 -4 -11 87.81 4.26 1 -4 -10 602.16 12.90 1 4 -10 560.38 11.63 -1 4 10 593.60 12.92 -1 -4 10 575.36 11.86 1 -4 -9 390.85 9.37 -1 4 9 407.71 9.67 1 4 -9 389.93 8.68 1 4 -8 1502.97 23.47 -1 4 8 1523.50 24.75 1 -4 -8 1481.74 24.55 -1 -4 7 7.34 0.92 1 -4 -7 7.70 1.07 1 4 -7 6.91 0.89 -1 4 7 7.34 1.05 1 -4 -6 10.72 1.10 -1 4 6 11.99 1.20 1 4 -6 12.74 1.04 -1 -4 6 12.44 1.03 1 -4 -5 495.46 9.48 -1 -4 5 525.05 8.87 -1 -4 4 3755.34 51.10 1 -4 -4 3715.95 52.22 -1 -4 3 202.47 3.68 1 -4 -3 210.92 4.57 -1 -4 -1 1371.96 18.62 1 4 1 1277.71 18.61 1 4 2 207.63 4.14 -1 -4 -2 204.21 4.08 -1 -4 -3 35.87 1.56 1 4 3 36.37 1.60 -1 -4 -4 1755.06 25.62 1 4 4 1725.32 25.69 -1 -4 -5 1170.35 18.05 1 4 5 1084.40 18.10 -1 -4 -6 92.69 3.46 1 4 6 91.00 3.41 1 4 7 1.16 0.61 -1 -4 -7 0.97 0.58 1 4 8 432.25 9.83 -1 -4 -8 409.58 9.45 1 4 9 22.34 2.07 -1 -4 -9 25.96 2.19 -1 -4 -10 52.71 3.27 1 4 10 53.24 3.39 -1 -4 -11 46.61 3.20 -1 -4 -12 130.89 5.77 -1 -5 13 35.38 2.85 1 -5 -12 76.57 4.24 -1 5 12 86.22 4.50 -1 -5 12 81.92 4.00 -1 5 11 411.92 10.56 1 -5 -11 407.30 10.50 1 -5 -10 12.58 1.65 -1 5 10 14.10 1.69 -1 -5 10 15.71 1.56 -1 -5 9 29.67 1.99 1 -5 -9 26.81 2.26 -1 5 9 22.11 1.97 -1 5 8 64.07 3.17 1 -5 -8 69.65 3.30 -1 -5 8 69.52 2.91 -1 5 7 22.38 1.76 -1 -5 7 22.62 1.48 1 -5 -7 19.72 1.64 -1 5 6 0.10 0.45 -1 -5 6 0.98 0.41 1 -5 -6 0.52 0.47 -1 -5 5 190.22 4.17 1 -5 -5 189.64 4.88 1 -5 -4 110.18 3.36 -1 -5 4 121.97 2.76 -1 -5 3 39.48 1.18 1 -5 -3 44.90 1.85 -1 -5 -1 517.81 7.85 1 5 1 506.63 7.93 -1 -5 -2 12.67 0.81 1 5 2 13.07 0.85 1 5 3 3724.08 51.78 -1 -5 -3 3748.24 51.62 1 5 4 112.73 3.34 1 5 5 338.06 7.23 -1 -5 -6 34.14 2.02 1 5 6 34.45 2.09 -1 -5 -7 105.01 4.00 1 5 7 116.74 4.23 -1 -5 -8 152.01 5.01 -1 -5 -9 165.44 5.67 -1 -5 -10 13.31 1.69 -1 -5 -11 17.95 2.03 -1 -5 -12 -0.75 0.83 -1 -6 13 1.68 0.84 -1 6 12 8.52 1.68 -1 -6 12 9.13 1.35 -1 6 11 110.10 5.08 -1 -6 11 108.74 4.34 -1 6 10 130.77 5.26 -1 -6 10 139.28 4.66 -1 -6 9 470.92 9.65 -1 6 9 460.56 10.71 -1 6 8 217.40 6.30 -1 -6 8 225.31 5.64 -1 6 7 444.92 9.38 -1 -6 7 413.41 8.08 -1 6 6 -0.03 0.47 -1 -6 5 556.71 9.20 -1 6 5 557.56 10.31 -1 -6 4 13.36 0.78 -1 -6 3 199.88 3.37 1 -6 -3 166.19 4.26 -1 -6 -2 718.41 11.11 1 6 3 1075.01 16.37 -1 -6 -3 1068.70 16.31 -1 -6 -4 744.22 12.70 1 6 4 797.25 13.10 -1 -6 -5 1167.15 18.47 1 6 5 1143.83 18.57 -1 -6 -6 1219.47 19.61 1 6 6 1187.77 19.71 -1 -6 -7 3.82 0.87 1 6 7 4.15 0.92 -1 -6 -8 25.59 1.99 -1 -6 -9 1.26 0.71 1 6 9 1.37 0.78 1 6 10 46.81 3.14 -1 -6 -10 48.52 3.13 -1 -6 -11 4.53 1.17 1 6 11 6.43 1.38 1 -7 -12 3.17 1.09 -1 -7 12 3.50 0.92 -1 7 12 3.57 1.19 -1 7 11 2.23 0.98 1 -7 -11 2.16 0.92 -1 -7 11 1.49 0.65 -1 7 10 21.85 2.14 1 -7 -10 25.74 2.28 -1 -7 10 26.18 1.93 -1 -7 9 281.44 6.79 -1 7 9 268.70 7.59 1 -7 -9 295.03 8.12 -1 7 8 158.60 5.18 1 -7 -8 165.12 5.36 -1 -7 8 164.10 4.48 1 -7 -7 476.63 10.12 -1 7 7 500.67 10.39 -1 -7 7 502.34 9.10 -1 7 6 459.26 9.18 1 -7 -6 428.61 8.92 -1 -7 5 3633.36 50.59 1 -7 -5 3786.08 52.19 1 -7 -4 72.84 2.65 -1 -7 4 75.15 1.92 -1 -7 3 226.26 3.73 -1 -7 0 831.72 11.66 -1 -7 -1 474.93 7.41 -1 -7 -2 512.62 8.39 1 7 3 1.74 0.45 -1 -7 -3 1.56 0.42 1 7 4 328.94 6.82 -1 -7 -4 332.36 6.73 1 7 5 281.02 6.33 -1 -7 -5 276.68 6.20 1 7 6 0.15 0.48 -1 -7 -6 0.60 0.52 -1 -7 -7 14.75 1.49 1 7 7 16.92 1.58 -1 -7 -8 114.90 4.28 1 7 8 116.09 4.60 -1 -7 -9 90.18 4.07 1 7 9 103.43 4.54 -1 -7 -10 104.68 4.59 1 7 10 109.60 4.97 -1 -7 -11 190.85 6.79 1 7 11 260.96 8.25 1 -8 -12 4.52 1.21 -1 -8 11 40.01 2.43 -1 8 11 38.05 2.84 -1 -8 10 39.41 2.27 1 -8 -10 38.28 2.77 -1 8 10 39.57 2.77 -1 8 9 13.82 1.64 1 -8 -9 12.73 1.56 -1 -8 8 65.87 2.64 1 -8 -8 66.13 3.25 -1 8 8 66.33 3.28 1 -8 -7 293.74 7.30 -1 -8 7 278.40 5.87 1 -8 -6 375.12 8.17 1 -8 -5 4.76 0.79 -1 -8 5 5.04 0.54 1 -8 -4 121.59 3.65 -1 -8 4 111.20 2.41 -1 -8 0 588.91 8.42 -1 -8 -1 81.39 1.98 -1 -8 -2 786.05 12.05 -1 -8 -3 71.39 2.34 -1 -8 -4 1.70 0.50 1 8 4 2.31 0.56 1 8 5 15.43 1.32 -1 -8 -5 15.29 1.26 1 8 6 630.19 11.87 -1 -8 -6 618.80 11.56 1 8 7 244.09 6.49 -1 -8 -7 242.63 6.62 1 8 8 9.64 1.31 1 8 9 131.66 4.92 -1 -8 -9 115.33 4.64 -1 -8 -10 0.16 0.66 1 8 10 0.17 0.69 1 8 11 57.92 3.66 1 -9 -11 0.88 0.73 -1 9 11 1.30 0.86 1 -9 -10 17.15 1.80 -1 9 10 16.56 1.87 -1 -9 9 118.12 3.72 1 -9 -9 117.09 4.63 -1 9 9 115.06 4.53 1 -9 -8 2.19 0.71 -1 -9 8 1.93 0.52 1 -9 -7 35.00 2.14 -1 -9 7 36.26 1.66 -1 -9 6 67.91 2.14 1 -9 -6 70.63 2.95 -1 -9 5 18.95 0.93 1 -9 -5 20.11 1.48 1 -9 -4 19.47 1.33 -1 -9 -1 32.59 1.12 -1 -9 -2 21.44 1.06 -1 -9 -3 1010.40 15.45 -1 -9 -4 126.14 3.52 -1 -9 -5 568.58 10.35 -1 -9 -6 0.04 0.48 -1 -9 -7 5.76 0.95 1 9 8 10.20 1.34 -1 -9 -8 8.82 1.24 -1 -9 -9 2.50 0.84 1 9 9 1.26 0.74 -1 -9 -10 2.44 0.93 1 9 10 2.42 0.88 -1 -9 -11 2.88 0.96 1 9 11 2.95 1.04 -1 10 11 0.06 0.63 1 -10 -11 0.34 0.65 1 -10 -10 152.43 5.47 -1 -10 8 42.29 1.98 -1 -10 7 0.93 0.37 -1 -10 6 187.17 3.99 -1 -10 5 33.15 1.16 -1 -10 -2 41.43 1.46 -1 -10 -4 51.70 2.07 -1 -10 -5 0.08 0.38 -1 -10 -6 15.91 1.38 1 10 6 15.96 1.40 1 10 7 40.28 2.35 -1 -10 -7 37.40 2.22 -1 -10 -8 31.79 2.20 1 10 8 33.10 2.26 1 10 9 0.69 0.64 -1 -10 -9 0.19 0.59 -1 -10 -10 70.23 3.60 1 10 10 73.08 3.81 -1 -10 -11 20.12 2.06 1 -11 -11 17.82 1.90 1 -11 -10 6.38 1.18 1 -11 -9 11.01 1.37 1 -11 -8 69.80 3.24 1 -11 -7 126.86 4.45 1 -11 -6 17.72 1.46 1 -11 -5 3.68 0.68 1 -11 -4 43.19 1.96 1 -11 -3 0.40 0.31 -1 -11 -3 0.80 0.33 -1 -11 -4 21.76 1.33 -1 -11 -6 91.61 3.31 1 11 8 0.17 0.54 -1 -11 -8 0.12 0.48 1 11 9 0.34 0.62 -1 -11 -9 0.44 0.58 -1 -11 -10 2.93 0.88 1 11 10 3.90 1.04 1 -12 -10 3.83 0.94 1 -12 -9 1.12 0.60 1 -12 -8 1.75 0.66 1 -12 -7 1.00 0.53 1 -12 -6 66.96 2.92 -1 -12 -7 1.06 0.50 -1 -12 -8 67.15 3.07 -1 -12 -9 0.62 0.57 -1 -12 -10 1.53 0.72 2 0 -14 254.70 8.34 -2 0 13 1.35 0.89 2 0 -13 0.58 0.70 2 0 -12 283.57 8.25 -2 0 12 301.47 8.69 2 0 -11 1.38 0.86 -2 0 11 0.44 0.68 2 0 -10 909.09 16.83 -2 0 10 894.39 16.79 2 0 -9 -0.09 0.56 -2 0 9 -0.26 0.58 2 0 -8 22.49 1.77 -2 0 8 17.44 1.59 -2 0 7 -0.20 0.38 2 0 -7 0.31 0.39 2 0 -6 2876.41 41.29 -2 0 6 2892.29 41.33 -2 0 5 -0.05 0.24 2 0 -5 0.52 0.30 2 0 -4 2228.77 31.64 2 -1 -14 7.56 1.56 -2 -1 14 9.95 1.71 2 1 -14 10.43 1.66 2 -1 -13 24.17 2.43 -2 -1 13 25.74 2.50 2 1 -13 26.39 2.45 -2 1 13 24.10 2.49 2 1 -12 377.69 9.60 2 -1 -12 357.60 9.65 -2 -1 12 377.51 9.87 -2 1 12 346.75 9.76 2 -1 -11 146.51 5.52 2 1 -11 147.49 5.33 -2 -1 11 155.63 5.67 -2 1 11 146.09 5.73 2 1 -10 235.95 6.64 2 -1 -10 257.25 7.28 -2 -1 10 248.65 7.01 -2 -1 9 428.08 9.48 2 -1 -9 409.38 9.34 2 1 -8 111.99 3.89 -2 -1 8 114.73 4.00 -2 -1 7 129.91 3.99 2 1 -7 136.42 4.05 -2 1 7 132.59 4.21 2 -1 -7 124.34 4.06 2 -1 -6 3974.39 56.02 -2 -1 6 3985.52 55.67 -2 1 5 2692.47 38.32 2 -1 -5 2764.95 38.48 2 1 -4 206.17 4.23 -2 1 4 188.02 4.34 2 -1 -4 217.56 4.61 -2 -1 4 187.91 4.18 -2 -2 14 10.72 1.77 -2 -2 13 4.46 1.20 -2 2 13 6.35 1.44 2 -2 -13 5.02 1.29 2 2 -12 53.70 3.17 -2 -2 12 52.04 3.28 -2 2 12 57.01 3.68 -2 -2 11 744.33 15.02 2 2 -11 760.42 14.69 -2 2 11 726.39 15.43 -2 -2 10 5.78 1.09 -2 2 10 6.34 1.17 2 2 -10 6.71 1.10 2 2 -9 140.64 4.57 -2 -2 9 148.36 4.87 2 -2 -9 146.79 5.16 -2 2 9 143.83 5.03 -2 2 8 11.85 1.32 -2 -2 8 10.05 1.20 2 2 -8 11.27 1.20 2 -2 -8 10.07 1.23 -2 2 7 2666.40 39.27 2 2 -7 2668.17 38.61 -2 -2 7 2700.30 38.73 2 -2 -7 2634.16 39.12 2 -2 -6 15.90 1.31 -2 2 6 14.01 1.22 -2 -2 6 15.21 1.15 2 2 -6 15.99 1.17 2 2 -5 0.80 0.31 2 -2 -5 1.02 0.43 -2 2 5 0.92 0.37 -2 -2 5 1.02 0.35 2 2 -4 2072.90 29.02 -2 -2 4 2052.78 29.10 2 -2 -4 2053.50 29.85 -2 2 4 2065.63 29.70 2 2 -3 598.99 9.11 2 2 4 247.18 5.69 2 2 5 368.04 7.88 2 2 6 125.75 4.28 -2 -2 -6 110.20 4.17 2 2 7 480.53 10.44 -2 -2 -7 448.50 10.30 -2 -2 -8 50.61 3.12 2 2 9 1093.28 20.55 2 3 -14 210.57 7.13 -2 -3 14 201.20 7.31 2 -3 -13 117.75 5.47 -2 3 13 121.77 5.59 2 3 -13 132.16 5.31 -2 3 12 202.61 7.02 2 3 -12 207.12 6.52 2 -3 -12 201.74 7.16 2 -3 -11 0.71 0.83 -2 3 11 0.85 0.81 -2 -3 11 1.23 0.76 2 3 -11 0.67 0.71 2 3 -10 25.60 1.92 -2 3 10 24.33 2.12 -2 -3 10 25.51 2.04 2 -3 -10 25.09 2.15 -2 -3 9 621.08 12.11 2 -3 -9 613.85 12.63 -2 3 9 632.76 12.75 -2 -3 8 1.88 0.63 -2 3 8 2.14 0.76 2 -3 -8 1.95 0.73 2 -3 -7 511.08 10.34 -2 -3 7 510.54 9.72 2 3 -7 532.98 9.73 -2 3 7 513.07 10.30 2 -3 -6 1049.03 17.58 2 3 -6 1078.82 16.61 -2 3 6 1064.55 17.50 -2 3 5 141.82 4.13 2 3 -5 171.06 3.76 -2 -3 4 4510.95 61.57 2 3 -4 4542.85 61.36 2 3 -3 43.53 1.26 2 3 2 540.72 8.93 2 3 3 3767.73 52.36 -2 -3 -4 834.44 13.92 2 3 4 817.28 13.90 -2 -3 -5 450.80 8.98 2 3 5 434.64 8.96 2 3 6 669.64 12.77 -2 -3 -6 676.99 12.59 -2 -3 -7 789.24 14.47 2 3 7 750.47 14.35 -2 -3 -8 19.56 1.85 2 3 8 20.58 1.95 -2 -3 -9 140.69 5.41 2 3 9 140.00 5.48 -2 -3 -10 371.20 10.33 2 3 10 379.74 10.01 2 3 11 112.24 5.28 2 4 -14 11.67 1.73 -2 -4 14 13.29 1.86 2 -4 -13 -0.35 0.71 2 4 -13 0.33 0.66 -2 4 13 0.30 0.70 -2 -4 13 0.80 0.74 2 4 -12 172.73 5.71 -2 4 12 159.91 6.31 2 -4 -12 157.03 6.26 -2 -4 12 177.29 6.08 2 -4 -11 2.09 0.91 -2 4 11 1.96 0.97 -2 -4 11 2.06 0.81 -2 4 10 9.51 1.44 2 4 -10 10.07 1.27 -2 -4 10 10.55 1.33 2 -4 -10 9.19 1.34 -2 4 9 860.93 16.27 -2 -4 9 893.06 15.47 2 -4 -9 880.76 16.21 2 4 -8 1219.74 19.04 -2 4 8 1192.08 20.28 2 -4 -8 1154.26 20.03 2 4 -7 3.29 0.62 -2 4 7 1.84 0.70 2 -4 -7 2.43 0.71 -2 4 6 464.50 9.39 2 4 -6 476.97 8.44 2 -4 -6 483.30 9.60 2 4 -5 398.53 6.93 -2 -4 5 392.50 7.08 2 -4 -5 416.96 8.25 2 4 -4 4329.05 58.60 -2 -4 4 4324.72 58.66 2 4 2 4714.48 64.36 -2 -4 -3 136.97 3.66 2 4 4 76.69 2.83 -2 -4 -4 81.97 2.85 -2 -4 -5 513.12 9.98 2 4 5 519.22 10.06 -2 -4 -6 17.69 1.56 2 4 6 18.58 1.60 -2 -4 -7 185.83 5.69 2 4 7 197.93 5.86 -2 -4 -8 16.97 1.71 2 4 8 17.75 1.77 -2 -4 -9 56.06 3.27 2 4 9 58.96 3.43 -2 -4 -10 57.18 3.57 2 4 11 29.93 2.72 -2 -4 -11 29.27 2.87 2 5 -14 0.87 0.84 -2 -5 14 0.59 0.73 -2 5 13 99.61 5.16 2 -5 -13 85.00 4.65 -2 -5 13 99.29 4.58 2 5 -13 95.29 4.35 2 -5 -12 73.93 4.23 -2 5 12 76.51 4.24 -2 -5 12 75.67 3.78 2 5 -12 74.05 3.64 2 5 -11 92.86 3.84 -2 -5 11 101.87 4.16 -2 5 11 92.46 4.47 2 -5 -11 92.83 4.50 2 5 -10 56.03 2.73 -2 -5 10 52.87 2.80 -2 5 10 55.71 3.28 2 -5 -10 54.30 3.23 2 5 -9 123.52 3.99 -2 -5 9 122.74 4.17 -2 5 9 129.87 4.89 2 -5 -9 129.77 4.88 2 5 -8 511.35 9.60 -2 -5 8 515.59 9.85 -2 5 8 506.33 10.66 2 -5 -8 498.54 10.64 2 5 -7 1479.49 21.89 -2 5 7 1473.92 23.44 2 5 -6 140.22 3.49 -2 5 6 128.79 4.16 -2 -5 6 137.02 3.57 2 -5 -6 142.91 4.43 2 5 -5 465.24 7.78 -2 -5 5 480.23 7.99 2 5 -4 19.31 0.85 -2 -5 4 22.10 0.97 2 5 1 18.76 0.89 2 5 2 310.12 5.75 2 5 3 432.94 7.97 -2 -5 -4 124.62 3.67 2 5 4 121.39 3.61 -2 -5 -5 57.23 2.54 2 5 5 57.19 2.54 -2 -5 -6 64.34 2.91 2 5 6 69.02 3.08 -2 -5 -7 1792.77 28.63 2 5 7 1839.15 28.86 -2 -5 -8 211.00 6.41 -2 -5 -9 8.29 1.40 2 5 9 9.22 1.45 2 5 10 48.19 3.23 -2 -5 -10 43.84 3.08 -2 -5 -11 1.96 1.09 2 5 11 1.20 0.82 -2 -6 14 37.13 2.83 -2 -6 13 69.73 3.67 2 -6 -12 148.76 6.16 -2 -6 12 158.76 5.50 -2 6 12 146.15 6.10 -2 -6 11 11.34 1.38 2 -6 -11 12.88 1.76 -2 6 11 10.59 1.64 -2 6 10 0.48 0.73 2 6 -10 0.91 0.60 -2 -6 10 -0.39 0.52 2 -6 -10 0.06 0.62 -2 6 9 544.22 11.68 2 6 -9 526.77 10.54 -2 -6 9 530.91 10.40 2 -6 -9 540.12 11.72 2 6 -8 234.74 5.69 -2 6 8 214.58 6.24 -2 -6 8 229.67 5.52 2 -6 -8 217.69 6.27 -2 6 7 465.23 9.87 2 -6 -7 483.96 10.08 2 -6 -6 19.72 1.60 -2 -6 6 22.30 1.24 -2 -6 5 362.54 6.29 -2 -6 4 684.01 10.12 2 6 0 182.69 3.13 -2 -6 -2 206.86 4.48 2 6 2 205.90 4.30 -2 -6 -3 883.14 14.01 -2 -6 -4 1511.52 22.88 2 6 4 1504.83 22.98 -2 -6 -5 718.17 12.70 2 6 5 716.83 12.74 -2 -6 -6 36.90 2.19 2 6 6 38.43 2.28 -2 -6 -7 12.26 1.40 2 6 7 10.71 1.36 2 6 8 422.72 9.91 -2 -6 -8 402.30 9.62 -2 -6 -9 22.59 2.08 2 6 9 24.20 2.28 -2 -6 -10 96.37 4.54 2 6 10 103.04 4.78 -2 -6 -11 78.30 4.39 -2 -7 14 35.96 2.67 -2 -7 13 80.95 3.92 2 -7 -12 70.98 4.16 -2 7 12 80.98 4.36 2 -7 -11 0.61 0.69 -2 7 11 1.22 0.81 -2 -7 11 0.72 0.60 -2 7 10 13.51 1.69 -2 -7 10 15.84 1.47 2 -7 -10 12.17 1.59 -2 -7 9 18.25 1.45 -2 7 9 16.56 1.77 2 -7 -9 15.62 1.68 -2 -7 8 30.02 1.72 2 -7 -8 29.55 2.18 2 -7 -7 107.80 3.99 -2 -7 7 109.08 3.15 2 -7 -6 283.25 6.80 -2 -7 6 280.89 5.44 2 -7 -5 20.22 1.51 -2 -7 5 15.63 0.85 -2 -7 4 728.85 10.47 2 7 1 0.13 0.23 2 7 2 599.24 9.75 -2 -7 -3 84.96 2.67 -2 -7 -4 194.34 4.77 2 7 4 179.49 4.70 -2 -7 -5 123.02 3.88 2 7 5 130.02 4.08 -2 -7 -6 220.55 5.83 2 7 6 219.76 5.96 -2 -7 -7 151.20 4.99 2 7 7 161.96 5.23 2 7 8 1.14 0.69 -2 -7 -8 1.82 0.80 -2 -7 -9 68.23 3.55 -2 -7 -10 14.13 1.81 2 7 10 15.55 1.94 -2 -7 -11 46.85 3.38 2 7 11 50.82 3.56 -2 -8 13 84.18 3.82 -2 8 12 10.71 1.75 2 -8 -12 10.70 1.73 -2 -8 12 13.26 1.47 2 -8 -11 18.08 2.06 -2 8 11 17.77 2.02 -2 -8 11 20.46 1.68 2 -8 -10 0.71 0.69 -2 8 10 1.13 0.76 -2 -8 10 1.80 0.62 -2 -8 9 43.23 2.14 2 -8 -9 38.71 2.60 2 -8 -8 282.60 7.40 2 -8 -7 6.44 1.02 2 -8 -6 202.81 5.50 -2 -8 6 191.84 4.08 -2 -8 5 391.25 6.34 2 8 2 555.30 9.13 -2 -8 -3 119.90 3.30 2 8 3 132.68 3.50 -2 -8 -4 112.86 3.46 2 8 4 116.11 3.51 -2 -8 -5 73.58 2.91 2 8 5 73.24 2.96 -2 -8 -6 47.58 2.48 2 8 6 51.19 2.66 -2 -8 -7 198.44 5.79 2 8 7 200.70 5.87 -2 -8 -8 217.79 6.46 -2 -8 -9 32.35 2.45 2 8 9 40.99 2.78 -2 -8 -10 0.06 0.63 2 8 10 -0.18 0.65 -2 -8 -11 1.01 0.90 2 -9 -12 1.44 0.89 -2 -9 12 4.08 0.85 2 -9 -11 228.95 7.60 -2 -9 11 210.01 5.68 2 -9 -10 5.58 1.16 -2 -9 10 5.99 0.87 -2 -9 9 2.78 0.62 2 -9 -9 3.42 0.92 -2 -9 8 142.36 3.80 2 -9 -8 131.53 4.70 2 -9 -7 69.77 3.22 -2 -9 7 69.36 2.26 -2 -9 6 20.41 1.02 2 -9 -6 22.28 1.70 2 9 3 31.93 1.57 -2 -9 -4 7.79 0.87 2 9 4 8.63 0.94 -2 -9 -5 320.06 7.04 2 9 5 343.11 7.38 -2 -9 -6 8.78 1.10 2 9 6 8.35 1.09 2 9 7 112.75 4.07 -2 -9 -7 102.14 3.90 -2 -9 -8 74.89 3.50 2 9 8 84.66 3.77 2 9 9 134.71 5.15 2 9 10 1.82 0.82 -2 -10 10 6.49 0.87 -2 -10 9 27.48 1.59 -2 -10 8 129.41 3.37 -2 -10 7 83.01 2.37 2 10 4 132.18 3.70 -2 -10 -5 139.59 4.19 2 10 5 153.14 4.32 -2 -10 -6 71.08 3.00 2 10 6 76.53 3.13 -2 -10 -7 8.80 1.17 2 10 7 8.68 1.19 -2 -10 -8 4.52 1.03 2 10 8 2.62 0.81 2 10 9 51.30 3.05 -2 -10 -9 50.00 3.17 2 10 10 3.09 1.01 2 -11 -11 0.24 0.62 2 -11 -10 64.88 3.65 2 -11 -9 11.83 1.48 2 11 6 6.29 0.96 2 11 7 28.61 1.98 2 11 8 0.67 0.56 2 11 9 50.07 2.93 2 11 10 20.71 2.04 -3 0 14 88.80 4.75 3 0 -14 94.08 4.81 -3 0 13 0.52 0.72 3 0 -13 0.67 0.78 -3 0 12 629.39 13.64 3 0 -12 618.60 13.60 3 0 -11 -0.05 0.60 -3 0 11 0.79 0.73 -3 0 10 18.69 1.78 3 0 -10 18.56 1.76 3 0 -9 0.74 0.58 -3 0 9 0.04 0.51 3 0 -8 4924.25 69.61 -3 0 8 4957.40 69.73 3 0 -7 0.64 0.49 -3 0 7 0.29 0.43 -3 0 6 3836.75 54.40 3 0 -6 3892.61 54.42 -3 -1 14 5.62 1.35 3 -1 -14 6.76 1.48 -3 1 14 5.74 1.50 3 1 -14 5.12 1.33 -3 1 13 67.93 4.05 3 1 -13 73.54 3.97 3 -1 -13 64.09 3.93 -3 -1 13 70.12 3.98 -3 1 12 181.23 6.48 3 1 -12 172.12 6.09 3 -1 -12 177.79 6.38 -3 -1 12 167.78 6.10 -3 1 11 18.79 1.98 3 1 -11 17.59 1.84 3 -1 -11 19.46 1.96 -3 -1 11 18.94 1.90 -3 -1 10 811.08 15.36 -3 1 10 842.70 16.02 3 1 -10 819.65 15.28 3 -1 -10 845.97 15.98 3 -1 -9 1703.86 26.86 -3 -1 9 1664.25 26.39 3 1 -9 1628.28 26.22 3 1 -8 110.26 3.82 -3 -1 8 116.16 3.98 3 -1 -8 104.01 3.94 3 1 -7 939.43 15.79 -3 -1 7 940.94 15.80 3 -1 -7 960.09 16.31 -3 -1 6 20.56 1.37 3 1 -5 779.09 12.71 3 2 -14 21.23 2.20 3 -2 -14 21.61 2.51 -3 -2 14 19.20 2.21 -3 2 13 22.22 2.40 3 -2 -13 22.24 2.41 -3 -2 13 24.89 2.39 -3 2 12 422.35 11.04 3 -2 -12 418.11 10.89 -3 -2 12 448.90 10.79 -3 2 11 46.16 3.08 3 2 -11 44.75 2.76 3 -2 -11 42.61 2.94 -3 -2 11 45.70 2.85 -3 -2 10 2.04 0.79 3 2 -10 2.61 0.84 -3 -2 9 78.84 3.33 3 2 -9 83.79 3.44 -3 -2 8 7.08 1.00 -3 2 8 7.45 1.07 3 2 -8 8.80 1.07 3 2 -7 952.68 15.62 -3 2 7 941.28 16.19 -3 -2 7 932.82 15.61 3 -2 -6 29.22 1.79 -3 2 6 29.23 1.76 3 2 -6 28.05 1.54 3 2 -5 2007.80 28.93 3 3 -14 60.88 3.83 -3 -3 14 53.49 3.61 3 3 -13 268.22 7.82 -3 3 13 278.86 8.83 3 -3 -13 289.03 9.08 -3 -3 13 294.34 8.55 3 3 -12 7.99 1.28 -3 3 12 7.92 1.43 3 -3 -12 6.76 1.41 3 3 -11 404.04 9.35 -3 3 11 407.28 10.27 3 -3 -11 400.57 10.19 3 3 -10 81.86 3.52 -3 3 10 80.08 3.89 -3 -3 10 71.71 3.40 -3 -3 9 1.93 0.68 3 3 -9 1.73 0.64 -3 3 9 1.45 0.75 3 -3 -9 2.56 0.79 -3 -3 8 67.60 2.80 -3 3 8 68.06 3.24 3 -3 -7 1130.68 18.77 -3 3 7 1094.32 18.53 -3 -3 6 502.31 9.01 3 3 -5 61.56 2.09 3 3 -4 445.78 7.44 3 4 -15 41.63 3.11 3 4 -14 13.62 1.75 -3 -4 14 12.62 1.80 -3 4 13 0.37 0.83 -3 -4 13 0.71 0.75 3 -4 -13 0.73 0.82 3 4 -13 0.67 0.66 3 4 -12 320.22 8.16 3 -4 -12 317.79 9.30 -3 4 12 340.70 9.55 -3 -4 12 311.45 8.48 3 4 -11 8.38 1.24 -3 4 11 9.54 1.57 3 -4 -11 7.04 1.35 -3 -4 11 8.27 1.30 3 4 -10 918.94 15.85 -3 -4 10 879.19 16.10 -3 4 10 899.46 17.12 3 -4 -10 892.51 17.07 -3 4 9 98.57 4.16 3 -4 -9 90.84 3.96 3 4 -9 89.65 3.30 -3 -4 9 86.34 3.38 -3 -4 8 96.94 3.35 3 -4 -8 93.27 3.87 3 4 -8 104.15 3.44 -3 4 8 103.75 4.01 3 4 -7 399.12 7.77 3 -4 -7 401.48 8.89 3 4 -6 225.31 4.83 3 4 -5 1942.19 27.55 3 4 -4 86.73 2.19 3 4 5 1276.65 20.95 3 5 -15 72.92 4.06 -3 -5 14 2.05 0.90 3 5 -14 0.60 0.71 3 5 -13 14.23 1.65 3 -5 -13 10.80 1.78 -3 5 13 12.60 1.90 -3 -5 13 12.10 1.64 3 5 -12 72.70 3.45 3 -5 -12 64.57 3.91 -3 -5 12 67.34 3.49 -3 5 11 59.47 3.54 3 5 -11 60.19 2.91 3 -5 -11 63.78 3.71 -3 -5 11 62.90 3.19 3 5 -10 102.57 3.68 -3 5 10 99.60 4.43 -3 -5 10 106.40 3.96 3 -5 -10 97.46 4.38 3 -5 -9 25.03 2.13 3 5 -9 25.47 1.64 -3 5 9 24.27 2.04 -3 -5 9 21.72 1.62 3 -5 -8 0.61 0.57 -3 -5 8 0.08 0.40 3 5 -8 0.68 0.44 3 5 -7 3512.19 48.99 3 5 -6 2443.15 34.85 -3 -5 6 2514.52 34.97 3 5 -5 1257.54 18.21 3 5 -4 422.18 6.65 3 5 -3 1332.89 18.35 3 5 0 1286.08 18.21 3 5 2 0.39 0.29 3 5 3 763.89 12.80 3 5 4 1028.92 16.99 3 5 5 294.23 7.10 3 5 6 215.28 6.10 3 5 7 295.44 7.75 3 5 8 34.68 2.57 3 5 9 549.09 12.45 3 6 -15 3.99 1.17 3 6 -14 36.14 2.63 -3 -6 14 36.22 2.73 -3 -6 13 1.81 0.81 3 -6 -13 1.96 0.95 -3 -6 12 2.06 0.81 3 -6 -12 2.11 0.96 3 6 -12 2.56 0.78 3 6 -11 429.58 9.23 3 -6 -11 444.75 11.09 -3 -6 11 455.09 9.78 3 6 -10 564.29 10.80 -3 6 10 562.98 12.36 -3 -6 10 564.67 11.02 3 -6 -10 558.87 12.40 -3 -6 9 37.81 2.03 3 6 -9 39.41 2.04 3 -6 -9 39.47 2.63 -3 -6 8 77.46 2.79 3 -6 -8 73.67 3.47 3 6 -7 13.60 0.97 -3 -6 6 13.23 0.93 3 6 -6 13.52 0.93 3 6 -5 3.60 0.45 3 6 -4 818.27 11.59 3 6 0 33.58 1.11 3 6 1 226.37 4.38 3 6 2 53.98 2.00 3 6 3 142.27 3.85 3 6 4 251.72 5.92 3 6 5 87.80 3.40 3 6 6 475.34 10.00 3 6 7 9.96 1.33 3 6 8 25.20 2.19 3 6 9 243.25 7.63 3 6 10 28.51 2.61 -3 -7 15 -0.17 0.58 -3 -7 14 3.22 0.94 -3 -7 13 49.60 2.91 3 -7 -12 1.71 0.88 -3 7 12 2.57 1.08 3 7 -11 39.44 2.32 -3 7 11 39.91 2.91 3 -7 -11 40.18 2.95 -3 -7 11 38.91 2.32 3 -7 -10 0.83 0.66 -3 -7 10 0.59 0.48 3 7 -10 -0.19 0.43 -3 -7 9 16.14 1.30 3 -7 -9 16.33 1.76 3 7 -8 0.61 0.42 -3 -7 8 0.74 0.45 3 7 -7 91.42 2.71 -3 -7 7 92.82 2.76 -3 -7 6 10.46 0.77 3 7 1 2439.46 33.91 3 7 3 962.72 15.28 3 7 4 1.38 0.50 3 7 5 -0.13 0.44 3 7 6 43.54 2.50 3 7 7 33.68 2.34 3 7 8 9.79 1.41 3 7 9 1.10 0.75 3 7 10 1.11 0.86 -3 -8 15 3.18 0.94 -3 -8 14 0.05 0.53 -3 -8 13 0.04 0.52 -3 -8 12 118.24 4.21 3 -8 -12 116.96 5.24 -3 -8 11 278.21 6.70 3 -8 -11 265.23 8.16 3 -8 -10 2.18 0.83 -3 -8 10 2.24 0.61 3 -8 -9 101.06 4.37 -3 -8 9 102.90 3.32 -3 -8 8 96.29 2.98 3 8 1 327.17 5.68 3 8 2 171.67 3.90 3 8 3 94.17 2.99 3 8 4 40.15 2.05 3 8 5 29.05 1.85 3 8 6 3.26 0.76 3 8 7 24.71 1.96 3 8 8 140.15 5.11 3 8 9 75.14 3.94 3 8 10 19.14 2.12 -3 -9 14 0.37 0.55 -3 -9 13 10.44 1.30 -3 -9 12 14.60 1.41 3 -9 -12 12.90 1.84 -3 -9 11 4.87 0.86 3 -9 -11 5.68 1.21 -3 -9 10 20.51 1.48 -3 -9 9 487.87 8.99 -3 -9 8 33.25 1.54 3 9 2 11.76 0.88 3 9 4 361.44 7.46 3 9 5 7.16 0.98 3 9 6 120.67 4.15 3 9 7 3.66 0.87 3 9 9 -0.49 0.65 3 10 3 7.61 0.78 3 10 4 8.97 0.94 3 10 5 175.05 4.80 3 10 6 162.25 4.82 3 10 7 100.00 3.92 3 10 8 1.41 0.71 3 10 9 7.65 1.29 3 11 5 17.22 1.34 3 11 6 6.17 0.96 3 11 7 56.41 2.81 3 11 8 0.88 0.62 3 11 9 7.92 1.28 4 0 -14 11.61 1.94 -4 0 14 10.35 1.77 -4 0 13 0.13 0.67 4 0 -13 -0.26 0.62 -4 0 12 9.22 1.49 4 0 -12 9.74 1.49 4 0 -11 -0.05 0.57 -4 0 11 0.69 0.70 4 0 -10 140.87 5.07 -4 0 10 144.79 5.04 4 0 -9 -0.17 0.47 -4 0 9 0.74 0.67 4 0 -8 219.63 6.00 -4 0 8 221.93 5.92 -4 -1 14 30.64 2.75 4 1 -14 34.94 2.91 4 -1 -14 31.69 2.89 -4 1 14 36.79 3.17 -4 -1 13 33.75 2.73 4 1 -13 34.77 2.78 4 -1 -13 35.09 2.89 -4 1 13 35.74 2.93 -4 -1 12 146.53 5.58 4 1 -12 143.95 5.39 -4 1 12 156.58 5.96 4 -1 -12 157.41 5.97 -4 -1 11 29.88 2.36 -4 1 11 29.17 2.37 4 1 -11 32.40 2.43 4 -1 -11 30.63 2.43 -4 1 10 467.60 10.72 4 -1 -10 499.72 11.03 -4 -1 10 470.65 10.48 4 1 -10 493.57 10.59 -4 1 9 3.29 0.87 4 1 -9 3.97 0.86 4 -1 -9 3.67 0.90 -4 -1 9 5.14 1.00 -4 -1 8 150.19 4.65 -4 1 8 157.35 4.88 4 -1 -8 151.92 4.95 4 2 -15 143.93 6.01 -4 -2 14 81.11 4.42 4 2 -14 84.94 4.36 4 -2 -14 87.55 4.92 -4 -2 13 27.77 2.47 4 2 -13 31.54 2.61 4 -2 -13 28.34 2.63 -4 -2 12 92.19 4.23 4 -2 -12 94.83 4.54 -4 2 12 98.17 4.59 4 -2 -11 848.26 16.77 -4 2 11 817.37 16.41 4 -2 -10 602.02 12.78 -4 2 10 590.53 12.54 -4 -2 10 587.02 12.02 4 2 -10 582.15 11.76 4 2 -9 548.84 11.05 -4 2 9 556.30 11.58 -4 -2 9 529.57 10.81 4 2 -8 1077.03 17.77 -4 -2 8 1068.77 17.75 4 2 -7 653.26 11.66 -4 -3 15 33.04 2.93 4 3 -15 33.58 2.83 4 3 -14 0.24 0.63 4 -3 -14 0.39 0.80 -4 -3 14 -0.33 0.75 -4 3 13 124.79 5.65 -4 -3 13 137.95 5.46 4 3 -13 126.14 5.00 4 -3 -13 123.89 5.63 -4 3 12 8.44 1.53 -4 -3 12 8.86 1.39 4 3 -12 10.31 1.46 4 -3 -12 8.73 1.54 4 -3 -11 203.85 6.77 -4 3 11 204.25 6.73 4 3 -11 213.46 6.26 4 -3 -10 1280.58 22.81 -4 3 10 1324.60 22.70 4 3 -10 1303.98 21.55 -4 -3 9 357.55 7.96 4 3 -9 346.29 7.76 4 3 -8 1088.48 17.72 -4 -3 8 1078.93 17.76 4 3 -7 843.92 14.14 -4 -4 15 6.47 1.40 4 4 -15 6.13 1.33 -4 -4 14 15.45 1.91 4 4 -14 13.19 1.66 -4 4 13 216.91 7.63 -4 -4 13 229.01 7.08 4 4 -13 208.36 6.55 4 -4 -13 194.82 7.36 -4 -4 12 8.48 1.33 4 4 -12 7.88 1.25 -4 4 12 6.94 1.46 4 -4 -12 8.64 1.56 4 -4 -11 60.60 3.62 4 4 -11 61.34 3.07 -4 -4 11 65.34 3.21 -4 4 11 60.38 3.54 4 -4 -10 176.09 6.10 -4 4 10 175.48 5.96 4 4 -10 184.34 5.31 -4 -4 10 178.62 5.39 4 4 -9 112.92 3.86 -4 -4 9 100.69 3.62 -4 -4 8 392.42 7.87 4 4 -8 364.31 7.54 4 4 -6 191.57 4.43 4 4 -5 308.78 5.83 4 5 -15 23.15 2.28 -4 -5 15 25.90 2.47 4 5 -14 40.79 2.73 -4 -5 14 40.95 2.93 4 5 -13 7.38 1.21 -4 -5 13 8.93 1.39 -4 5 13 8.60 1.62 4 -5 -13 7.26 1.50 4 5 -12 19.51 1.78 -4 -5 12 18.51 1.78 -4 5 12 18.71 2.13 4 -5 -12 20.06 2.22 4 5 -11 3.55 0.83 4 -5 -11 3.63 1.07 -4 -5 11 2.87 0.82 4 5 -10 421.87 8.98 -4 -5 10 426.81 9.12 4 5 -9 0.40 0.49 -4 -5 9 0.03 0.40 -4 -5 8 122.69 3.73 4 5 -8 119.68 3.56 4 5 -7 5.20 0.69 4 5 -6 25.63 1.30 4 5 -5 3654.35 50.08 4 6 -15 126.65 5.06 4 6 -14 42.34 2.79 -4 -6 14 50.01 3.12 4 6 -13 36.90 2.46 -4 -6 13 34.67 2.45 4 -6 -13 39.77 3.21 -4 -6 12 33.75 2.32 4 -6 -12 34.51 2.90 -4 -6 11 0.81 0.60 4 6 -11 0.97 0.53 -4 -6 10 1.00 0.59 4 6 -10 0.06 0.40 -4 -6 9 344.49 7.22 4 6 -9 315.27 6.85 4 6 -8 336.26 6.72 -4 -6 8 349.56 7.00 4 6 -7 48.79 1.89 4 6 -6 877.07 13.33 4 6 -5 1608.57 22.57 4 6 -4 5.31 0.43 4 7 -15 12.53 1.62 -4 -7 15 13.03 1.67 4 7 -14 1.22 0.73 -4 -7 14 0.92 0.72 4 7 -13 47.45 2.69 -4 -7 13 52.33 2.92 4 7 -12 63.54 2.96 -4 -7 12 70.78 3.29 4 7 -11 14.61 1.33 4 7 -10 99.02 3.37 -4 -7 10 94.52 3.39 4 7 -9 849.48 13.71 -4 -7 9 823.08 13.94 4 7 -7 18.55 1.06 4 7 -6 3.88 0.45 4 7 -5 26.10 0.93 4 7 -1 175.86 3.20 4 7 0 396.87 6.75 4 7 1 171.69 3.87 4 7 2 101.46 3.04 4 7 3 360.07 7.27 4 7 4 95.33 3.41 4 7 5 1188.09 19.73 4 7 6 100.76 4.02 -4 -8 15 4.98 1.11 -4 -8 14 52.79 3.03 -4 -8 13 20.22 1.81 4 8 -12 7.92 1.19 -4 -8 12 9.79 1.21 4 8 -11 56.57 2.61 -4 -8 11 60.94 2.71 4 8 -10 51.18 2.29 -4 -8 10 56.69 2.45 4 8 -9 74.67 2.60 -4 -8 9 84.49 2.80 4 8 -8 9.51 0.83 -4 -9 14 38.82 2.43 -4 -9 13 23.83 1.81 -4 -9 12 26.72 1.83 -4 -9 11 14.89 1.29 4 9 0 9.65 0.58 4 9 1 265.39 5.07 4 9 3 16.50 1.23 4 9 4 0.18 0.40 4 9 7 4.14 1.00 4 9 8 77.48 3.74 4 10 2 120.70 3.18 4 10 3 66.85 2.43 4 10 5 1.49 0.55 4 10 6 0.45 0.50 4 11 4 18.60 1.34 4 11 5 4.72 0.79 4 11 6 2.63 0.70 4 11 7 42.42 2.49 -5 0 14 403.56 10.96 5 0 -14 410.76 11.34 -5 0 13 0.26 0.80 5 0 -13 -0.44 0.69 5 0 -12 49.32 3.22 -5 0 12 39.27 2.91 -5 0 11 0.47 0.72 5 0 -11 1.59 0.72 5 0 -10 358.37 8.99 -5 -1 14 267.30 8.49 -5 1 14 277.36 8.86 5 1 -14 267.57 8.45 5 -1 -14 286.87 9.03 5 -1 -13 1.40 0.84 -5 1 13 0.58 0.78 -5 -1 13 0.49 0.72 5 1 -13 0.49 0.69 5 -1 -12 333.12 9.25 -5 -1 12 330.84 8.83 -5 1 12 327.02 9.03 5 1 -12 312.67 8.72 5 1 -11 290.18 7.91 5 -1 -11 287.82 8.16 -5 1 11 279.96 7.97 -5 -1 11 288.55 7.89 5 1 -10 0.59 0.59 -5 -1 10 1.17 0.71 5 1 -9 73.23 3.31 5 2 -15 0.14 0.70 -5 2 14 5.93 1.40 5 2 -14 4.82 1.24 5 -2 -14 5.20 1.31 -5 -2 13 281.33 8.28 5 2 -13 303.07 8.52 5 -2 -13 287.51 8.86 5 -2 -12 80.24 4.21 -5 -2 12 80.61 3.97 5 2 -12 74.36 3.79 -5 -2 11 205.20 6.33 -5 -2 10 588.32 11.86 5 2 -9 1450.29 23.58 5 3 -15 9.59 1.57 -5 -3 15 10.76 1.72 5 3 -14 36.92 2.85 -5 3 14 36.21 3.13 -5 -3 14 38.99 2.87 -5 -3 13 189.51 6.39 5 3 -13 191.21 6.45 -5 3 13 173.77 6.71 -5 -3 12 14.55 1.72 5 3 -12 15.56 1.70 -5 -3 11 240.71 6.78 5 3 -11 227.43 6.47 5 3 -10 83.88 3.48 5 3 -9 141.38 4.48 5 3 -8 3152.01 45.39 5 4 -15 28.87 2.51 -5 -4 15 30.97 2.63 5 4 -14 29.03 2.38 -5 -4 14 30.83 2.52 -5 -4 13 93.52 4.25 5 4 -13 101.42 4.40 5 4 -12 1.55 0.73 -5 -4 12 2.12 0.83 -5 -4 11 96.10 3.92 5 4 -11 85.42 3.64 -5 -4 10 79.18 3.33 5 4 -10 80.11 3.26 5 4 -9 352.69 7.74 5 4 -8 505.32 9.71 5 4 -7 250.96 5.68 -5 -5 15 47.63 3.15 5 5 -14 38.26 2.66 -5 -5 14 36.64 2.68 -5 -5 13 200.00 6.30 5 5 -13 198.04 6.11 -5 -5 12 1.99 0.77 5 5 -11 122.46 4.30 -5 -5 11 130.54 4.52 5 5 -10 139.15 4.48 5 5 -9 5.25 0.79 5 5 -8 575.10 10.36 5 5 -7 45.01 1.97 5 5 -6 153.68 3.77 -5 -6 15 3.39 1.02 5 6 -15 4.20 1.00 5 6 -14 1.53 0.70 -5 -6 13 308.53 7.99 5 6 -13 281.13 7.42 -5 -6 12 158.57 5.18 5 6 -11 1.30 0.62 -5 -6 11 2.10 0.70 5 6 -10 60.66 2.66 5 6 -9 100.47 3.28 5 6 -8 11.80 1.01 5 6 -7 11.29 0.93 5 6 -6 22.75 1.19 5 7 -15 2.43 0.83 -5 -7 15 2.66 0.91 5 7 -14 5.52 1.05 -5 -7 14 7.26 1.24 5 7 -13 0.58 0.57 -5 -7 13 1.30 0.63 5 7 -12 6.94 1.01 -5 -7 12 8.45 1.16 5 7 -11 100.93 3.53 5 7 -10 104.03 3.38 5 7 -9 418.14 7.90 5 7 -5 434.01 6.98 5 8 -15 20.98 1.90 -5 -8 15 22.70 2.01 -5 -8 14 2.11 0.77 5 8 -14 2.64 0.79 5 8 -13 7.88 1.07 -5 -8 13 9.74 1.24 5 8 -12 155.67 4.56 5 8 -11 179.54 4.81 5 8 -10 4.14 0.69 5 8 -9 2.70 0.52 5 8 -8 39.19 1.58 5 8 -7 85.03 2.21 5 8 -6 68.11 1.72 5 8 -5 636.13 9.06 5 8 -2 8.71 0.48 5 8 -1 410.95 6.66 5 8 0 287.30 5.36 5 8 2 16.01 1.20 -5 -9 14 5.50 0.99 5 9 -1 253.36 4.23 5 9 0 191.88 3.82 5 9 1 8.11 0.75 5 9 2 165.09 4.11 5 9 3 1.32 0.50 5 9 4 0.90 0.48 5 10 0 264.96 4.60 5 10 3 24.49 1.53 5 10 4 10.25 1.07 5 10 5 8.56 1.08 6 0 -15 0.38 0.70 6 0 -14 169.85 6.72 -6 -1 15 0.14 0.81 -6 -1 14 11.07 1.72 6 1 -13 104.35 4.88 6 1 -12 5.55 1.17 6 2 -15 27.13 2.62 -6 -2 15 31.61 2.81 6 2 -14 1.84 0.90 6 2 -13 143.25 5.61 6 2 -12 0.22 0.57 6 3 -15 12.25 1.78 -6 -3 15 15.76 1.98 6 3 -14 55.43 3.44 -6 -3 14 59.55 3.52 6 3 -13 2.13 0.88 6 3 -12 26.12 2.17 6 3 -11 298.12 7.74 6 4 -15 1.71 0.90 -6 -4 15 2.60 0.97 6 4 -14 73.47 3.89 -6 -4 14 87.15 4.20 6 4 -13 212.03 6.75 6 4 -12 5.99 1.08 6 4 -11 0.26 0.51 6 4 -10 156.29 4.91 -6 -5 15 35.32 2.71 6 5 -14 53.58 3.19 -6 -5 14 56.63 3.26 6 5 -13 0.68 0.60 6 5 -12 192.86 5.96 6 5 -11 1293.80 21.24 6 5 -10 30.31 1.93 6 6 -16 3.85 1.04 6 6 -15 26.68 2.25 -6 -6 15 25.31 2.25 6 6 -14 91.13 3.95 6 6 -13 2.14 0.75 6 6 -12 1.65 0.69 6 6 -10 91.66 3.36 6 6 -9 374.78 7.72 6 7 -16 -0.53 0.63 6 7 -15 2.23 0.83 6 7 -14 0.47 0.49 6 7 -13 7.08 1.08 6 7 -12 2.62 0.70 6 7 -11 22.16 1.62 6 7 -10 16.81 1.32 6 7 -9 21.19 1.37 6 7 -8 0.56 0.36 6 8 -15 4.87 0.98 6 8 -14 4.31 0.90 6 8 -13 3.27 0.72 6 8 -12 34.44 1.99 6 8 -11 16.79 1.31 6 8 -10 66.05 2.47 6 8 -9 126.05 3.44 6 8 -8 47.29 1.79 6 8 -7 277.94 5.14 6 9 -12 64.90 2.60 6 9 -11 24.96 1.51 6 9 -9 284.56 5.44 6 10 -1 0.26 0.19 6 10 0 23.21 1.12 7 3 -15 3.70 1.08 7 3 -14 174.11 6.29 7 4 -15 0.59 0.64 7 4 -14 140.43 5.41 7 4 -13 21.16 1.96 7 5 -16 13.22 1.76 7 5 -15 -0.53 0.68 7 5 -13 94.11 4.10 7 5 -12 64.64 3.19 7 6 -16 -0.11 0.67 7 6 -15 7.73 1.31 7 6 -14 27.81 2.23 7 6 -13 8.26 1.16 7 6 -12 45.24 2.52 7 6 -11 14.08 1.37 7 7 -16 1.39 0.68 7 7 -15 57.98 3.12 7 7 -14 25.54 1.96 7 7 -13 25.71 1.95 7 7 -12 121.15 4.18 7 7 -11 46.54 2.32 7 7 -10 36.31 1.97 7 8 -14 2.84 0.77 7 8 -13 8.35 1.09 7 8 -12 0.63 0.50 7 8 -11 7.48 0.97 7 8 -10 91.36 3.00 7 8 -8 2.47 0.49 7 9 -8 0.14 0.24 0 0 0 0.00 0.00 TITL csi4_0111 in P2(1)/c REM P2(1)/c (#14 in standard setting) CELL 0.41077 9.719526 8.648565 10.589953 90.0000 115.7085 90.0000 ZERR 4.00 0.001181 0.000151 0.000357 0.0000 0.0086 0.0000 LATT 1 SYMM -x, y+1/2,-z+1/2 SFAC I Cs UNIT 16.00 4.00 TREF HKLF 4 END _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' ; _shelx_hkl_checksum 62657 _olex2_submission_special_instructions 'No special instructions were received' _oxdiff_exptl_absorpt_empirical_details ; Empirical correction (ABSPACK) includes: - Absorption correction using spherical harmonics - Frame scaling - Detector area scaling ; _oxdiff_exptl_absorpt_empirical_full_max 1.117 _oxdiff_exptl_absorpt_empirical_full_min 0.884 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_disorder_assembly _atom_site_disorder_group I2 I 0.38622(9) 0.71360(3) 0.39521(3) 0.0295(3) Uani 1 1 d . . . . . Cs1 Cs 0.77864(9) 0.87866(4) 0.69178(3) 0.0332(3) Uani 1 1 d . . . . . I1 I 0.56313(10) 0.90966(4) 0.31141(3) 0.0331(4) Uani 1 1 d . . . . . I3 I 0.17400(9) 0.50392(4) 0.45229(4) 0.0324(3) Uani 1 1 d . . . . . I4 I 1.05177(9) 0.64776(4) 0.99818(3) 0.0320(4) Uani 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 I2 0.0325(10) 0.02798(17) 0.02840(15) -0.00168(8) 0.0137(3) 0.00235(17) Cs1 0.0358(10) 0.03355(18) 0.02884(15) 0.00235(8) 0.0126(3) 0.00332(18) I1 0.0322(11) 0.0374(2) 0.03105(17) 0.00226(10) 0.0150(3) -0.0019(2) I3 0.0331(10) 0.02709(18) 0.03836(18) 0.00292(9) 0.0168(3) -0.0007(2) I4 0.0303(11) 0.02941(19) 0.03465(17) 0.00232(9) 0.0125(3) 0.00532(18) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source Cs Cs -1.8030 0.7961 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' I I -2.2298 0.6770 '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 Cs1 I2 Cs1 90.987(16) 3_676 . ? I1 I2 Cs1 61.911(18) . . ? I1 I2 Cs1 67.53(2) . 3_676 ? I1 I2 I3 173.92(2) . . ? I3 I2 Cs1 110.73(3) . 3_676 ? I3 I2 Cs1 124.167(13) . . ? I2 Cs1 I2 89.013(16) 3_676 . ? I2 Cs1 Cs1 43.140(12) . 3_676 ? I2 Cs1 Cs1 45.872(11) 3_676 3_676 ? I2 Cs1 I4 103.376(14) 3_676 4_575 ? I2 Cs1 I4 63.196(15) 3_676 2_756 ? I1 Cs1 I2 42.854(15) . . ? I1 Cs1 I2 71.727(11) . 3_676 ? I1 Cs1 I2 43.547(13) 3_676 3_676 ? I1 Cs1 I2 68.381(19) 3_676 . ? I1 Cs1 I2 63.494(15) 4_576 . ? I1 Cs1 I2 116.82(2) 4_576 3_676 ? I1 Cs1 Cs1 42.208(15) . 3_676 ? I1 Cs1 Cs1 89.32(2) 4_576 3_676 ? I1 Cs1 Cs1 40.519(12) 3_676 3_676 ? I1 Cs1 I1 106.23(2) . 4_576 ? I1 Cs1 I1 82.727(18) . 3_676 ? I1 Cs1 I1 73.271(15) 3_676 4_576 ? I1 Cs1 I3 74.308(11) . 3_666 ? I1 Cs1 I3 147.93(2) . 2_656 ? I1 Cs1 I3 134.55(2) . 4_676 ? I1 Cs1 I4 147.543(15) . . ? I1 Cs1 I4 135.678(13) 4_576 4_575 ? I1 Cs1 I4 142.984(12) 3_676 4_575 ? I1 Cs1 I4 63.513(15) . 2_756 ? I1 Cs1 I4 68.294(19) . 4_575 ? I1 Cs1 I4 105.912(14) 3_676 2_756 ? I1 Cs1 I4 169.574(15) 4_576 2_756 ? I3 Cs1 I2 123.39(3) 2_656 . ? I3 Cs1 I2 145.964(12) 3_666 3_676 ? I3 Cs1 I2 80.297(12) 2_656 3_676 ? I3 Cs1 I2 67.067(16) 3_666 . ? I3 Cs1 I2 172.342(19) 4_676 . ? I3 Cs1 I2 96.643(16) 4_676 3_676 ? I3 Cs1 Cs1 106.25(2) 2_656 3_676 ? I3 Cs1 Cs1 142.242(13) 4_676 3_676 ? I3 Cs1 Cs1 106.678(17) 3_666 3_676 ? I3 Cs1 I1 133.26(3) 3_666 3_676 ? I3 Cs1 I1 74.950(14) 3_666 4_576 ? I3 Cs1 I1 72.577(13) 2_656 4_576 ? I3 Cs1 I1 117.770(14) 4_676 4_576 ? I3 Cs1 I1 66.024(18) 2_656 3_676 ? I3 Cs1 I1 119.267(15) 4_676 3_676 ? I3 Cs1 I3 62.95(2) 2_656 4_676 ? I3 Cs1 I3 132.782(11) 2_656 3_666 ? I3 Cs1 I3 105.608(19) 3_666 4_676 ? I3 Cs1 I4 71.968(18) 4_676 2_756 ? I3 Cs1 I4 116.928(15) 2_656 2_756 ? I3 Cs1 I4 63.437(13) 2_656 . ? I3 Cs1 I4 72.440(19) 4_676 4_575 ? I3 Cs1 I4 135.33(3) 2_656 4_575 ? I3 Cs1 I4 61.062(14) 3_666 4_575 ? I3 Cs1 I4 99.402(17) 3_666 2_756 ? I4 Cs1 I2 106.339(13) 2_756 . ? I4 Cs1 I2 139.952(11) . 3_676 ? I4 Cs1 I2 124.316(15) . . ? I4 Cs1 I2 101.273(15) 4_575 . ? I4 Cs1 Cs1 158.16(3) . 3_676 ? I4 Cs1 Cs1 107.370(14) 4_575 3_676 ? I4 Cs1 Cs1 83.890(14) 2_756 3_676 ? I4 Cs1 I1 69.452(18) . 4_576 ? I4 Cs1 I1 123.680(16) . 3_676 ? I4 Cs1 I3 52.883(15) . 4_676 ? I4 Cs1 I3 73.563(12) . 3_666 ? I4 Cs1 I4 92.00(2) . 4_575 ? I4 Cs1 I4 117.84(2) . 2_756 ? I4 Cs1 I4 40.844(14) 2_756 4_575 ? I2 I1 Cs1 75.235(16) . . ? I2 I1 Cs1 102.092(17) . 4_575 ? I2 I1 Cs1 68.92(2) . 3_676 ? Cs1 I1 Cs1 100.57(2) . 4_575 ? Cs1 I1 Cs1 97.273(18) . 3_676 ? Cs1 I1 Cs1 157.197(19) 3_676 4_575 ? I2 I3 Cs1 103.58(2) . 3_666 ? I2 I3 Cs1 105.161(17) . 4_475 ? I2 I3 Cs1 125.57(2) . 2_646 ? Cs1 I3 Cs1 117.05(2) 2_646 4_475 ? Cs1 I3 Cs1 101.873(17) 3_666 4_475 ? Cs1 I3 Cs1 99.815(9) 2_646 3_666 ? Cs1 I4 Cs1 95.49(2) . 4_576 ? Cs1 I4 Cs1 139.156(14) 2_746 4_576 ? Cs1 I4 Cs1 99.852(13) . 2_746 ? I4 I4 Cs1 67.18(3) 3_767 4_576 ? I4 I4 Cs1 112.35(3) 3_767 . ? I4 I4 Cs1 71.97(2) 3_767 2_746 ? 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 I2 Cs1 3.8172(6) 3_676 ? I2 Cs1 4.0071(10) . ? I2 I1 2.8184(9) . ? I2 I3 2.9984(8) . ? Cs1 Cs1 5.5816(14) 3_676 ? Cs1 I1 3.7803(12) 3_676 ? Cs1 I1 3.6558(6) . ? Cs1 I1 3.8095(8) 4_576 ? Cs1 I3 3.7697(11) 4_676 ? Cs1 I3 3.7533(4) 2_656 ? Cs1 I3 3.7547(5) 3_666 ? Cs1 I4 4.0032(10) 4_575 ? Cs1 I4 3.7537(7) . ? Cs1 I4 3.8803(7) 2_756 ? I4 I4 2.7532(9) 3_767 ? _cod_database_fobs_code 2022880