#------------------------------------------------------------------------------ #$Date: 2024-02-04 13:40:19 +0200 (Sun, 04 Feb 2024) $ #$Revision: 289452 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/24/78/7247808.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_7247808 loop_ _publ_author_name 'Pradhan, Abinash' 'Sahoo, Sanand' 'Samal, Saroj L.' _publ_section_title ; (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties ; _journal_issue 3 _journal_name_full CrystEngComm _journal_page_first 312 _journal_page_last 323 _journal_paper_doi 10.1039/D3CE01019H _journal_volume 26 _journal_year 2024 _chemical_formula_moiety 'Bi Br5, 2(C2 H8 N)' _chemical_formula_sum 'C4 H16 Bi Br5 N2' _chemical_formula_weight 700.72 _space_group_crystal_system orthorhombic _space_group_IT_number 41 _space_group_name_Hall 'A 2 -2ab' _space_group_name_H-M_alt 'A e a 2' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary dual _audit_creation_date 2023-06-01 _audit_creation_method ; Olex2 1.5-alpha (compiled 2021.06.29 svn.r12e2184c for OlexSys, GUI svn.r6374) ; _audit_update_record ; 2023-10-09 deposited with the CCDC. 2023-12-01 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 18.2458(5) _cell_length_b 22.4324(7) _cell_length_c 7.8919(2) _cell_measurement_reflns_used 4210 _cell_measurement_temperature 90(2) _cell_measurement_theta_max 26.5540 _cell_measurement_theta_min 2.1240 _cell_volume 3230.13(16) _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 1.5-alpha (Dolomanov et al., 2009)' _computing_publication_material 'Olex2 1.5-alpha (Dolomanov et al., 2009)' _computing_structure_refinement 'SHELXL 2018/3 (Sheldrick, 2015)' _computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)' _diffrn_ambient_temperature 90(2) _diffrn_detector 'Hybrid Pixel Array Detector' _diffrn_detector_area_resol_mean 10.0000 _diffrn_measured_fraction_theta_full 1.000 _diffrn_measured_fraction_theta_max 0.956 _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 74.00 99.00 0.50 131.13 -- 10.00 37.00 59.00 50 2 \w -61.00 -36.00 0.50 131.13 -- -10.20 -37.00 -96.00 50 3 \w 32.00 58.00 0.50 131.13 -- -10.20 37.00 59.00 52 4 \w -17.00 98.00 0.50 131.13 -- 10.00 57.00-180.00 230 5 \w -14.00 79.00 0.50 131.13 -- -10.20 38.00 30.00 186 ; _diffrn_measurement_device 'four-circle diffractometer' _diffrn_measurement_device_type 'XtaLAB Pro II AFC12 (RINC): Kappa single' _diffrn_measurement_method '\w scans' _diffrn_orient_matrix_type 'CrysAlisPro convention (1999,Acta A55,543-557)' _diffrn_orient_matrix_UB_11 0.0406665000 _diffrn_orient_matrix_UB_12 0.0102132000 _diffrn_orient_matrix_UB_13 0.0323065000 _diffrn_orient_matrix_UB_21 -0.0137455000 _diffrn_orient_matrix_UB_22 0.0299341000 _diffrn_orient_matrix_UB_23 -0.0110865000 _diffrn_orient_matrix_UB_31 -0.0789481000 _diffrn_orient_matrix_UB_32 0.0000856000 _diffrn_orient_matrix_UB_33 0.0185527000 _diffrn_radiation_monochromator mirror _diffrn_radiation_probe x-ray _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0310 _diffrn_reflns_av_unetI/netI 0.0353 _diffrn_reflns_Laue_measured_fraction_full 1.000 _diffrn_reflns_Laue_measured_fraction_max 0.956 _diffrn_reflns_limit_h_max 22 _diffrn_reflns_limit_h_min -20 _diffrn_reflns_limit_k_max 27 _diffrn_reflns_limit_k_min -28 _diffrn_reflns_limit_l_max 10 _diffrn_reflns_limit_l_min -6 _diffrn_reflns_number 7989 _diffrn_reflns_point_group_measured_fraction_full 1.000 _diffrn_reflns_point_group_measured_fraction_max 0.957 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.074 _diffrn_reflns_theta_min 1.816 _diffrn_source 'micro-focus sealed X-ray tube' _diffrn_source_type 'Rigaku (Mo) X-ray Source' _exptl_absorpt_coefficient_mu 23.255 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 0.18374 _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_density_diffrn 2.882 _exptl_crystal_description crystalline _exptl_crystal_F_000 2496 _exptl_crystal_size_max 0.13 _exptl_crystal_size_mid 0.11 _exptl_crystal_size_min 0.08 _refine_diff_density_max 1.047 _refine_diff_density_min -1.017 _refine_diff_density_rms 0.200 _refine_ls_abs_structure_details ; Refined as a perfect inversion twin. ; _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.057 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 106 _refine_ls_number_reflns 2664 _refine_ls_number_restraints 22 _refine_ls_restrained_S_all 1.054 _refine_ls_R_factor_all 0.0582 _refine_ls_R_factor_gt 0.0381 _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^)+(0.0503P)^2^+19.0466P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0913 _refine_ls_wR_factor_ref 0.0993 _reflns_Friedel_coverage 0.858 _reflns_Friedel_fraction_full 1.000 _reflns_Friedel_fraction_max 0.957 _reflns_number_gt 2067 _reflns_number_total 2664 _reflns_threshold_expression 'I > 2\s(I)' _iucr_refine_instructions_details ; TITL ab258_100222_a.res in Aba2 ab258_100222.res created by SHELXL-2018/3 at 15:08:25 on 01-Jun-2023 REM Old TITL ab258_100222 in Cmce REM SHELXT solution in Aba2: R1 0.171, Rweak 0.011, Alpha 0.030 REM 0.783 for 100 systematic absences, Orientation a'=c, b'=-b, c'=a REM Formula found by SHELXT: N Br5 Bi CELL 0.71073 18.2458 22.4324 7.8919 90 90 90 ZERR 8 0.0005 0.0007 0.0002 0 0 0 LATT -5 SYMM -X,-Y,+Z SYMM 0.5+X,0.5-Y,+Z SYMM 0.5-X,0.5+Y,+Z SFAC C H Bi Br N UNIT 32 128 8 40 16 SIMU 0.02 0.04 2 C1 C4 N4 RIGU 0.01 0.01 C1 C4 N4 RIGU 0.01 0.01 N4 C1 C4 SIMU 0.02 0.04 2 N4 C1 C4 L.S. 40 PLAN 5 CONF list 4 MORE -1 BOND $H fmap 2 53 acta TWIN -1 0 0 0 -1 0 0 0 -1 2 REM REM REM WGHT 0.050300 19.046602 FVAR 0.07090 BI1 3 0.372266 0.368600 0.396073 11.00000 0.03478 0.05862 = 0.03368 0.00484 -0.00086 0.00739 BR1 4 0.471273 0.380403 0.137819 11.00000 0.06319 0.10084 = 0.05393 0.00485 0.02162 0.00391 BR2 4 0.469612 0.383097 0.650029 11.00000 0.05321 0.13519 = 0.06275 -0.02159 -0.02523 0.00225 BR3 4 0.401020 0.244888 0.390533 11.00000 0.09009 0.05231 = 0.11396 -0.00041 0.01657 0.01419 BR4 4 0.249875 0.350502 0.645628 11.00000 0.08290 0.12552 = 0.07092 0.00260 0.04526 -0.00598 BR5 4 0.338867 0.492351 0.401926 11.00000 0.06707 0.05310 = 0.16866 0.01656 -0.01985 0.00781 N2 5 0.153080 0.468318 0.400954 11.00000 0.06053 0.07075 = 0.12148 0.01506 0.01168 0.00198 AFIX 33 H2A 2 0.125839 0.438338 0.362354 11.00000 -1.20000 H2B 2 0.195432 0.469266 0.345070 11.00000 -1.20000 H2C 2 0.161687 0.463114 0.510968 11.00000 -1.20000 AFIX 0 C3 1 0.114720 0.523684 0.375838 11.00000 0.10790 0.06594 = 0.22498 -0.02881 -0.12823 0.02535 AFIX 23 H3A 2 0.104426 0.528182 0.255933 11.00000 -1.20000 H3B 2 0.068091 0.521557 0.434565 11.00000 -1.20000 AFIX 0 C2 1 0.153151 0.575617 0.433183 11.00000 0.09006 0.06793 = 0.09976 0.00342 0.03900 0.01466 AFIX 33 H2D 2 0.123918 0.610396 0.411822 11.00000 -1.50000 H2E 2 0.162441 0.572303 0.552545 11.00000 -1.50000 H2F 2 0.198840 0.578940 0.373599 11.00000 -1.50000 AFIX 6 PART -1 C1 1 0.317365 0.173983 0.942202 11.00000 0.13648 0.14655 = 0.11028 -0.04715 -0.00667 -0.04858 AFIX 33 H1A 2 0.300100 0.140328 0.878539 11.00000 -1.50000 H1B 2 0.338612 0.160460 1.046637 11.00000 -1.50000 H1C 2 0.277075 0.200179 0.966193 11.00000 -1.50000 AFIX 5 C4 1 0.375299 0.207459 0.838864 11.00000 0.18523 0.12399 = 0.09330 -0.01982 0.00242 -0.01463 AFIX 23 H4A 2 0.415704 0.180850 0.813171 11.00000 -1.20000 H4B 2 0.354064 0.220636 0.732592 11.00000 -1.20000 AFIX 5 N4 5 0.403661 0.261029 0.936603 11.00000 0.19197 0.11955 = 0.09187 0.03429 -0.00629 -0.07287 AFIX 33 H4C 2 0.437211 0.279937 0.874853 11.00000 -1.20000 H4D 2 0.366671 0.285682 0.958825 11.00000 -1.20000 H4E 2 0.423721 0.248858 1.033403 11.00000 -1.20000 AFIX 0 HKLF 4 REM ab258_100222_a.res in Aba2 REM wR2 = 0.0993, GooF = S = 1.057, Restrained GooF = 1.054 for all data REM R1 = 0.0381 for 2067 Fo > 4sig(Fo) and 0.0582 for all 2664 data REM 106 parameters refined using 22 restraints END WGHT 0.0503 19.0790 REM Highest difference peak 1.047, deepest hole -1.017, 1-sigma level 0.200 Q1 1 0.4602 0.4209 0.3967 11.00000 0.05 1.05 Q2 1 0.3655 0.4126 0.4006 11.00000 0.05 1.00 Q3 1 0.3422 0.2278 0.8947 11.00000 0.05 0.81 Q4 1 0.4184 0.4996 0.4104 11.00000 0.05 0.79 Q5 1 0.4393 0.3199 0.4007 11.00000 0.05 0.79 REM The information below was added by Olex2. REM REM R1 = 0.0381 for 2067 Fo > 4sig(Fo) and 0.0582 for all 8269 data REM 106 parameters refined using n/a restraints REM Highest difference peak 1.05, deepest hole -1.02 REM Mean Shift 0, Max Shift 0.001. REM +++ Tabular Listing of Refinement Information +++ REM R1_all = 0.0582 REM R1_gt = 0.0381 REM wR_ref = 0.0993 REM GOOF = 1.057 REM Shift_max = 0.001 REM Shift_mean = 0 REM Reflections_all = 8269 REM Reflections_gt = 2067 REM Parameters = 106 REM Hole = -1.02 REM Peak = 1.05 ; _cod_data_source_file d3ce01019h2.cif _cod_data_source_block ab258_100222 _cod_depositor_comments 'Adding full bibliography for 7247803--7247812.cif.' _cod_original_sg_symbol_Hall 'A 2 -2ac' _cod_database_code 7247808 _shelx_shelxl_version_number 2018/3 _chemical_oxdiff_formula (C2H5NH3)2BiClBr4 _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. ; _reflns_odcompleteness_completeness 99.47 _reflns_odcompleteness_iscentric 1 _reflns_odcompleteness_theta 26.32 _olex2_refinement_description ; 1. Fixed Uiso At 1.2 times of: All C(H,H) groups, All N(H,H,H) groups At 1.5 times of: All C(H,H,H) groups 2. Uiso/Uaniso restraints and constraints C1 \\sim C4 \\sim N4: within 2A with sigma of 0.02 and sigma for terminal atoms of 0.04 within 2A N4 \\sim C1 \\sim C4: within 2A with sigma of 0.02 and sigma for terminal atoms of 0.04 within 2A 3. Rigid body (RIGU) restrains C1, C4, N4 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01 N4, C1, C4 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01 4.a Free rotating group: C1(C4,N4) 4.b Secondary CH2 refined with riding coordinates: C3(H3A,H3B), C4(H4A,H4B) 4.c Me refined with riding coordinates: N2(H2A,H2B,H2C), C2(H2D,H2E,H2F), C1(H1A,H1B,H1C), N4(H4C,H4D,H4E) ; _olex2_submission_special_instructions 'No special instructions were received' _oxdiff_exptl_absorpt_empirical_details ; Empirical correction (ABSPACK) includes: - Absorption correction using spherical harmonics - Frame scaling ; _oxdiff_exptl_absorpt_empirical_full_max 4.064 _oxdiff_exptl_absorpt_empirical_full_min 0.651 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, z' 'x+1/2, -y+1/2, z' '-x+1/2, y+1/2, z' 'x, y+1/2, z+1/2' '-x, -y+1/2, z+1/2' 'x+1/2, -y+1, z+1/2' '-x+1/2, y+1, 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 Bi1 Bi 0.37227(2) 0.36860(2) 0.3961(6) 0.0424(2) Uani 1 1 d . . . . . Br1 Br 0.4713(3) 0.3804(3) 0.1378(3) 0.0727(16) Uani 1 1 d . . . . . Br2 Br 0.4696(3) 0.3831(4) 0.6500(3) 0.0837(18) Uani 1 1 d . . . . . Br3 Br 0.40102(11) 0.24489(8) 0.3905(14) 0.0855(7) Uani 1 1 d . . . . . Br4 Br 0.2499(7) 0.35050(10) 0.6456(13) 0.0931(6) Uani 1 1 d . . . . . Br5 Br 0.33887(10) 0.49235(8) 0.4019(15) 0.0963(9) Uani 1 1 d . . . . . N2 N 0.1531(7) 0.4683(6) 0.401(7) 0.084(5) Uani 1 1 d . . . . . H2A H 0.125839 0.438338 0.362354 0.101 Uiso 1 1 calc R U . . . H2B H 0.195432 0.469266 0.345070 0.101 Uiso 1 1 calc R U . . . H2C H 0.161687 0.463114 0.510968 0.101 Uiso 1 1 calc R U . . . C3 C 0.1147(12) 0.5237(9) 0.376(6) 0.133(15) Uani 1 1 d . . . . . H3A H 0.104426 0.528182 0.255933 0.160 Uiso 1 1 calc R U . . . H3B H 0.068091 0.521557 0.434565 0.160 Uiso 1 1 calc R U . . . C2 C 0.1532(11) 0.5756(9) 0.433(5) 0.086(12) Uani 1 1 d . . . . . H2D H 0.123918 0.610396 0.411822 0.129 Uiso 1 1 calc R U . . . H2E H 0.162441 0.572303 0.552545 0.129 Uiso 1 1 calc R U . . . H2F H 0.198840 0.578940 0.373599 0.129 Uiso 1 1 calc R U . . . C1 C 0.3174(13) 0.1740(11) 0.942(3) 0.131(12) Uani 1 1 d G U . A -1 H1A H 0.300100 0.140328 0.878539 0.197 Uiso 1 1 calc R U . A -1 H1B H 0.338612 0.160460 1.046637 0.197 Uiso 1 1 calc R U . A -1 H1C H 0.277075 0.200179 0.966193 0.197 Uiso 1 1 calc R U . A -1 C4 C 0.3753(14) 0.2075(11) 0.839(2) 0.134(10) Uani 1 1 d G U . A -1 H4A H 0.415704 0.180850 0.813171 0.161 Uiso 1 1 calc R U . A -1 H4B H 0.354064 0.220636 0.732592 0.161 Uiso 1 1 calc R U . A -1 N4 N 0.4037(12) 0.2610(9) 0.937(3) 0.134(10) Uani 1 1 d G U . A -1 H4C H 0.437211 0.279937 0.874853 0.161 Uiso 1 1 calc R U . A -1 H4D H 0.366671 0.285682 0.958825 0.161 Uiso 1 1 calc R U . A -1 H4E H 0.423721 0.248858 1.033403 0.161 Uiso 1 1 calc R U . A -1 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 Bi1 0.0348(3) 0.0586(4) 0.0337(3) 0.0048(11) -0.0009(11) 0.0074(2) Br1 0.063(4) 0.101(3) 0.054(4) 0.005(3) 0.022(3) 0.004(3) Br2 0.053(3) 0.135(4) 0.063(4) -0.022(4) -0.025(3) 0.002(4) Br3 0.0901(12) 0.0523(10) 0.1140(18) 0.000(5) 0.017(5) 0.0142(8) Br4 0.0829(11) 0.1255(16) 0.0709(11) 0.003(7) 0.0453(10) -0.006(6) Br5 0.0671(10) 0.0531(10) 0.169(3) 0.017(4) -0.020(4) 0.0078(8) N2 0.061(8) 0.071(10) 0.121(14) 0.02(4) 0.01(3) 0.002(7) C3 0.108(17) 0.066(13) 0.22(4) -0.03(3) -0.13(3) 0.025(13) C2 0.090(13) 0.068(13) 0.10(4) 0.003(15) 0.039(18) 0.015(11) C1 0.14(2) 0.15(2) 0.11(3) -0.047(18) -0.007(16) -0.049(16) C4 0.19(2) 0.12(2) 0.09(2) -0.020(15) 0.002(16) -0.015(16) N4 0.192(19) 0.120(17) 0.09(3) 0.034(15) -0.006(16) -0.073(15) 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' Bi Bi -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Br Br -0.2901 2.4595 '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' loop_ _diffrn_refln_index_h _diffrn_refln_index_k _diffrn_refln_index_l _diffrn_refln_intensity_net _diffrn_refln_intensity_u 2 0 0 73.07 1.98 -2 0 0 89.52 1.87 -2 0 0 77.48 1.97 2 0 0 88.97 1.89 -3 0 0 0.75 0.33 -3 0 0 0.04 0.39 3 0 0 0.16 0.32 3 0 0 0.19 0.38 4 0 0 1416.87 28.71 -4 0 0 1423.99 28.66 4 0 0 1500.79 28.39 -4 0 0 1517.53 28.36 5 0 0 -0.04 0.54 -5 0 0 0.3 0.57 5 0 0 1.28 0.68 -5 0 0 -0.02 0.7 -6 0 0 81.11 2.32 6 0 0 78.38 2.67 -6 0 0 73.23 2.58 6 0 0 78.69 2.34 7 0 0 -0.38 0.88 -7 0 0 1.01 0.98 -7 0 0 0.33 0.79 7 0 0 -0.33 0.93 -8 0 0 2399.79 45.16 -8 0 0 2282.58 45.76 8 0 0 2281.22 45.99 8 0 0 2344.85 45.35 9 0 0 -0.25 1.29 -9 0 0 -0.35 1.05 9 0 0 -0.5 1.18 -9 0 0 -0.51 1.3 10 0 0 369.74 8.65 -10 0 0 380.96 8.37 -10 0 0 363.56 8.93 10 0 0 357.34 9.23 -11 0 0 -0.17 1.6 11 0 0 -0.11 1.71 11 0 0 -0.54 1.54 -11 0 0 -0.25 1.33 12 0 0 302.77 8.57 12 0 0 303.04 7.84 -12 0 0 322.21 7.5 -12 0 0 298.47 8.08 13 0 0 -0.61 1.97 13 0 0 -0.06 1.99 -13 0 0 0.88 1.83 14 0 0 187.27 6.1 -14 0 0 185.92 6.01 14 0 0 185.45 6.56 15 0 0 -0.73 2.65 16 0 0 11.81 3.12 17 0 0 1.1 3.17 18 0 0 108.83 5.9 19 0 0 0.1 3.4 20 0 0 131.53 6.87 21 0 0 -4.16 4.07 22 0 0 0.87 4.22 0 -2 0 35.03 1.68 -1 2 0 2804.28 49.14 -1 -2 0 2592.78 48.68 1 2 0 2610.18 48.69 -1 2 0 2580.32 48.76 1 -2 0 2589.08 48.74 -1 2 0 2564.86 48.73 2 -2 0 50.4 1.47 -2 2 0 50.86 1.46 2 -2 0 55.13 1.64 -2 2 0 54.96 1.62 3 -2 0 869.26 16.43 -3 2 0 788.31 16.27 -3 -2 0 829.31 15.86 -3 -2 0 839.95 16.37 3 -2 0 796.38 16.28 -3 2 0 806.59 16.23 3 2 0 835.59 15.87 4 -2 0 2.46 0.57 4 -2 0 2.37 0.64 -4 2 0 1.91 0.66 -4 2 0 1.93 0.61 -4 -2 0 2.57 0.61 -4 -2 0 1.87 0.39 4 2 0 2.04 0.43 5 2 0 149.82 4.06 -5 2 0 142.66 3.71 -5 -2 0 155.33 3.42 5 -2 0 154.62 3.91 -5 -2 0 148.24 3.97 -5 2 0 154.5 3.94 5 -2 0 148.82 3.94 5 2 0 155.53 3.45 6 2 0 1180.93 22.45 6 -2 0 1183.45 23.03 -6 -2 0 1171.37 22.38 -6 2 0 1114.99 22.75 -6 2 0 1145.05 23.03 6 2 0 1093.87 23.34 6 -2 0 1160.95 23.17 -6 -2 0 1123.72 23.21 7 -2 0 50.09 2.26 -7 2 0 45.48 1.94 -7 -2 0 46.08 2.18 -7 -2 0 45.55 1.63 7 2 0 46.11 2.3 7 2 0 47.98 1.72 -7 2 0 46.47 2.12 7 -2 0 48.37 2.08 8 -2 0 97.43 3.45 8 2 0 100.28 3.7 8 2 0 100.96 2.9 -8 -2 0 101.51 2.8 -8 2 0 100.86 3.13 8 -2 0 102.98 3.34 -8 -2 0 97.91 3.46 -8 2 0 98.37 3.37 -9 -2 0 3065.06 60.84 9 -2 0 3083.28 60.95 -9 2 0 3140.55 60.67 -9 -2 0 3136.93 59.79 -9 2 0 3124.3 60.21 9 -2 0 3103.04 60.61 9 2 0 3122.38 60.02 9 2 0 3174.15 61.22 10 -2 0 200.83 5.77 10 2 0 215.71 6.28 -10 -2 0 209.81 5.95 10 2 0 207.06 5.3 -10 2 0 212.7 5.48 -10 2 0 207.29 5.82 -10 -2 0 203.95 5.04 10 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18.67 3.25 14 -4 4 15.93 3.06 15 -4 4 7.09 3.58 15 4 4 7.19 3.25 15 -4 4 4.38 2.98 16 -4 4 119.8 5.88 16 -4 4 119.07 6.09 16 4 4 114.91 5.63 17 -4 4 6.83 3.99 17 -4 4 15.47 3.75 18 -4 4 108.26 6.12 18 -4 4 101.23 6.08 19 -4 4 -0.6 4.07 19 -4 4 1.25 3.95 20 -4 4 116.55 6.72 21 -4 4 -0.21 4.28 0 -6 -4 39.38 1.11 0 6 4 41.62 2.71 0 -6 4 43.06 2.27 0 6 -4 43.82 2 0 6 4 42.24 1.89 0 6 -4 42.97 2.2 0 -6 -4 39.29 1.84 0 -6 4 40.83 1.93 1 6 4 634.64 14.13 1 -6 -4 621.24 12.78 1 -6 -4 618.93 12.07 1 -6 4 627.59 12.89 -1 6 4 626.44 14.04 -1 -6 -4 591.25 12.17 1 6 -4 670.36 12.69 1 6 4 634.99 12.63 -1 6 4 592.39 13.96 -1 6 -4 496.41 14.03 1 -6 4 656.18 13.61 -1 -6 4 646.79 13.33 -1 6 -4 638.57 13.45 1 6 -4 650.95 13.23 1 -6 4 662.74 13.61 2 6 -4 234.61 5.7 2 -6 4 227.66 5.99 2 6 4 223.89 6.66 2 -6 -4 230.16 4.84 -2 6 4 256.54 8.33 -2 6 4 224.43 6.51 -2 6 -4 225.45 7.65 -2 -6 -4 222.72 4.97 -2 -6 -4 315.51 8.83 2 -6 4 232.73 6.2 -2 -6 4 243.71 5.8 -2 6 -4 238.45 6.14 3 -6 4 443.4 10.31 3 6 4 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2.66 8 -6 4 54.22 3.08 8 -6 4 57.79 3.56 -8 6 -4 54.9 3.34 8 6 4 52.5 3.4 -9 6 -4 865.64 18.1 -9 -6 -4 834.21 18.46 9 -6 4 888.49 18.85 -9 -6 4 787.47 18.08 -9 -6 4 869.86 17.84 -9 -6 -4 840.44 17.85 9 -6 4 869.08 19.06 -9 6 -4 862 18.71 9 6 4 847.17 18.91 -10 6 -4 110.01 4.06 -10 -6 -4 110.44 4.37 10 -6 4 110.88 4.67 -10 -6 4 98.13 4.01 10 -6 4 105.07 4.91 10 6 4 105.21 4.71 -11 6 -4 308.97 8.04 -11 -6 -4 295.69 8.16 11 -6 4 311.3 8.86 11 -6 4 309.83 9.1 11 6 4 301.55 8.67 12 -6 4 2.85 3.02 12 -6 4 1.67 2.61 12 6 4 0.06 2.8 13 -6 4 24.06 3.71 13 -6 4 21.74 3.31 13 6 4 18.54 3.2 14 -6 4 6.54 3.35 14 6 4 8.32 3.17 14 -6 4 3.73 2.89 15 -6 4 39.39 4.12 15 -6 4 39.15 4.36 15 6 4 42.1 3.88 16 -6 4 27.88 4.39 16 -6 4 31.69 4.11 17 -6 4 127.3 6.46 17 -6 4 114.3 6.43 18 -6 4 0.09 4.09 18 -6 4 0.47 3.75 19 -6 4 5.36 4.49 19 -6 4 6.15 4.16 20 -6 4 -3.23 4.62 20 -6 4 -0.94 4.32 0 8 4 2381.59 47.6 0 -8 4 2394.4 46.59 0 8 -4 2449.75 46.56 0 8 -4 2291.26 46.62 0 8 4 2422.32 46.63 0 -8 -4 2432.13 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5.27 18 -12 4 12.04 4.77 0 -14 -4 22.44 3.41 0 -14 4 27.04 3.37 1 14 4 59.63 4.14 1 -14 4 62.27 3.7 -1 14 4 81.92 5.35 -1 14 -4 91.35 5.33 1 -14 -4 47.41 3.96 1 -14 4 44.56 3.85 2 -14 -4 77.88 4.45 2 -14 4 74.95 4.49 2 14 4 77.7 4.66 2 -14 4 73.03 4.03 -2 14 4 113.17 6.16 -2 14 -4 103.41 5.65 2 -14 4 55.54 4.58 -3 14 4 261.53 9.32 3 -14 4 191.95 7.89 -3 14 -4 240.99 8.7 3 -14 -4 238.35 7.53 3 -14 4 225.36 7.61 3 14 4 228.93 7.73 3 -14 4 213.79 7.09 -3 14 -4 237.04 7.16 4 -14 4 48.77 4.28 4 14 4 52.22 4.15 4 -14 -4 51.85 3.63 4 -14 4 54.18 3.85 -4 14 4 31.24 5.01 -4 14 -4 30.36 4.43 4 -14 4 46.83 3.67 -4 14 -4 51.46 3.67 -5 14 -4 15.6 3.8 5 -14 4 23.45 3.2 5 -14 4 26.37 3.63 -5 14 4 12.7 4.04 5 14 4 27.24 3.67 6 -14 4 4.83 2.99 6 -14 4 3.06 3.1 6 14 4 8.35 3.2 7 -14 4 21.04 3.59 7 -14 4 21.37 3.64 7 14 4 23.07 3.5 8 14 4 60.22 4.35 8 -14 4 63.67 4.56 8 -14 4 51.99 4.27 9 -14 4 104.17 5.46 9 -14 4 105.3 5.61 9 14 4 95.76 5.17 10 -14 4 46.49 4.26 10 -14 4 42.2 4.48 10 14 4 44.82 4.18 11 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4 80.12 4.92 -5 16 4 49.7 5.96 5 -16 4 83.45 5.11 -5 16 -4 41.77 5.3 6 -16 4 6.41 3.4 6 -16 4 7.87 3.88 -6 16 4 -0.36 4.6 6 16 4 9.81 3.67 -6 16 -4 2 4.01 7 -16 4 55.8 5 7 16 4 64.42 4.93 7 -16 4 49.77 4.76 8 16 4 79.95 5.18 8 -16 4 76.16 5.51 8 -16 4 63.81 5.34 9 -16 4 16.56 4.23 9 -16 4 21.67 4.22 9 16 4 16.3 4.03 10 -16 4 0.09 4 10 -16 4 2.51 3.57 11 -16 4 2.69 4.3 11 -16 4 2.35 3.82 12 -16 4 64.28 5.42 12 -16 4 55.91 5.95 13 -16 4 13.32 5.05 13 -16 4 21.68 4.58 14 -16 4 -3.39 5.04 14 -16 4 1.21 4.13 15 -16 4 7.29 5.27 15 -16 4 3.83 4.35 16 -16 4 5.76 4.56 0 -18 -4 61.37 5.05 0 -18 4 61.2 4.81 1 -18 -4 25.18 4.34 1 -18 4 29.87 4.09 -1 18 4 42.14 4.86 -1 18 -4 44.23 4.65 1 18 4 11.86 3.44 1 -18 4 31.03 4.43 2 -18 4 3.09 3.78 2 -18 -4 1.73 3.68 2 -18 4 1.13 3.51 -2 18 4 12.98 4.23 -2 18 -4 11.68 3.97 2 18 4 -1.98 3.37 3 18 4 41.27 4.38 3 -18 4 37.56 4.9 3 -18 -4 36.63 4.51 3 -18 4 32.65 4.4 -3 18 4 65.48 5.58 -3 18 -4 61.54 5.15 4 -18 4 65.07 5.75 4 18 4 89.63 5.61 4 -18 -4 82.37 5.59 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79.03 5.16 14 1 5 83.54 5.14 15 -1 5 87.64 5.51 15 1 5 84.35 5.26 16 -1 5 25.51 4.33 16 1 5 21.77 4.18 17 -1 5 8.63 4.23 17 1 5 10.4 4.07 18 -1 5 37.56 4.99 18 1 5 40.89 4.73 19 -1 5 15.41 4.58 0 -3 5 1.17 1.62 0 3 5 -1.05 1.86 0 3 -5 0.5 1.58 -1 3 5 87.94 3.71 -1 3 -5 89.27 3.42 1 3 -5 88.67 3.33 -1 -3 -5 84.64 3.65 1 -3 5 77.47 3.48 -1 -3 5 89.16 3.42 1 3 5 84.06 3.89 -2 3 -5 97.36 3.66 -2 3 5 94.03 3.8 2 3 -5 93.35 3.43 -2 -3 -5 89.38 3.76 2 -3 5 92.99 3.79 -2 -3 5 89.13 3.38 2 3 5 86.57 3.93 -3 3 -5 140.73 4.62 -3 3 5 130.47 4.65 -3 -3 -5 137.59 4.82 3 3 -5 138.01 4.19 3 -3 5 135.94 4.76 -3 -3 5 141.89 4.27 3 3 5 134.33 5.02 -4 3 5 33.74 2.53 4 -3 5 33.54 1.93 -4 -3 -5 30.04 2.59 4 -3 5 33.19 2.73 -4 -3 5 31.93 2.12 4 3 5 28.17 2.85 -4 3 -5 30.2 2.52 -5 -3 -5 184.19 5.89 -5 3 5 183.51 5.71 5 -3 5 192.57 5.13 5 -3 5 196.01 6.19 5 3 5 185.07 6.13 -5 -3 5 189.5 5.13 -5 3 -5 189.53 5.79 -6 -3 -5 205.22 6.37 -6 3 5 208.27 6.15 6 -3 5 211.16 5.75 6 -3 5 217.66 6.73 6 3 5 215.38 6.81 -6 3 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3.32 -3 -5 5 57.85 2.71 -3 5 -5 61.3 3.06 3 5 5 59.32 3.5 4 -5 5 20.21 1.91 4 -5 5 20.51 2.52 -4 5 -5 21.01 2.37 4 5 5 19.89 2.76 -4 5 5 19.72 2.41 -4 -5 5 19.53 1.92 -4 -5 -5 16.3 2.33 5 -5 5 81.3 3.3 -5 5 5 81.06 3.85 -5 -5 -5 75.29 3.79 5 -5 5 83.61 3.96 -5 5 -5 82.21 3.7 5 5 5 80.49 4.18 6 -5 5 386.53 9.22 -6 -5 -5 370.57 9.62 -6 5 5 369.92 9.74 6 -5 5 380.34 9.94 6 5 5 369.76 10.03 -6 5 -5 377 9.57 -7 -5 -5 63.73 3.63 7 -5 5 69.39 3.3 -7 5 5 62.73 3.7 7 -5 5 67.94 3.92 7 5 5 60.73 3.8 -7 5 -5 61.9 3.59 8 -5 5 32.04 2.65 8 5 5 26.17 3.07 8 -5 5 32.16 3.33 9 -5 5 127.87 4.84 9 -5 5 127.97 5.42 9 5 5 117.06 5.21 10 -5 5 129.5 5.05 10 -5 5 118.22 5.48 10 5 5 114.66 5.38 11 -5 5 21.58 3.52 11 -5 5 16.44 2.84 11 5 5 17.68 3.43 12 -5 5 8.97 3.53 12 -5 5 5.59 2.77 12 5 5 4.36 3.14 13 -5 5 12.77 3.64 13 5 5 11.86 3.5 13 -5 5 16.91 3.19 14 -5 5 161.11 6.97 14 5 5 148.98 6.59 15 -5 5 57.8 4.98 15 5 5 51.96 4.62 16 -5 5 40.47 5.02 16 5 5 36.3 4.43 17 -5 5 13.56 4.55 18 -5 5 53.09 5.53 19 -5 5 17.63 4.85 0 -7 5 -2.16 1.83 0 -7 5 0.58 1.76 0 7 -5 0.96 1.63 0 7 5 1.11 2.1 1 -7 5 159.73 4.97 1 7 -5 161.39 4.82 1 7 5 158.13 5.72 -1 7 5 158.34 5.67 1 -7 5 165.69 5.2 -1 -7 5 172.82 5.05 -1 7 -5 166.11 5.01 2 -7 5 148.36 4.77 2 7 5 155.24 5.66 -2 7 5 155.52 5.57 2 -7 5 165.24 5.29 -2 -7 5 162.84 4.77 -2 7 -5 161.07 5.04 3 7 5 284.44 8.47 3 -7 5 288.59 7.46 -3 7 5 298.19 8.35 3 -7 5 295.81 7.98 -3 -7 5 297.2 7.21 -3 7 -5 296.3 7.7 4 -7 5 0.51 1.63 4 -7 5 -0.1 2.13 -4 7 -5 1.19 1.96 4 7 5 -1.73 2.45 -4 7 5 -2.4 2.34 5 -7 5 170.08 5.35 -5 7 5 169.34 6.11 5 -7 5 172.26 5.82 -5 7 -5 176.47 5.59 5 7 5 161.12 6.03 6 -7 5 154.55 5.13 -6 -7 -5 148.42 5.35 -6 7 5 156.3 5.97 6 -7 5 161.04 5.76 -6 7 -5 151.22 5.29 6 7 5 150.76 5.89 7 -7 5 285.31 7.79 7 -7 5 281.64 8.28 7 7 5 272.43 8.3 8 -7 5 26.15 2.72 8 -7 5 22.74 3.15 8 7 5 24.74 3.16 9 -7 5 48.36 3.37 9 -7 5 45.16 3.84 9 7 5 41.87 3.71 10 -7 5 66.75 4 10 -7 5 64.16 4.43 10 7 5 60.9 4.28 11 -7 5 54.64 3.9 11 -7 5 56.8 4.53 11 7 5 47.54 4.03 12 -7 5 -1.51 3.33 12 -7 5 0.63 2.83 12 7 5 -3.06 3.2 13 -7 5 23.84 4.02 13 -7 5 26.33 3.64 13 7 5 17.01 3.7 14 -7 5 12.03 4.09 14 -7 5 11.8 3.47 14 7 5 8.87 3.67 15 -7 5 109.98 5.91 15 -7 5 99.78 6.13 15 7 5 100.45 5.73 16 -7 5 5.11 4.37 17 -7 5 6.4 4.55 18 -7 5 25.83 5.18 0 -9 5 0.47 1.83 0 9 5 1.71 2.42 1 -9 5 17.96 2.55 -1 9 -5 19.73 2.23 1 -9 5 21.81 2.42 -1 -9 5 21.86 2.18 1 9 5 22.25 2.89 -1 9 5 21.33 2.96 2 -9 5 429.82 10.38 2 9 5 406.27 10.84 -2 9 5 400.14 10.86 2 -9 5 413.93 10.24 -2 9 -5 423.41 10.04 3 -9 5 77.08 3.68 3 9 5 78.6 4.26 -3 9 5 78.25 4.28 3 -9 5 80.42 3.85 -3 9 -5 81.29 3.67 4 -9 5 0.84 1.93 4 -9 5 0.82 2.21 -4 9 -5 -0.27 2.02 4 9 5 1.58 2.6 -4 9 5 1.15 2.65 5 -9 5 7.91 2.6 5 -9 5 6.94 2.16 -5 9 -5 6.37 2.33 5 9 5 4.62 2.73 6 -9 5 405.75 10.32 6 -9 5 425.15 10.85 6 9 5 403.11 11.06 7 -9 5 48.42 3.32 7 -9 5 47.76 3.72 7 9 5 46.93 3.82 8 -9 5 2.14 2.88 8 -9 5 -1.66 2.32 8 9 5 0.66 2.91 9 -9 5 26.98 3.57 9 -9 5 24.39 3.07 9 9 5 24.46 3.38 10 -9 5 91.76 4.72 10 -9 5 98.2 5.38 10 9 5 94.82 4.85 11 -9 5 11.06 3.62 11 -9 5 15.09 3.15 11 9 5 15.59 3.55 12 -9 5 -0.16 3.43 12 -9 5 -1.69 3.02 12 9 5 1.74 3.16 13 -9 5 0.49 3.72 13 -9 5 -0.55 3.19 13 9 5 -2.41 3.57 14 -9 5 88.56 5.37 14 -9 5 86.12 5.99 14 9 5 81.76 5.27 15 -9 5 13.05 4.47 15 -9 5 10.69 3.84 16 -9 5 10 4.72 16 -9 5 11.93 4.2 17 -9 5 5.44 4.67 17 -9 5 12.76 4.33 18 -9 5 29.38 5.46 0 -11 5 -0.87 2 0 11 5 -0.81 2.69 1 11 5 48.58 3.78 -1 11 5 49.93 3.82 1 -11 5 47.45 3.2 1 -11 5 44.38 3.56 2 -11 5 8.63 2.68 2 -11 5 10.62 2.47 -2 11 -5 11.03 2.25 2 11 5 9.3 2.92 -2 11 5 8.69 2.83 3 -11 5 108.31 4.78 3 11 5 99.53 5.08 -3 11 5 102.47 5.21 3 -11 5 103.61 4.69 -3 11 -5 108.07 4.32 4 -11 5 23.1 2.93 4 -11 5 20.4 2.93 -4 11 -5 22.56 2.67 4 11 5 27.2 3.45 5 11 5 102.45 5.01 5 -11 5 96.6 4.6 5 -11 5 92.67 4.56 6 -11 5 20.84 3.2 6 -11 5 19.73 2.99 6 11 5 27.06 3.51 7 -11 5 107.72 4.88 7 -11 5 109.8 5.32 7 11 5 108.15 5.41 8 -11 5 0.2 2.98 8 -11 5 0.83 2.6 8 11 5 1.82 3.04 9 -11 5 60.4 4.15 9 -11 5 58.08 4.47 9 11 5 62.56 4.42 10 -11 5 25.96 3.97 10 -11 5 23.02 3.36 10 11 5 19.61 3.56 11 -11 5 64.77 4.47 11 -11 5 61.1 4.95 11 11 5 66.22 4.56 12 -11 5 2.99 3.83 12 -11 5 4.97 3.26 12 11 5 6.61 3.42 13 -11 5 20.21 4.6 13 -11 5 25.34 3.86 13 11 5 24.6 4.07 14 -11 5 1.26 4.35 14 -11 5 5.45 3.64 15 -11 5 104.75 6.22 15 -11 5 91.54 6.49 16 -11 5 -1.94 4.69 16 -11 5 0.1 4 17 -11 5 7.53 5.02 17 -11 5 9.79 4.37 18 -11 5 25.74 4.88 0 13 5 0.67 3.02 1 -13 5 -0.47 3.26 1 13 5 3.84 3.1 -1 13 5 2.55 3.05 2 -13 5 82.36 5 2 13 5 91.67 5.09 -2 13 5 88.24 5.08 2 -13 5 82.99 4.3 3 -13 5 8.3 2.81 3 -13 5 8.91 3.1 3 13 5 6.82 3.24 4 -13 5 6.45 2.85 4 -13 5 10.66 3.14 4 13 5 8.79 3.26 5 -13 5 15.09 3.23 5 -13 5 12.63 3.23 5 13 5 15.84 3.47 6 13 5 162.69 6.75 6 -13 5 175.17 6.67 6 -13 5 147.79 6.19 7 -13 5 0.48 3.07 7 -13 5 1.8 2.96 7 13 5 -2.6 3.59 8 -13 5 1.95 3.45 8 -13 5 4.15 3.07 8 13 5 3.43 3.34 9 -13 5 44.97 4.15 9 -13 5 40.42 4.34 9 13 5 46.93 4.45 10 -13 5 113.45 5.65 10 -13 5 103.68 5.96 10 13 5 101.54 5.67 11 -13 5 -1.09 3.93 11 -13 5 -0.8 3.12 11 13 5 -1.45 3.5 12 -13 5 6.2 4.35 12 -13 5 14.29 3.75 12 13 5 14.29 3.82 13 -13 5 -3.66 4.55 13 -13 5 4.44 3.78 14 -13 5 91.99 5.88 14 -13 5 86.37 6.34 15 -13 5 3.12 4.59 15 -13 5 2.57 3.93 16 -13 5 7.88 4.98 16 -13 5 12.17 4.59 17 -13 5 9.61 4.64 0 15 5 1.52 3.18 1 15 5 86.16 5.07 -1 15 5 72.98 4.91 1 -15 5 64.68 5.02 2 -15 5 4.06 3.39 2 15 5 5.72 3.32 -2 15 5 1.85 3.52 3 -15 5 119.48 6.44 3 15 5 134.75 6.28 3 -15 5 133.12 5.57 4 -15 5 1.99 3.04 4 -15 5 2.88 3.42 4 15 5 4.96 3.39 5 -15 5 85.33 5.54 5 15 5 90.62 5.38 5 -15 5 74.18 4.65 6 -15 5 11.05 3.61 6 -15 5 12.49 3.85 6 15 5 17.3 3.63 7 15 5 88.87 5.73 7 -15 5 90.72 5.68 7 -15 5 87.6 5.33 8 -15 5 25.04 4.18 8 -15 5 27.98 4.15 8 15 5 22.78 4.37 9 -15 5 47 4.65 9 -15 5 39.43 4.6 9 15 5 41.86 4.77 10 -15 5 4.72 3.93 10 -15 5 11.42 3.79 10 15 5 6.39 3.97 11 -15 5 53.3 4.87 11 -15 5 43.66 5.05 12 -15 5 1.18 4.29 12 -15 5 1.39 3.86 13 -15 5 8.91 4.54 13 -15 5 6.64 4.05 14 -15 5 2.18 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36.54 2.93 3 0 6 2.34 2.38 -3 0 6 1.64 2.04 -3 0 -6 0.34 2.16 -4 0 -6 1367.57 28.17 4 0 6 1349.67 28.61 -4 0 6 1343.02 27.86 5 0 6 0.06 2.6 -5 0 6 0.26 2.13 6 0 6 0.43 2.72 7 0 6 -0.84 2.95 8 0 6 142.64 5.93 9 0 6 -0.77 3.15 10 0 6 17.1 3.62 11 0 6 -0.75 3.31 12 0 6 124.68 6.07 13 0 6 0.4 3.73 14 0 6 91.07 5.87 15 0 6 2.46 4.25 16 0 6 105.25 6.28 17 0 6 0.79 4.29 18 0 6 8.8 4.54 0 -2 6 6.05 2.14 0 2 6 10.17 2.58 0 2 -6 6.18 2.11 -1 2 -6 61.01 3.18 1 2 -6 60.81 3.15 -1 -2 -6 51.72 3.24 1 -2 6 56.93 3.35 -1 -2 6 51.68 3.2 1 2 6 54.42 3.55 -1 2 6 58.2 3.46 2 -2 6 14.68 2.55 -2 -2 6 15.36 2.35 2 2 6 13.13 2.68 -2 2 6 16.74 2.56 -2 2 -6 15.88 2.39 -2 -2 -6 18.31 2.49 2 2 -6 15.56 2.14 -3 2 6 144.94 5.21 -3 2 -6 139.92 5.02 -3 -2 -6 148.95 5.26 3 -2 6 136.6 5.18 -3 -2 6 144.4 4.84 3 2 6 144.82 5.54 4 -2 6 12.74 2.69 4 2 6 11.18 2.8 -4 -2 6 11.87 2.16 -4 2 6 11.59 2.43 -4 2 -6 12.74 2.43 -5 2 6 720.8 16.37 5 -2 6 739.45 16.97 5 2 6 755.03 17.26 6 -2 6 2.2 2.71 6 2 6 2.57 2.64 -6 2 6 3.75 2.14 7 -2 6 250.69 7.96 7 2 6 241.52 7.94 8 -2 6 1.28 2.89 8 2 6 -1.49 3.03 9 -2 6 0.42 3.01 9 2 6 3.73 3.18 10 -2 6 9.38 3.37 10 2 6 8.6 3.34 11 -2 6 15.85 3.71 11 2 6 21.03 3.79 12 -2 6 6.03 3.74 12 2 6 5.44 3.64 13 -2 6 315.95 10.13 13 2 6 308.84 9.91 14 -2 6 0.66 3.96 14 2 6 -0.08 3.81 15 -2 6 31.84 4.79 15 2 6 28.88 4.58 16 -2 6 3.06 4.3 16 2 6 2.91 4.11 17 -2 6 35.66 5.1 17 2 6 27.35 4.87 18 -2 6 -1.68 4.55 18 2 6 2.46 4.46 0 -4 6 1.46 2.16 0 4 6 3.8 2.49 0 4 -6 3.92 2 1 -4 6 1.2 2.14 -1 -4 6 0.78 2.08 1 4 6 0.06 2.48 -1 4 6 -1.2 2.38 -1 4 -6 1.64 2.05 1 4 -6 0.33 1.94 -2 4 6 50.76 3.43 -2 4 -6 53.03 3.1 2 -4 6 52.52 3.41 -2 -4 6 48.27 3.04 2 4 6 45.74 3.61 -3 4 -6 29.45 2.72 -3 4 6 27.79 2.97 3 4 6 26.38 3.19 3 -4 6 28.57 2.99 -3 -4 6 28.62 2.54 -4 4 -6 713.04 16.04 -4 4 6 685.09 16.16 4 -4 6 741.29 16.49 4 4 6 722.56 16.84 5 -4 6 8.86 2.82 5 4 6 11.21 2.91 -5 4 6 10.38 2.53 6 -4 6 2.43 2.69 6 4 6 2.74 2.8 -6 4 6 2.5 2.37 7 -4 6 5.54 2.98 7 4 6 7.05 3.16 -7 4 6 5.64 2.48 8 -4 6 123.17 5.57 8 4 6 126.34 5.67 9 -4 6 3.13 3.11 9 4 6 0.28 3.23 10 -4 6 2.71 3.2 10 4 6 2.78 3.39 11 -4 6 18.68 4.03 11 4 6 15.12 3.76 12 -4 6 175.62 7.19 12 4 6 158.27 6.95 13 -4 6 10.26 4.02 13 4 6 12.1 4.1 14 -4 6 84.17 5.75 14 4 6 77.85 5.55 15 -4 6 3.41 4.33 15 4 6 -0.08 3.96 16 -4 6 162.29 7.78 16 4 6 153.24 7.24 17 -4 6 -1.12 4.51 17 4 6 6.98 4.42 0 -6 6 4.41 2.29 0 6 6 6.48 2.63 1 6 6 64.27 4.17 -1 6 -6 73.36 3.45 -1 6 6 61.81 3.92 1 -6 6 71.87 3.8 -1 -6 6 74.15 3.61 2 -6 6 16.67 2.69 2 6 6 13.65 3.07 -2 6 -6 16.63 2.44 -2 6 6 18.23 2.85 -3 6 -6 106.11 4.31 -3 6 6 98.99 4.76 3 -6 6 107.5 4.72 3 6 6 104.97 5.08 4 -6 6 21.26 2.99 4 6 6 18.68 3.3 -4 6 6 23.07 2.93 -5 6 6 448.5 11.67 5 -6 6 453.52 11.61 5 6 6 457.27 12.19 -6 6 6 60.99 3.98 6 -6 6 62.76 4.14 6 6 6 56.92 4.25 -7 6 6 257.59 8.04 7 -6 6 258.27 8.2 7 6 6 254.27 8.27 8 -6 6 2.72 3.08 8 6 6 -1.22 3.18 -8 6 6 1.09 2.92 9 -6 6 3.47 3.13 9 6 6 4.91 3.27 10 -6 6 1.32 3.22 10 6 6 1.18 3.24 11 -6 6 18.8 3.96 11 6 6 12.41 3.72 12 -6 6 37.1 4.46 12 6 6 29.66 4.21 13 -6 6 217.85 8.25 13 6 6 191.04 7.74 14 -6 6 8.87 4.27 14 6 6 5.65 3.9 15 -6 6 33.57 5 15 6 6 35.32 4.74 16 -6 6 0.19 4.63 16 6 6 1.25 4.11 17 -6 6 34.69 5.38 0 8 6 99.62 4.85 0 -8 6 107.9 4.51 1 -8 6 5.69 2.4 1 8 6 8.68 3 -1 8 6 4.2 2.7 2 8 6 40.6 3.72 -2 8 6 33.25 3.43 2 -8 6 36.21 3.32 -2 8 -6 38.61 2.93 3 8 6 74.39 4.62 -3 8 6 73.61 4.4 3 -8 6 83.98 4.31 -3 8 -6 83.96 3.9 -4 8 6 628.48 15.39 4 -8 6 637.73 14.92 4 8 6 603.41 15.34 5 8 6 34.07 3.75 5 -8 6 35.38 3.53 -5 8 6 33.22 3.73 6 -8 6 4.84 3.06 6 8 6 4.67 3.15 -6 8 6 5.27 3.27 7 -8 6 12.19 3.17 7 8 6 7.95 3.37 -7 8 6 9.12 3.72 -8 8 6 149.37 6.71 8 -8 6 129.9 5.92 8 8 6 123.03 5.83 9 -8 6 13.03 3.57 9 8 6 14.5 3.59 -9 8 6 10.07 4.12 10 -8 6 1.99 3.52 10 8 6 3.58 3.39 11 -8 6 27.63 4.34 11 8 6 29.34 4.18 12 -8 6 52.88 5.01 12 8 6 54.05 4.8 13 -8 6 13.61 4.41 13 8 6 10.69 4.07 14 -8 6 25.34 4.85 14 8 6 24.93 4.48 15 -8 6 4.07 4.72 15 8 6 -0.5 4.09 16 -8 6 78.05 6.35 0 10 6 57.88 4.21 1 10 6 80.63 4.74 -1 10 6 78.93 4.61 1 -10 6 82.27 4.14 2 10 6 42.56 3.91 -2 10 6 37.34 3.99 2 -10 6 40.49 3.37 3 10 6 40.91 3.94 -3 10 6 38.66 4.07 3 -10 6 35.59 3.42 4 10 6 51.52 4.34 -4 10 6 61.37 4.71 4 -10 6 55.43 3.94 -5 10 6 262.04 8.95 5 -10 6 239.16 7.75 5 10 6 228.36 8.11 6 -10 6 7.94 3.28 6 10 6 8.49 3.54 -6 10 6 6.11 3.97 -7 10 6 165.36 7.76 7 -10 6 137.45 6.11 7 10 6 129.01 6.1 8 -10 6 7.87 3.32 8 10 6 10.66 3.62 -8 10 6 8.77 4.89 9 -10 6 16.21 3.78 9 10 6 20.92 3.9 10 -10 6 1.68 3.8 10 10 6 3.14 3.58 11 -10 6 4.97 3.98 11 10 6 4.2 3.65 12 -10 6 36.61 4.91 12 10 6 43.39 4.53 13 -10 6 107.83 6.53 13 10 6 94.24 5.86 14 -10 6 -0.74 4.52 14 10 6 -0.08 3.95 15 -10 6 22.99 5.19 0 12 6 25.04 3.82 1 12 6 2.24 3.03 -1 12 6 3.46 3.29 2 12 6 32.8 3.94 -2 12 6 31.13 4 3 12 6 49.35 4.3 -3 12 6 55.8 4.78 3 -12 6 45.77 3.72 4 12 6 160.32 6.84 -4 12 6 179.57 7.56 4 -12 6 159.85 6.35 5 -12 6 15.54 3.46 5 12 6 22.83 4.01 -5 12 6 14.67 4.45 6 -12 6 1.63 3.35 6 12 6 -0.41 3.58 -6 12 6 -0.33 4.67 7 -12 6 0.14 3.34 7 12 6 3.13 3.68 -7 12 6 2.43 5.13 8 -12 6 82.08 5.32 8 12 6 93.45 5.66 9 -12 6 21.49 4.28 9 12 6 21.91 4.29 10 -12 6 0.91 3.91 10 12 6 3.15 3.87 11 -12 6 30 4.74 11 12 6 33.44 4.52 12 -12 6 48.91 5.31 12 12 6 45.69 4.94 13 -12 6 21 4.92 13 12 6 20.25 4.4 14 -12 6 9.2 4.91 0 14 6 38.04 4.36 1 14 6 45.83 4.5 -1 14 6 52.33 4.78 2 14 6 8.39 3.67 -2 14 6 5.83 3.71 3 14 6 28.78 3.98 -3 14 6 22.74 4.59 4 -14 6 22.7 3.59 4 14 6 28.61 4.12 -4 14 6 23.03 4.84 5 14 6 69.52 5.21 -5 14 6 65.68 6.31 5 -14 6 54.89 4.52 6 -14 6 27.69 3.98 6 14 6 24.68 4.44 -6 14 6 27.79 5.75 7 -14 6 99.51 5.8 7 14 6 101.27 6.04 8 -14 6 11.86 3.91 8 14 6 12.18 4.27 9 -14 6 7.98 4.1 9 14 6 14.99 4.44 10 -14 6 3.34 4.17 10 14 6 3.45 4.29 11 -14 6 0.63 4.37 11 14 6 5.04 4.33 12 -14 6 28.74 5.26 12 14 6 40.91 5.05 13 -14 6 36.5 5.7 0 16 6 67.56 5.34 1 16 6 21.41 4.12 -1 16 6 18.41 4.34 2 16 6 12.55 3.92 -2 16 6 4.2 4.09 3 16 6 42.59 4.75 -3 16 6 33.32 4.96 4 16 6 96.29 5.99 -4 16 6 86.97 6.65 5 16 6 26.56 4.5 -5 16 6 13.75 5.64 6 -16 6 2.54 3.74 6 16 6 2.05 4.37 7 -16 6 -1.25 3.75 7 16 6 -4.86 4.68 8 -16 6 48.23 5.14 8 16 6 50.56 5.66 9 -16 6 25.6 4.75 9 16 6 30.38 5.13 10 -16 6 1.42 4.35 10 16 6 -1.82 4.72 11 -16 6 11.36 4.7 12 -16 6 11.05 4.96 0 18 6 55.47 5.18 1 18 6 24.96 4.42 -1 18 6 15.65 4.35 2 18 6 9.39 4.01 -2 18 6 -2.13 4.32 3 18 6 16.9 4.29 -3 18 6 -1.18 4.48 4 18 6 34.22 4.83 -4 18 6 14.22 5.02 5 18 6 37.56 4.99 -5 18 6 13.01 5.44 6 18 6 18.55 4.8 7 18 6 23.56 5.51 8 -18 6 21.65 4.78 8 18 6 16.09 5.41 9 -18 6 13.57 4.95 9 18 6 13.32 5.33 10 -18 6 -0.67 4.73 11 -18 6 0.5 4.87 0 20 6 10.44 4.17 1 20 6 9.36 4.15 -1 20 6 4.03 4.03 2 20 6 12.84 4.24 -2 20 6 -3.7 4.31 3 20 6 14.31 4.29 -3 20 6 -0.76 4.46 4 20 6 26.61 4.9 -4 20 6 -1.02 5.02 5 20 6 17.79 4.74 6 20 6 16.41 4.94 7 20 6 -4.36 5.73 8 20 6 10.61 5.89 0 22 6 7.66 3.95 1 22 6 4.9 3.84 -1 22 6 -2.64 4.08 2 22 6 1.34 4 3 22 6 8.82 4.25 4 22 6 12.6 4.64 5 22 6 10.27 4.86 0 -1 7 0.34 2.61 0 1 7 2.21 2.7 1 -1 7 95.78 4.6 -1 -1 7 95.41 4.46 1 1 7 91.58 4.78 -1 1 7 93.01 4.54 2 -1 7 227.52 7.35 2 1 7 220.25 7.45 -2 -1 7 226.7 7.03 -2 1 7 233.31 7.26 3 -1 7 56.52 3.99 3 1 7 63.14 4.27 -3 -1 7 63.3 3.74 -3 1 7 63.39 3.94 4 -1 7 0.26 2.89 4 1 7 0.81 3.01 -4 1 7 -0.27 2.57 5 -1 7 31.68 3.75 5 1 7 33.5 3.89 6 -1 7 71.06 4.54 6 1 7 65.42 4.58 7 -1 7 32.93 3.82 7 1 7 32.08 3.94 8 -1 7 1.88 3.29 8 1 7 0.92 3.47 9 -1 7 15.39 4.1 9 1 7 23.4 4.06 10 -1 7 126.74 6.41 10 1 7 130.45 6.47 11 -1 7 99.43 5.92 11 1 7 96.83 5.93 12 -1 7 11.2 4.22 12 1 7 14.48 4.4 13 -1 7 21.62 4.61 13 1 7 19.26 4.54 14 -1 7 33.68 5.15 14 1 7 35.74 5.06 15 -1 7 10.2 4.8 15 1 7 5.51 4.7 16 1 7 1.22 4.75 0 -3 7 -1.07 2.45 0 3 7 -2.33 2.94 1 -3 7 116.44 4.94 -1 -3 7 110.79 4.69 1 3 7 113.07 5.37 -1 3 7 112.33 5.19 2 -3 7 91.63 4.61 2 3 7 101.14 5.06 -2 3 7 91.4 4.74 3 -3 7 65 4.31 3 3 7 75.98 4.72 -3 3 7 73.33 4.26 4 -3 7 -0.31 2.88 4 3 7 1.21 3.11 -4 3 7 1.28 2.63 -5 3 7 36.67 3.39 5 -3 7 40.34 3.77 5 3 7 35.43 3.92 6 3 7 35.73 3.99 6 -3 7 37.08 3.87 7 3 7 36.92 4.08 7 -3 7 36.51 4.01 8 -3 7 14.43 3.74 8 3 7 4.84 3.69 9 3 7 35.35 4.43 9 -3 7 41.39 4.42 10 -3 7 84.1 5.43 10 3 7 73.27 5.3 11 -3 7 127.76 6.55 11 3 7 127.15 6.63 12 -3 7 9.87 4.3 12 3 7 5.76 4.1 13 -3 7 14.53 4.58 13 3 7 22.75 4.81 14 3 7 39.93 5.07 14 -3 7 47.37 5.44 15 -3 7 11.56 4.71 15 3 7 14.73 4.71 16 3 7 0.92 4.58 0 -5 7 -0.59 2.66 0 5 7 -0.41 2.99 -1 5 7 50.3 4.04 1 -5 7 56.48 3.88 1 5 7 58.87 4.41 -2 5 7 154.77 6.21 2 -5 7 163.5 6.04 2 5 7 171.14 6.68 3 -5 7 23.21 3.33 3 5 7 25.13 3.73 -3 5 7 24.52 3.37 4 -5 7 2.26 3.03 4 5 7 -0.83 3.36 -4 5 7 -0.13 2.87 -5 5 7 31.85 3.57 5 -5 7 34.74 3.68 5 5 7 38.06 4.06 -6 5 7 56.05 3.99 6 -5 7 62.38 4.42 6 5 7 60.94 4.74 7 -5 7 21.98 3.78 7 5 7 21.95 3.99 8 -5 7 8.11 3.57 8 5 7 7.97 3.78 9 -5 7 9.42 3.76 9 5 7 7.14 3.9 10 -5 7 167.68 7.12 10 5 7 151.78 7.02 11 -5 7 46.2 4.99 11 5 7 43.91 4.93 12 -5 7 19.31 4.48 12 5 7 16.4 4.48 13 -5 7 24.4 4.84 13 5 7 33.23 4.81 14 -5 7 46.77 5.35 14 5 7 44.04 5.23 15 -5 7 8.98 4.92 15 5 7 5.14 4.49 0 7 7 -0.44 3.2 -1 7 7 123.39 5.82 1 -7 7 137.3 5.38 1 7 7 122.76 5.85 -2 7 7 77.48 4.79 2 -7 7 87.11 4.52 2 7 7 77.69 4.94 -3 7 7 87.64 5 3 -7 7 94.05 4.78 3 7 7 88.21 5.25 4 -7 7 9.3 3.1 4 7 7 6.68 3.5 -4 7 7 8.09 3.17 -5 7 7 39.33 4.02 5 -7 7 42.75 4.19 5 7 7 43.46 4.53 -6 7 7 32.3 3.95 6 7 7 25.92 4.25 6 -7 7 36.44 4.07 -7 7 7 54.14 4.48 7 -7 7 56.28 4.61 7 7 7 56.45 4.76 8 -7 7 4.93 3.65 8 7 7 3.22 3.81 9 7 7 35.69 4.74 9 -7 7 38.63 4.55 10 -7 7 26.6 4.35 10 7 7 29.97 4.49 11 -7 7 110.03 6.21 11 7 7 107.59 6.24 12 -7 7 6.29 4.42 12 7 7 1.3 4.11 13 -7 7 14.32 4.73 13 7 7 14.21 4.64 14 -7 7 29.13 5.21 14 7 7 24.95 4.75 15 7 7 16.89 4.9 0 9 7 2.52 3.31 1 9 7 24.09 3.85 -1 9 7 22.22 3.69 2 9 7 195.92 7.53 -2 9 7 192.05 7.25 3 -9 7 12.07 3.3 3 9 7 10.64 3.75 -3 9 7 12.05 3.6 4 -9 7 1.3 3.16 4 9 7 1.3 3.51 -4 9 7 2.45 3.48 5 -9 7 15.29 3.56 5 9 7 12.11 3.76 -5 9 7 15.64 4.01 -6 9 7 82.54 5.54 6 -9 7 85.37 5.07 6 9 7 82.5 5.46 7 -9 7 17.01 3.86 7 9 7 18.24 4.13 -7 9 7 21.28 4.51 8 -9 7 0.76 3.66 8 9 7 0.6 3.84 -8 9 7 2.57 4.29 9 -9 7 3.59 3.96 9 9 7 0.69 3.87 10 -9 7 111.93 6.36 10 9 7 108.11 6.34 11 -9 7 16.42 4.58 11 9 7 24.02 4.58 12 -9 7 3.05 4.53 12 9 7 2.19 4.18 13 -9 7 20.29 5.1 13 9 7 16.39 4.6 14 9 7 28.25 4.93 15 9 7 0.09 4.58 0 11 7 4.03 3.46 1 11 7 70.9 5.11 -1 11 7 78.12 5.31 2 11 7 9.37 3.72 -2 11 7 12.73 3.93 3 11 7 43.77 4.65 -3 11 7 51.7 4.87 4 -11 7 -1.77 3.39 4 11 7 -0.17 3.75 -4 11 7 2.85 3.95 5 -11 7 29.05 4.09 5 11 7 27.78 4.48 -5 11 7 37.46 5.29 6 -11 7 7.12 3.68 6 11 7 5.81 4.02 -6 11 7 6.46 4.73 -7 11 7 58.22 6.32 7 11 7 45.51 4.99 7 -11 7 54.02 4.93 8 -11 7 13.09 4.2 8 11 7 10.84 4.12 -8 11 7 11.11 5.46 9 -11 7 25.06 4.6 9 11 7 26.24 4.66 -9 11 7 30.39 6.26 10 -11 7 6.61 4.52 10 11 7 12.9 4.35 11 -11 7 68.09 5.78 11 11 7 69.58 5.65 12 -11 7 -1.38 4.6 12 11 7 4.86 4.31 13 -11 7 16.39 5.08 13 11 7 14.72 4.7 14 11 7 13.57 4.9 0 13 7 2.97 3.86 1 13 7 10.58 3.92 -1 13 7 10.71 4.06 2 13 7 84.83 5.62 -2 13 7 97.09 6.18 3 13 7 -1.34 3.84 -3 13 7 1.29 4.31 4 13 7 -1 3.99 -4 13 7 -1.4 4.53 5 13 7 6.24 4.25 -5 13 7 6.46 5.27 -6 13 7 71.59 7.17 6 -13 7 54.92 4.8 6 13 7 56.66 5.46 7 -13 7 1.02 3.85 7 13 7 5.87 4.51 -7 13 7 1.49 5.97 8 -13 7 11.06 4.32 8 13 7 10.26 4.66 -8 13 7 6.36 6.79 9 -13 7 0.26 4.28 9 13 7 2.21 4.51 -9 13 7 -6.07 7.17 10 -13 7 76.95 6.03 10 13 7 78.08 6.16 11 -13 7 0.09 4.56 11 13 7 6.84 4.69 12 -13 7 -0.57 4.71 12 13 7 8.94 4.74 13 13 7 20.09 5.03 0 15 7 -0.96 4 1 15 7 56.02 5.27 -1 15 7 60.21 5.61 2 15 7 12.19 4.31 -2 15 7 6.34 4.73 3 15 7 41.48 5.05 -3 15 7 36.38 5.53 4 15 7 3.57 4.4 -4 15 7 8.78 5.53 5 15 7 29.75 5.1 -5 15 7 34.36 6.53 6 15 7 0.2 4.64 -6 15 7 -1.01 6.32 7 15 7 42.16 5.61 -7 15 7 48.79 8.17 8 -15 7 -0.09 4.37 8 15 7 -2.18 4.8 -8 15 7 -1.85 7.55 9 -15 7 11.41 4.67 9 15 7 18.95 5.33 -9 15 7 21.2 8.09 10 -15 7 1.11 4.62 10 15 7 4.92 5.05 -10 15 7 -8.17 7.9 11 15 7 39.39 5.64 0 17 7 5.1 4.33 1 17 7 11.77 4.54 -1 17 7 3.58 4.3 2 17 7 83.8 5.96 -2 17 7 74.03 6.55 3 17 7 14.27 4.47 -3 17 7 4.55 5.18 4 17 7 17.95 4.54 -4 17 7 -0.26 5.55 5 17 7 -0.95 4.88 -5 17 7 0.28 6.17 6 17 7 40.96 5.93 -6 17 7 43.84 7.59 7 17 7 -4.52 5.11 -7 17 7 -6.33 7.51 8 17 7 2.04 5.3 -8 17 7 -0.17 7.63 9 17 7 -1.27 5.31 -9 17 7 -5.33 8.2 0 19 7 12.29 4.51 1 19 7 29.64 4.86 -1 19 7 23.38 4.87 2 19 7 12.69 4.61 -2 19 7 8.96 4.94 3 19 7 31.04 4.9 -3 19 7 17.92 5.72 4 19 7 17.35 4.7 0 0 8 517.26 13.25 1 0 8 -0.07 3.12 -1 0 8 0.89 3.08 2 0 8 9.25 3.4 3 0 8 0.07 3.37 4 0 8 38.19 4.36 5 0 8 -2.29 3.61 6 0 8 -0.08 3.7 7 0 8 -1.79 3.95 8 0 8 205.41 8.13 9 0 8 2.96 4.26 10 0 8 20.39 4.71 11 0 8 -0.36 4.32 12 0 8 82.08 6.18 0 -2 8 0.87 3.14 0 2 8 5.62 3.41 1 -2 8 159.53 6.24 1 2 8 154.75 6.42 -1 2 8 158.44 6.46 2 -2 8 2.13 3.15 2 2 8 1.47 3.29 -2 2 8 0.66 3.15 3 -2 8 74.55 4.8 3 2 8 86.4 5.25 4 -2 8 2.07 3.4 4 2 8 1.25 3.56 5 -2 8 7.89 3.66 5 2 8 9.14 3.78 6 -2 8 0.46 3.6 6 2 8 1.88 3.91 7 -2 8 19.82 4.29 7 2 8 18.06 4.35 8 -2 8 4.37 4.08 8 2 8 0.43 4.12 9 -2 8 228.89 8.66 9 2 8 228.72 8.84 10 -2 8 3.53 4.13 10 2 8 -0.27 4.3 11 -2 8 52.24 5.51 11 2 8 62.3 5.83 12 -2 8 0.55 4.49 12 2 8 -0.76 4.62 0 4 8 360.85 10.61 1 -4 8 5.67 3.31 1 4 8 5.32 3.67 -1 4 8 6.54 3.46 2 -4 8 8.41 3.3 2 4 8 7.13 3.69 -2 4 8 5.65 3.5 3 -4 8 -2.1 3.35 3 4 8 1.43 3.61 -3 4 8 -1.99 3.19 4 4 8 34.3 4.41 4 -4 8 34.75 4.08 5 -4 8 -0.15 3.39 5 4 8 5.35 3.87 6 -4 8 7.38 3.77 6 4 8 8.55 3.93 7 -4 8 8.49 3.85 7 4 8 11.15 4.28 8 -4 8 170.78 7.31 8 4 8 163.64 7.59 9 -4 8 7.45 4.22 9 4 8 5.3 4.45 10 -4 8 18.84 4.56 10 4 8 19.83 4.81 11 -4 8 3.48 4.37 11 4 8 1.86 4.56 12 -4 8 85.63 6.32 12 4 8 87.96 6.45 0 6 8 0.39 3.58 1 6 8 102.74 5.75 -1 6 8 102.72 5.64 2 6 8 12.63 4.04 -2 6 8 9.39 3.68 -3 6 8 73.9 5.02 3 -6 8 78.39 4.88 3 6 8 77.95 5.54 4 -6 8 4.58 3.46 4 6 8 3.05 3.89 -4 6 8 1.75 3.34 5 -6 8 13.83 3.74 5 6 8 18.81 4.26 6 -6 8 2.68 3.65 6 6 8 3.08 4 7 -6 8 18.85 4.19 7 6 8 15.47 4.33 8 -6 8 12.45 4.28 8 6 8 17.18 4.64 9 -6 8 146.37 7 9 6 8 151.95 7.45 10 -6 8 6.1 4.42 10 6 8 1.29 4.51 11 -6 8 46.84 5.4 11 6 8 48.63 5.51 12 -6 8 4.09 4.54 12 6 8 4.36 4.82 0 8 8 249.69 8.9 1 8 8 13.88 4.08 -1 8 8 15.66 3.99 2 8 8 5.87 3.88 -2 8 8 8.26 3.85 3 8 8 -0.61 3.93 -3 8 8 0.48 3.74 -4 8 8 45.33 4.75 4 8 8 45.29 4.81 4 -8 8 49.71 4.55 5 -8 8 7.72 3.84 5 8 8 8.31 4.33 -5 8 8 7.37 3.88 6 -8 8 2.34 3.84 6 8 8 1.81 4.1 7 -8 8 24 4.39 7 8 8 21.98 4.62 8 -8 8 111.2 6.25 8 8 8 107.18 6.55 9 -8 8 6.62 4.2 9 8 8 11.32 4.69 10 -8 8 5.09 4.41 10 8 8 3.86 4.68 11 -8 8 4.85 4.47 11 8 8 1.71 4.68 0 10 8 21.8 4.44 1 10 8 50.16 5.08 -1 10 8 53.17 5.24 2 10 8 10.28 4.23 -2 10 8 9.5 4.15 -3 10 8 52.24 5.05 3 10 8 43.74 5.07 4 10 8 15.22 4.38 -4 10 8 19.79 4.56 5 10 8 21.64 4.78 -5 10 8 29.74 4.88 6 -10 8 6.73 4.05 6 10 8 5 4.38 -6 10 8 3.09 4.57 7 -10 8 7.32 4.17 7 10 8 5.87 4.54 8 -10 8 18.81 4.47 8 10 8 21.75 4.89 9 -10 8 81.08 5.94 9 10 8 81.1 6.22 10 -10 8 4 4.48 10 10 8 6.87 4.66 0 12 8 99.08 6.34 1 12 8 5.82 4.33 -1 12 8 20.97 4.62 2 12 8 2.16 4.21 -2 12 8 8.61 4.62 3 12 8 -0.84 4.3 -3 12 8 2.5 4.58 4 12 8 29.14 4.86 -4 12 8 40.06 5.69 5 12 8 9.12 4.74 -5 12 8 14.36 5.25 6 12 8 9.06 4.76 -6 12 8 13.63 5.71 7 -12 8 21.02 4.65 7 12 8 18.01 4.94 -7 12 8 19.85 5.99 8 -12 8 50.08 5.4 8 12 8 51.09 5.78 9 -12 8 4.83 4.44 0 14 8 17.49 4.83 1 14 8 27.61 4.97 -1 14 8 31.01 5.24 2 14 8 5.79 4.72 -2 14 8 10.17 4.85 3 14 8 28.05 5.22 -3 14 8 36.47 6.04 4 14 8 11.07 4.73 -4 14 8 20.73 5.91 5 14 8 10.8 4.79 -5 14 8 21.97 6.3 6 14 8 -1.35 4.89 -6 14 8 6.43 6.56 -7 14 8 6.33 6.98 -8 14 8 19.46 7.83 0 16 8 54.94 5.94 -1 16 8 16.33 5.22 1 1 9 15.36 4.01 2 -1 9 43.74 4.69 2 1 9 47.38 4.7 3 -1 9 25.68 4.43 3 1 9 29.83 4.58 4 -1 9 1.44 4.01 4 1 9 -2.16 4.2 5 -1 9 25.48 4.51 5 1 9 18.61 4.51 6 -1 9 84.75 5.93 6 1 9 84.22 6.02 7 -1 9 42.29 5.14 7 1 9 38.52 5.29 8 -1 9 -3 4.51 8 1 9 4.73 4.7 9 -1 9 15.2 4.84 0 3 9 2.66 3.83 1 3 9 16.02 4.31 -1 3 9 22.3 4.03 2 3 9 31 4.57 3 -3 9 40.93 4.68 3 3 9 39.38 4.78 4 -3 9 1.02 3.9 4 3 9 6.3 4.12 5 -3 9 28.65 4.55 5 3 9 25.66 4.96 6 -3 9 48.02 5.03 6 3 9 52.28 5.6 7 -3 9 53.27 5.24 7 3 9 52.7 5.59 8 -3 9 5.9 4.32 8 3 9 1.05 4.63 9 -3 9 15.59 4.63 0 5 9 -1.32 4.02 1 5 9 9.18 4.22 -1 5 9 7.37 4.1 2 5 9 42.99 4.88 -2 5 9 44.45 4.84 3 5 9 20.59 4.67 4 -5 9 3.54 3.82 4 5 9 2.54 4.23 5 -5 9 15.5 4.11 5 5 9 16.06 4.71 6 -5 9 92.23 5.87 6 5 9 93.81 6.35 7 -5 9 17.63 4.49 7 5 9 17.67 4.96 8 -5 9 3.71 4.33 0 7 9 -0.18 4.15 1 7 9 18.25 4.55 -1 7 9 23.36 4.55 2 7 9 17.78 4.55 -2 7 9 19.19 4.51 3 7 9 43.8 5.32 -3 7 9 42.4 4.74 4 7 9 5.41 4.53 5 7 9 36 5.23 6 -7 9 28.34 4.67 6 7 9 29.45 5.19 7 -7 9 44.24 5.07 8 -7 9 3.17 4.28 0 9 9 -2.49 4.44 1 9 9 3.83 4.42 -1 9 9 -0.92 4.38 2 9 9 49.2 5.51 -2 9 9 50.26 5.23 3 9 9 11.74 4.85 -3 9 9 7.27 4.49 4 9 9 3.77 4.57 -4 9 9 -2.67 4.43 5 9 9 3.32 4.68 0 11 9 0.69 4.64 1 11 9 15.64 4.85 -1 11 9 13.09 4.95 -2 11 9 3.33 4.84 -3 11 9 31.26 5.55 -4 11 9 1.26 4.92 2 2 10 -1.81 4.51 1 4 10 7.76 4.48 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 Br1 Bi1 Br3 87.8(2) . . ? Br1 Bi1 Br4 172.7(3) . . ? Br1 Bi1 Br4 90.7(3) . 8_544 ? Br1 Bi1 Br5 93.4(2) . . ? Br2 Bi1 Br1 96.14(6) . . ? Br2 Bi1 Br3 90.4(2) . . ? Br2 Bi1 Br4 173.1(3) . 8_544 ? Br2 Bi1 Br4 91.1(3) . . ? Br2 Bi1 Br5 90.7(2) . . ? Br3 Bi1 Br4 89.70(15) . 8_544 ? Br3 Bi1 Br4 90.88(14) . . ? Br3 Bi1 Br5 178.32(5) . . ? Br4 Bi1 Br4 82.055(15) . 8_544 ? Br5 Bi1 Br4 87.82(16) . . ? Br5 Bi1 Br4 89.06(15) . 8_544 ? Bi1 Br4 Bi1 164.47(8) . 8_545 ? H2A N2 H2B 109.5 . . ? H2A N2 H2C 109.5 . . ? H2B N2 H2C 109.5 . . ? C3 N2 H2A 109.5 . . ? C3 N2 H2B 109.5 . . ? C3 N2 H2C 109.5 . . ? N2 C3 H3A 108.6 . . ? N2 C3 H3B 108.6 . . ? H3A C3 H3B 107.5 . . ? C2 C3 N2 115(2) . . ? C2 C3 H3A 108.6 . . ? C2 C3 H3B 108.6 . . ? C3 C2 H2D 109.5 . . ? C3 C2 H2E 109.5 . . ? C3 C2 H2F 109.5 . . ? H2D C2 H2E 109.5 . . ? H2D C2 H2F 109.5 . . ? H2E C2 H2F 109.5 . . ? H1A C1 H1B 109.5 . . ? H1A C1 H1C 109.5 . . ? H1B C1 H1C 109.5 . . ? C4 C1 H1A 109.5 . . ? C4 C1 H1B 109.5 . . ? C4 C1 H1C 109.5 . . ? C1 C4 H4A 109.5 . . ? C1 C4 H4B 109.5 . . ? H4A C4 H4B 108.1 . . ? N4 C4 C1 110.6 . . ? N4 C4 H4A 109.5 . . ? N4 C4 H4B 109.5 . . ? C4 N4 H4C 109.5 . . ? C4 N4 H4D 109.5 . . ? C4 N4 H4E 109.5 . . ? H4C N4 H4D 109.5 . . ? H4C N4 H4E 109.5 . . ? H4D N4 H4E 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 Bi1 Br1 2.736(5) . ? Bi1 Br2 2.698(5) . ? Bi1 Br3 2.8247(17) . ? Bi1 Br4 3.005(9) . ? Bi1 Br4 3.006(9) 8_544 ? Bi1 Br5 2.8425(18) . ? N2 H2A 0.8900 . ? N2 H2B 0.8900 . ? N2 H2C 0.8900 . ? N2 C3 1.44(2) . ? C3 H3A 0.9700 . ? C3 H3B 0.9700 . ? C3 C2 1.43(3) . ? C2 H2D 0.9600 . ? C2 H2E 0.9600 . ? C2 H2F 0.9600 . ? C1 H1A 0.9600 . ? C1 H1B 0.9600 . ? C1 H1C 0.9600 . ? C1 C4 1.5318 . ? C4 H4A 0.9700 . ? C4 H4B 0.9700 . ? C4 N4 1.5188 . ? N4 H4C 0.8900 . ? N4 H4D 0.8900 . ? N4 H4E 0.8900 . ?