#------------------------------------------------------------------------------ #$Date: 2023-06-29 17:40:04 +0200 (Thu, 29 Jun 2023) $ #$Revision: 284687 $ #$URL: svn://www.crystallography.net/cod/cif/2/02/27/2022779.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_2022779 loop_ _publ_author_name 'Domasevitch, Kostiantyn V.' 'Senchyk, Ganna A.' 'Krautscheid, Harald' _publ_section_title ; catena-Poly[[bis(diaqualithium)]-\m4-3,3′,5,5′-tetranitro-4,4′-bipyrazole-1,1′-diido]: a new moisture-insensitive alkali-metal energetic salt with a well-defined network structure ; _journal_coeditor_code PK2688 _journal_issue 7 _journal_name_full 'Acta Crystallographica Section E Crystallographic Communications' _journal_paper_doi 10.1107/S2056989023005339 _journal_volume 79 _journal_year 2023 _chemical_formula_iupac '[Li2 (C6 N8 O8) (H2 O)4]' _chemical_formula_moiety 'C6 H8 Li2 N8 O12' _chemical_formula_sum 'C6 H8 Li2 N8 O12' _chemical_formula_weight 398.08 _chemical_name_systematic catena-Poly[[bis(diaqualithium)]-\m~4~-3,3',5,5'-tetranitro-4,4'-bipyrazole-1,1'-diido] _space_group_crystal_system orthorhombic _space_group_IT_number 56 _space_group_name_Hall '-P 2ab 2ac' _space_group_name_H-M_alt 'P c c n' _atom_sites_solution_hydrogens difmap _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _audit_creation_method SHELXL-2014/7 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 11.5094(9) _cell_length_b 13.9839(8) _cell_length_c 9.4247(5) _cell_measurement_reflns_used 8000 _cell_measurement_temperature 213(2) _cell_measurement_theta_max 27.967 _cell_measurement_theta_min 2.913 _cell_volume 1516.87(17) _computing_cell_refinement ; IPDS Software (Stoe & Cie, 2000) ; _computing_data_collection ; IPDS Software (Stoe & Cie, 2000) ; _computing_data_reduction ; IPDS Software (Stoe & Cie, 2000) ; _computing_molecular_graphics ; Diamond 2.1e (Brandenburg, 1999) ; _computing_publication_material ; WinGX 1.70.01 (Farrugia, 2012) ; _computing_structure_refinement ; SHELXL-2014/7 (Sheldrick, 2015) ; _computing_structure_solution ; SHELXS-97 (Sheldrick, 2008) ; _diffrn_ambient_temperature 213(2) _diffrn_measured_fraction_theta_full 0.997 _diffrn_measured_fraction_theta_max 0.994 _diffrn_measurement_device_type 'Stoe Image plate diffraction system' _diffrn_measurement_method '\f oscillation scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0485 _diffrn_reflns_av_unetI/netI 0.0410 _diffrn_reflns_limit_h_max 15 _diffrn_reflns_limit_h_min -15 _diffrn_reflns_limit_k_max 18 _diffrn_reflns_limit_k_min -16 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_limit_l_min -12 _diffrn_reflns_number 10855 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.967 _diffrn_reflns_theta_min 2.913 _exptl_absorpt_coefficient_mu 0.165 _exptl_absorpt_correction_type none _exptl_crystal_colour yellow _exptl_crystal_density_diffrn 1.743 _exptl_crystal_description prism _exptl_crystal_F_000 808 _exptl_crystal_size_max 0.250 _exptl_crystal_size_mid 0.220 _exptl_crystal_size_min 0.200 _refine_diff_density_max 0.278 _refine_diff_density_min -0.136 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 0.880 _refine_ls_hydrogen_treatment refall _refine_ls_matrix_type full _refine_ls_number_parameters 151 _refine_ls_number_reflns 1817 _refine_ls_number_restraints 4 _refine_ls_restrained_S_all 0.880 _refine_ls_R_factor_all 0.0468 _refine_ls_R_factor_gt 0.0299 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0455P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0697 _refine_ls_wR_factor_ref 0.0723 _reflns_number_gt 1225 _reflns_number_total 1817 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file pk2688sup1.cif _cod_data_source_block I _cod_database_code 2022779 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_min 0.960 _shelx_estimated_absorpt_t_max 0.968 _shelx_hkl_file ; -1 12 0 1.32 6.12 2 0 12 -3 -1.55 6.24 2 0 14 -2 201.86 8.54 2 0 15 -1 -3.36 7.67 2 1 5 -5 249.79 7.41 2 2 4 -6 623.49 10.50 2 3 4 -7 19.36 5.45 2 3 15 -6 84.69 11.10 2 5 -5 8 1.22 6.33 2 6 -8 5 5.74 6.14 2 6 -6 8 2.45 7.70 2 8 -10 1 0.41 6.24 2 8 -10 2 27.48 7.71 2 8 -10 3 1.07 7.60 2 8 -9 6 1.56 9.04 2 9 -10 5 -1.19 9.16 2 10 -11 2 10.57 9.23 2 11 -11 4 -2.09 12.69 2 -1 3 1 517.67 16.20 3 -1 5 -1 54.83 6.77 3 -1 11 -1 39.92 7.53 3 -1 12 4 18.28 9.15 3 -1 13 1 153.11 9.55 3 -1 13 2 283.01 10.48 3 0 15 5 2.36 13.18 3 0 16 0 172.01 13.54 3 1 11 -5 3.49 8.79 3 1 14 -4 -1.11 10.81 3 1 17 -2 2.60 15.20 3 2 -4 0 138.75 8.40 3 2 2 9 8.12 8.99 3 2 12 -6 237.77 11.89 3 2 15 -5 0.55 13.07 3 3 12 -7 8.86 12.99 3 4 -6 5 21.27 7.27 3 4 2 11 0.36 13.31 3 4 5 -8 -1.43 8.89 3 4 11 -8 -1.34 13.22 3 5 -7 5 89.23 7.78 3 5 -2 10 0.41 12.87 3 5 0 11 -2.36 15.26 3 6 -7 -3 16.67 7.50 3 7 -9 4 20.97 8.86 3 8 -9 -2 89.96 9.49 3 8 4 -10 4.83 17.03 3 9 -10 -1 2.37 10.80 3 9 -9 -3 0.02 10.84 3 9 -8 8 4.47 15.39 3 10 -10 -2 1.70 12.85 3 11 -11 0 24.28 15.24 3 11 -11 3 63.36 15.58 3 12 -11 -1 11.54 18.09 3 12 -10 -3 3.88 17.80 3 -1 13 3 45.23 6.68 3 0 7 -4 551.73 9.04 3 0 8 -4 637.87 9.47 3 0 9 -4 829.36 10.26 3 0 13 -3 -1.17 6.26 3 1 -2 4 2746.90 21.72 3 1 12 -5 -1.54 6.28 3 1 16 -3 5.92 9.32 3 1 18 -1 11.22 11.00 3 2 17 -4 1.27 12.66 3 3 -5 -1 151.56 6.72 3 3 -2 8 21.04 6.39 3 4 12 -8 9.47 10.74 3 7 -9 0 13.78 6.35 3 7 -8 6 90.82 8.10 3 8 -8 7 21.85 9.21 3 8 -5 10 -0.96 12.75 3 9 -10 4 19.63 9.10 3 10 -9 7 4.10 12.65 3 11 -11 1 3.70 10.71 3 11 -11 2 22.49 10.91 3 -1 10 5 216.37 12.69 3 4 -5 -3 369.34 12.19 3 -1 8 -2 684.03 11.07 4 -1 9 -2 82.44 7.76 4 -1 12 -1 49.49 8.96 4 -1 13 0 263.33 10.07 4 0 10 -4 303.11 8.91 4 0 14 6 71.01 13.57 4 0 15 -2 -0.89 10.88 4 0 16 -1 3.47 12.82 4 0 16 4 2.65 13.19 4 1 0 -3 -0.20 6.75 4 1 1 7 145.37 9.06 4 1 4 -5 113.99 6.93 4 1 15 -4 2.97 12.79 4 2 -4 3 94.40 6.90 4 2 0 8 211.84 10.31 4 2 13 -6 98.08 13.19 4 3 -4 6 546.39 10.64 4 3 -3 7 82.21 7.98 4 3 2 10 -0.15 10.92 4 3 13 -7 21.67 13.19 4 4 -2 9 231.30 11.86 4 4 4 -8 32.86 9.08 4 5 -6 -3 430.21 11.83 4 5 7 -9 19.33 13.09 4 5 8 -9 -0.10 13.23 4 5 9 -9 -2.87 15.24 4 5 10 -9 14.90 15.52 4 6 -8 -1 415.41 10.09 4 6 -3 10 17.69 13.20 4 6 -1 11 8.71 15.48 4 6 3 -9 0.75 11.00 4 7 -9 3 111.27 9.33 4 7 -7 -4 125.35 9.97 4 7 -4 10 10.84 15.41 4 7 1 -9 36.48 11.44 4 7 6 -10 5.62 15.81 4 8 -9 5 -0.17 10.70 4 8 -7 8 42.71 13.13 4 8 -6 9 112.30 15.59 4 9 -10 0 -4.91 10.76 4 9 -9 6 1.65 12.92 4 10 -10 5 8.67 15.01 4 11 -9 -4 12.27 15.13 4 12 -11 0 3.93 17.78 4 -1 7 -2 275.34 6.89 4 -1 10 -2 108.21 5.97 4 0 3 -3 1.03 4.39 4 0 6 -4 134.05 5.61 4 0 11 -4 1500.22 13.13 4 0 17 1 -2.93 9.43 4 0 17 2 4.71 10.61 4 1 13 -5 8.50 7.61 4 2 16 -5 0.56 10.84 4 3 -5 4 51.53 5.55 4 4 0 10 373.83 10.33 4 4 13 -8 0.33 12.71 4 5 6 -9 38.31 8.16 4 5 11 -9 19.72 12.69 4 6 -8 4 67.91 6.58 4 6 -7 6 1.98 6.22 4 7 -9 1 271.21 7.94 4 7 -9 2 115.48 6.94 4 9 -10 3 0.13 7.74 4 12 -11 1 11.06 12.69 4 11 -6 -7 3.14 22.00 4 0 12 7 0.13 14.20 4 1 3 8 63.43 11.44 4 7 -6 -5 0.07 10.72 4 -1 6 -2 304.10 8.56 5 -1 11 -2 199.00 8.47 5 -1 11 5 -2.47 8.87 5 -1 13 -1 149.92 9.44 5 -1 13 4 2.91 10.59 5 -1 14 1 425.07 11.19 5 -1 14 2 47.41 10.89 5 -1 14 3 20.89 10.86 5 0 14 -3 -5.31 10.77 5 0 17 0 -0.96 13.17 5 0 17 3 2.31 15.33 5 1 17 -3 100.95 15.52 5 1 18 -2 18.66 17.74 5 2 -4 1 240.69 9.08 5 2 -4 2 89.21 7.16 5 2 -3 5 445.83 9.56 5 2 3 -6 141.35 8.58 5 2 14 -6 62.88 13.32 5 3 0 9 -2.51 8.85 5 3 3 -7 86.72 8.21 5 3 14 -7 19.79 15.57 5 4 -6 -1 44.06 6.24 5 4 -6 4 70.08 7.62 5 4 -5 6 300.35 9.07 5 4 -3 8 208.65 9.96 5 4 3 11 6.57 15.33 5 5 -7 -1 954.87 13.41 5 5 -7 4 -1.82 7.27 5 5 -6 6 0.31 8.72 5 5 -3 9 3.91 10.82 5 7 -7 7 212.14 11.68 5 7 -5 9 3.10 13.03 5 7 5 -10 12.06 15.52 5 8 3 -10 39.31 15.85 5 9 -10 1 5.48 10.68 5 9 -10 2 43.67 10.89 5 9 -8 -4 8.89 10.91 5 10 -10 -1 5.21 10.82 5 10 -10 4 0.13 13.13 5 11 -10 -2 6.12 13.11 5 11 -10 5 -3.64 17.75 5 11 -8 -5 -0.73 15.22 5 12 -9 -4 1.90 16.78 5 -1 4 -1 2566.16 22.42 5 -1 14 0 0.15 6.28 5 0 5 -4 475.20 8.67 5 0 12 -4 105.23 6.77 5 1 16 -4 16.80 9.32 5 2 -1 7 208.50 7.27 5 2 8 -7 19.43 6.35 5 2 9 -7 22.29 6.55 5 4 -4 7 122.85 7.11 5 5 5 -9 81.66 8.39 5 6 -8 0 243.86 7.06 5 6 -8 3 89.79 5.83 5 6 -4 9 37.18 7.89 5 7 -8 5 121.15 7.01 5 7 -6 8 22.78 7.81 5 8 -9 -1 45.30 6.61 5 8 -9 4 20.63 7.75 5 9 -8 7 2.06 9.30 5 10 -9 6 -1.73 10.85 5 2 7 10 10.40 20.68 4 9 -5 -7 30.24 19.05 4 1 14 8 50.83 22.38 5 4 -4 -4 155.67 12.26 5 11 -7 -6 64.91 19.21 5 -1 3 0 940.19 18.35 6 -1 12 -2 286.63 10.17 6 -1 12 5 1.80 8.93 6 0 0 3 -1.06 6.89 6 0 16 -2 73.77 13.16 6 0 16 5 -0.43 15.41 6 0 17 -1 -1.83 13.23 6 0 17 4 16.54 15.61 6 1 -1 5 5.58 5.86 6 1 0 6 1399.08 17.63 6 1 8 -6 7.52 8.71 6 1 9 -6 96.64 9.30 6 1 10 -6 5.24 8.68 6 1 14 -5 2.64 12.00 6 2 -2 6 194.54 8.76 6 2 7 -7 33.35 8.95 6 2 10 -7 213.94 11.76 6 2 11 -7 8.02 10.85 6 2 15 -6 19.03 15.46 6 3 -5 3 39.65 6.09 6 3 8 -8 301.81 12.28 6 3 9 -8 15.46 10.96 6 4 3 -8 213.67 10.43 6 5 -5 7 104.47 9.28 6 5 -4 8 70.99 9.11 6 5 -1 10 9.77 12.89 6 5 1 -8 34.64 9.21 6 5 1 11 12.52 15.32 6 6 -8 1 379.74 9.61 6 6 -8 2 150.62 8.19 6 6 -6 -4 99.01 8.66 6 6 -6 7 10.49 8.86 6 6 -5 8 0.60 10.76 6 7 -8 -2 245.74 10.40 6 8 -8 -3 1.47 8.75 6 8 -8 6 2.10 10.87 6 9 -9 -2 -0.17 10.79 6 9 -9 5 27.31 12.78 6 9 -7 8 27.32 15.38 6 9 -6 9 16.29 17.70 6 10 -10 0 -3.03 10.98 6 10 -10 3 41.51 13.00 6 10 -9 -3 8.85 11.00 6 12 -10 -2 2.96 15.50 6 -1 14 -1 384.49 8.54 6 -1 15 1 8.71 7.75 6 -1 15 2 134.84 8.58 6 0 13 -4 175.31 8.41 6 0 15 -3 -2.62 7.71 6 1 -2 3 4339.75 29.02 6 1 7 -6 15.52 5.22 6 1 11 -6 15.05 6.35 6 3 -5 0 5619.27 29.86 6 3 7 -8 105.52 7.15 6 3 10 -8 8.43 9.22 6 5 -7 3 1.83 5.10 6 8 -9 3 9.70 6.27 6 8 -4 10 8.74 12.64 6 10 -10 1 -2.76 7.70 6 10 -10 2 0.44 9.10 6 11 -10 -1 5.34 9.32 6 11 -10 4 22.44 10.94 6 2 8 10 40.15 21.55 5 2 -1 -4 315.66 16.26 6 -1 5 -2 2741.29 20.60 7 -1 9 -3 -0.04 7.18 7 -1 10 -3 4.19 7.21 7 -1 13 -2 295.60 10.12 7 -1 14 4 0.24 10.87 7 -1 15 0 23.81 10.89 7 -1 15 3 12.72 11.08 7 0 15 6 7.65 15.35 7 0 18 0 114.97 16.01 7 0 18 1 -2.00 16.77 7 0 18 2 10.08 17.93 7 1 3 -5 345.70 9.33 7 1 15 -5 116.57 13.42 7 1 17 -4 9.68 15.42 7 2 3 9 183.82 10.71 7 2 6 -7 91.48 9.31 7 2 12 -7 196.47 13.50 7 3 -4 5 146.32 8.27 7 3 -1 8 1.66 8.69 7 3 3 10 32.35 11.23 7 3 11 -8 87.07 13.45 7 4 -6 0 0.94 5.64 7 4 -6 3 34.61 7.37 7 4 -1 9 -1.08 9.85 7 4 4 11 29.72 15.52 7 5 -7 0 26.83 7.38 7 5 -5 -4 212.43 10.59 7 5 4 -9 58.70 11.32 7 6 -7 5 82.03 9.11 7 6 -2 10 63.84 13.32 7 6 0 11 6.59 15.35 7 6 2 -9 32.83 11.21 7 6 7 -10 9.48 15.61 7 6 8 -10 8.35 18.23 7 7 -3 10 3.73 15.13 7 7 4 -10 16.48 15.51 7 8 -9 0 2.28 8.77 7 8 -7 7 46.11 12.15 7 9 -7 -5 64.10 11.36 7 10 -8 7 15.15 15.38 7 12 -8 -5 22.78 18.03 7 -1 8 -3 260.76 7.19 7 -1 11 -3 146.22 6.25 7 0 9 -5 0.44 5.14 7 0 10 -5 1.86 6.15 7 0 14 -4 123.77 8.31 7 0 17 -2 -0.47 10.70 7 1 -2 0 0.13 5.19 7 1 6 -6 336.29 7.90 7 1 12 -6 0.73 7.58 7 2 13 -7 -0.83 9.25 7 3 -5 1 161.43 6.25 7 3 -5 2 1107.95 12.41 7 3 6 -8 63.62 6.84 7 3 12 -8 8.51 10.60 7 4 1 10 5.36 7.91 7 4 9 -9 76.81 9.66 7 5 -7 1 826.95 10.56 7 5 -7 2 954.82 10.85 7 7 -8 4 28.15 6.30 7 7 -7 6 62.15 6.57 7 7 -1 11 6.68 12.77 7 8 -9 1 45.89 6.56 7 8 -9 2 88.42 6.73 7 8 -6 8 72.03 9.42 7 8 -5 9 6.54 10.62 7 9 -9 4 18.51 7.75 7 10 -9 5 28.31 9.31 7 10 -7 8 18.03 12.59 7 11 -10 0 2.09 9.16 7 11 -10 3 3.36 10.82 7 12 -10 -1 8.51 10.94 7 0 5 7 0.70 12.48 6 0 13 7 -2.16 16.05 7 3 0 -6 172.51 11.36 7 6 -5 -5 -0.08 8.91 7 9 -6 -6 136.57 14.85 7 -2 9 1 914.42 13.00 8 -1 7 -3 37.83 6.03 8 -1 13 5 5.31 10.91 8 -1 14 -2 48.51 10.86 8 -1 15 -1 5.97 10.89 8 -1 16 1 36.46 13.06 8 -1 16 2 111.34 13.46 8 0 4 -4 419.85 9.63 8 0 8 -5 2.63 7.21 8 0 11 -5 -0.68 8.71 8 0 16 -3 -6.04 12.99 8 0 18 -1 -5.54 15.68 8 1 1 -4 307.17 10.62 8 1 13 -6 5.17 10.94 8 1 16 -5 4.12 15.29 8 2 -3 4 2567.53 19.61 8 2 1 8 13.16 8.82 8 2 2 -6 190.08 9.25 8 2 5 -7 34.41 7.53 8 3 1 9 1.99 8.86 8 3 2 -7 8.32 7.39 8 3 13 -8 14.27 15.53 8 4 -6 1 42.31 6.12 8 4 -6 2 214.22 7.48 8 4 -5 5 104.48 7.87 8 4 7 -9 -3.86 11.04 8 4 8 -9 88.12 13.46 8 4 10 -9 8.67 15.28 8 4 11 -9 -3.65 15.55 8 5 -6 5 200.76 8.40 8 5 2 11 5.15 15.27 8 6 -7 -2 15.21 7.32 8 6 6 -10 0.38 15.46 8 7 -8 -1 271.31 9.18 8 8 -8 5 11.05 10.60 8 8 2 -10 42.38 15.83 8 9 -9 -1 11.09 10.67 8 9 -8 6 -5.39 12.77 8 11 -10 1 13.25 13.06 8 11 -10 2 8.62 13.05 8 11 -9 -3 1.81 13.04 8 12 -10 3 6.12 17.83 8 -2 10 1 88.79 5.97 8 -1 12 -3 32.86 6.30 8 -1 16 0 0.67 9.02 8 0 7 -5 0.82 5.05 8 0 12 -5 2.52 6.16 8 0 15 -4 29.93 9.12 8 2 14 -7 61.15 11.16 8 3 -3 6 17.61 5.36 8 3 -2 7 5.40 5.19 8 5 -2 9 98.34 8.30 8 7 -6 7 49.31 7.92 8 7 -4 9 5.37 9.09 8 12 -10 0 10.21 10.92 8 2 9 10 -0.84 30.63 6 0 3 6 500.73 16.83 8 1 4 8 13.29 10.85 8 4 0 -7 -1.57 9.01 8 10 -8 -4 0.17 13.48 8 -2 8 1 109.60 6.87 9 -2 8 2 -0.61 7.26 9 -2 9 0 1.15 7.15 9 -2 9 2 26.03 7.50 9 -2 10 0 363.65 9.41 9 -2 10 2 133.17 8.35 9 -2 11 1 150.82 8.37 9 -2 11 2 231.56 9.10 9 -1 6 -3 545.10 9.78 9 -1 13 -3 48.77 9.10 9 -1 15 4 0.62 12.94 9 -1 16 3 11.80 13.15 9 0 2 -3 2.08 6.53 9 0 17 -3 -0.67 15.25 9 1 -2 2 3414.68 28.79 9 1 5 -6 15.09 7.45 9 1 14 -6 52.50 13.06 9 3 5 -8 416.15 11.45 9 4 -2 8 10.26 8.81 9 4 6 -9 137.79 11.62 9 5 0 10 69.68 13.22 9 6 -7 4 38.46 7.42 9 6 -6 6 81.03 9.13 9 6 -3 9 0.39 10.88 9 6 5 -10 29.94 15.40 9 7 -8 3 3.57 8.63 9 7 -5 8 117.35 11.32 9 8 -7 -4 56.01 9.35 9 9 -9 3 3.59 10.75 9 9 -7 7 77.43 13.30 9 9 -5 9 19.90 15.53 9 10 -9 -2 203.58 11.92 9 10 -9 4 93.90 13.14 9 11 -9 5 13.41 15.43 9 12 -10 1 12.31 15.48 9 12 -10 2 -6.54 15.62 9 12 -9 -3 6.43 15.49 9 -2 8 0 382.84 7.94 9 -2 11 0 0.19 5.08 9 -2 12 1 139.27 7.22 9 -1 4 -2 381.43 9.03 9 -1 15 -2 137.14 8.47 9 -1 16 -1 32.58 9.29 9 0 1 -2 1777.72 25.83 9 0 6 -5 0.43 5.18 9 0 13 -5 -2.32 7.59 9 0 18 -2 10.05 12.66 9 1 -2 1 437.02 12.45 9 2 15 -7 31.19 12.64 9 4 -4 6 33.89 5.42 9 5 -5 6 2.43 5.10 9 6 -5 7 32.86 6.41 9 6 -4 8 102.47 8.17 9 7 -8 0 -1.11 5.20 9 7 -8 2 215.02 7.59 9 8 -3 10 30.70 11.18 9 9 -9 0 204.53 7.59 9 9 -9 2 -3.54 7.61 9 9 -6 8 3.13 10.77 9 10 -8 6 29.20 9.31 9 5 -4 -5 14.30 11.80 8 0 16 6 34.44 22.35 9 1 2 7 43.80 9.43 9 3 -4 -2 109.28 9.05 9 3 4 10 29.91 13.73 9 4 5 11 0.50 18.89 9 7 3 -10 1.87 18.62 9 -2 7 1 314.94 9.11 10 -2 9 3 2.02 7.30 10 -2 10 -1 91.62 7.73 10 -2 10 3 -1.78 7.30 10 -2 12 0 3.60 8.75 10 -2 12 2 53.49 9.12 10 -1 3 -1 522.49 13.44 10 -1 14 -3 27.55 10.82 10 -1 14 5 8.76 12.90 10 -1 17 1 -1.26 14.23 10 -1 17 2 3.96 15.34 10 0 14 -5 -5.18 11.90 10 0 14 7 0.21 15.29 10 0 16 -4 -2.96 14.14 10 1 15 -6 2.01 15.25 10 2 0 7 0.05 7.22 10 2 4 -7 18.52 7.49 10 3 -4 4 278.31 8.04 10 4 -3 7 212.38 8.70 10 4 2 -8 11.29 8.94 10 5 -6 -2 5.68 7.22 10 5 -6 4 507.56 10.08 10 5 -4 7 60.43 9.06 10 5 -3 8 43.75 9.17 10 5 3 -9 1.87 10.89 10 5 9 -10 18.67 18.11 10 6 -1 10 11.92 13.18 10 6 1 11 5.14 15.52 10 7 -8 1 293.11 8.98 10 7 -7 -3 192.50 8.95 10 7 -7 5 -0.34 8.69 10 7 -2 10 6.96 15.08 10 8 -8 -2 3.59 8.76 10 8 -8 4 7.39 8.77 10 8 -7 6 4.21 10.73 10 9 -9 1 5.61 9.93 10 9 -8 -3 6.49 10.67 10 9 -8 5 1.55 10.83 10 11 -9 -2 30.29 12.98 10 -2 7 0 2.22 4.06 10 -2 7 2 277.52 8.13 10 -2 9 -1 897.71 11.10 10 -2 11 -1 139.40 6.22 10 -2 13 1 4.32 6.23 10 -1 9 -4 2.67 5.19 10 -1 10 -4 34.92 5.43 10 -1 11 -4 -1.54 6.25 10 -1 17 0 5.53 9.34 10 1 10 -7 5.84 7.57 10 2 -2 5 976.62 12.47 10 2 10 -8 2.87 7.83 10 4 -5 4 340.66 7.66 10 5 8 -10 0.92 11.04 10 6 -7 -1 0.91 5.09 10 6 -7 3 22.17 5.25 10 8 -4 9 4.93 9.30 10 10 -9 -1 42.48 7.96 10 10 -9 3 6.58 7.81 10 10 -7 7 -1.95 10.75 10 11 -9 4 -0.28 10.76 10 11 -8 6 1.93 10.93 10 -1 9 6 91.58 12.12 10 -1 10 6 1.44 10.86 10 2 0 -5 0.98 7.04 10 2 4 9 153.47 12.48 10 7 0 -9 -4.78 13.59 10 -2 8 -1 107.13 6.71 11 -2 8 3 50.01 7.75 11 -2 11 3 1.66 8.80 11 -2 12 -1 159.18 9.54 11 -2 12 3 70.80 9.28 11 -2 13 0 -0.97 8.79 11 -2 13 2 70.35 9.38 11 -1 5 -3 52.51 6.37 11 -1 8 -4 45.03 7.56 11 -1 11 6 17.11 9.11 11 -1 12 -4 26.89 8.94 11 -1 15 -3 22.55 10.92 11 -1 16 -2 133.05 13.31 11 -1 16 4 19.41 14.25 11 -1 17 -1 -3.17 14.16 11 -1 17 3 101.89 15.77 11 0 1 4 2406.08 30.06 11 0 3 -4 577.03 11.20 11 0 5 -5 0.79 7.19 11 0 15 -5 -3.33 13.06 11 1 -1 4 316.41 9.84 11 1 2 -5 350.84 9.84 11 1 4 -6 94.91 8.09 11 1 8 -7 52.19 9.07 11 1 9 -7 489.41 11.28 11 1 11 -7 34.75 10.89 11 1 12 -7 37.53 12.09 11 1 16 -6 27.68 17.93 11 2 -3 3 2038.71 18.45 11 2 -1 6 208.37 9.13 11 2 8 -8 408.97 12.54 11 2 9 -8 108.33 11.37 11 2 11 -8 9.64 13.02 11 2 12 -8 -2.39 13.28 11 3 0 8 31.81 9.05 11 3 4 -8 109.21 9.63 11 4 -5 -2 108.75 7.33 11 4 0 9 -0.14 8.86 11 4 2 10 3.35 10.98 11 4 5 -9 45.77 11.12 11 5 3 11 19.05 15.42 11 5 7 -10 9.47 15.39 11 8 -6 7 315.61 12.09 11 8 -5 8 5.08 12.86 11 10 -9 0 -0.05 10.85 11 10 -9 2 179.98 11.60 11 10 -7 -5 -2.04 12.01 11 10 -6 8 18.06 15.47 11 11 -8 -4 66.00 13.55 11 12 -9 -2 33.23 15.36 11 12 -9 4 8.06 16.67 11 -1 7 -4 1.29 5.14 11 -1 13 -4 3.66 7.49 11 0 10 -6 251.87 7.74 11 0 17 -4 14.68 11.00 11 6 -7 2 8.99 5.25 11 6 -6 5 258.85 7.75 11 7 -6 6 29.47 6.39 11 8 -8 3 4.72 6.14 11 10 -9 1 35.43 7.89 11 10 -8 5 21.57 9.31 11 11 -9 3 0.85 9.25 11 11 -7 7 2.16 12.55 11 6 -1 -8 100.77 14.28 11 0 2 5 -0.07 7.05 11 6 1 -9 98.14 14.29 11 -2 6 1 1959.76 19.41 12 -2 7 -1 331.67 8.60 12 -2 9 -2 25.84 7.47 12 -2 10 -2 132.34 7.98 12 -2 11 -2 253.91 8.76 12 -2 13 -1 9.87 8.75 12 -2 13 3 2.49 8.78 12 -2 14 0 299.89 11.34 12 -2 14 1 328.23 12.19 12 -2 14 2 9.02 10.70 12 -1 12 6 5.45 10.83 12 -1 15 5 115.94 13.90 12 -1 17 -2 9.81 15.16 12 -1 18 0 -3.95 15.57 12 -1 18 1 8.29 16.79 12 -1 18 2 4.11 17.95 12 0 8 -6 114.28 8.73 12 0 9 -6 0.54 8.74 12 0 11 -6 -4.33 8.89 12 0 12 -6 5.22 10.69 12 1 7 -7 -1.13 8.75 12 1 13 -7 8.48 13.10 12 2 -3 -1 108.43 9.21 12 2 2 8 8.54 8.78 12 2 7 -8 105.31 9.67 12 2 13 -8 -4.18 15.51 12 3 2 9 26.48 9.09 12 3 8 -9 23.60 12.85 12 3 9 -9 35.16 13.24 12 3 10 -9 41.35 13.39 12 3 11 -9 11.92 15.33 12 3 12 -9 0.32 17.97 12 4 6 11 60.89 16.09 12 5 -6 3 504.14 10.01 12 5 -1 9 3.85 10.75 12 5 6 -10 174.69 14.28 12 6 -7 0 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9.15 13 -2 8 -2 -1.28 7.21 13 -2 11 4 12.23 8.87 13 -2 13 -2 70.61 9.16 13 -2 14 3 -0.39 10.74 13 -2 15 0 0.18 10.86 13 -2 15 1 237.90 12.01 13 -1 6 -4 311.17 8.17 13 -1 13 6 1.00 11.00 13 -1 17 4 6.76 15.59 13 -1 18 -1 9.81 16.77 13 0 7 -6 253.64 8.87 13 1 0 5 0.83 5.75 13 1 6 -7 2.63 8.71 13 2 -3 2 37.53 6.94 13 2 3 -7 3.30 7.41 13 2 6 -8 69.36 9.34 13 3 -1 7 224.94 9.00 13 3 5 10 16.79 13.08 13 3 7 -9 8.39 11.01 13 4 -4 5 108.18 7.89 13 4 -1 8 59.39 9.14 13 4 4 -9 27.24 11.09 13 5 -6 -1 70.21 7.78 13 5 -6 2 9.59 7.12 13 6 -6 -3 4.45 7.34 13 6 -5 6 2.87 8.73 13 6 0 10 61.64 13.26 13 7 -7 -2 46.83 7.62 13 7 -1 10 62.69 14.48 13 8 -8 1 423.69 10.82 13 9 -8 -2 427.15 11.43 13 9 -7 -4 9.32 10.72 13 9 -6 7 31.93 12.94 13 9 -5 8 21.10 13.23 13 10 -7 6 13.12 12.85 13 11 -9 1 84.30 13.12 13 11 -7 -5 12.61 13.21 13 12 -9 -1 19.41 15.20 13 12 -9 2 30.77 15.25 13 12 -8 5 12.83 17.84 13 13 -9 -1 20.74 17.96 13 -2 15 2 5.10 7.79 13 -1 10 -5 190.36 7.35 13 -1 11 -5 -1.07 6.16 13 -1 15 -4 3.95 9.04 13 0 14 -6 75.02 9.51 13 1 15 -7 3.62 12.60 13 3 -2 6 307.97 7.90 13 6 -4 7 39.50 6.51 13 6 -3 8 -2.03 6.39 13 9 -8 3 0.54 7.58 13 10 -8 4 -0.63 7.75 13 12 -9 0 4.57 10.54 13 12 -9 1 18.86 10.74 13 -1 8 6 5.63 12.50 13 -2 10 4 5.20 8.92 13 3 1 -7 230.42 11.47 13 5 4 11 50.55 19.32 13 7 -6 -4 147.32 11.96 13 7 2 -10 7.80 18.56 13 8 1 -10 39.95 19.30 13 -2 6 -1 1959.57 17.29 14 -2 7 -2 321.24 8.24 14 -2 9 4 142.54 9.03 14 -2 10 -3 -0.97 7.25 14 -2 11 -3 2.39 8.76 14 -2 12 4 264.44 10.93 14 -2 14 -2 8.60 10.72 14 -2 15 -1 234.43 11.89 14 -2 16 0 8.48 12.76 14 -2 16 1 20.24 12.98 14 -1 4 -3 329.42 9.07 14 -1 9 -5 82.86 7.75 14 -1 12 -5 7.78 8.82 14 -1 16 5 3.61 15.46 14 -1 17 -3 96.96 15.73 14 -1 18 -2 9.86 17.87 14 0 4 -5 0.69 5.71 14 0 15 -6 15.34 15.09 14 1 3 -6 129.35 8.44 14 2 1 -6 216.51 9.88 14 3 -4 -1 285.25 9.90 14 3 3 -8 75.96 9.43 14 4 -5 -1 1091.91 14.78 14 4 -3 6 19.70 7.40 14 4 -2 7 205.26 8.77 14 4 3 10 -1.87 10.98 14 4 8 -10 110.40 15.96 14 4 9 -10 1.43 15.89 14 5 -6 0 2.34 6.40 14 5 -6 1 68.79 7.68 14 5 -4 6 329.61 9.21 14 5 -3 7 22.94 8.90 14 5 -2 8 28.41 8.98 14 5 2 -9 111.46 11.77 14 5 5 -10 19.64 13.32 14 6 -6 4 112.14 7.86 14 7 -7 3 199.65 8.35 14 8 -7 -3 4.32 8.81 14 8 -6 6 -4.83 10.71 14 8 -3 9 40.84 13.22 14 9 -8 -1 53.83 9.18 14 9 -7 5 61.00 11.02 14 10 -6 7 19.66 13.19 14 11 -8 -3 1.75 12.90 14 11 -7 6 65.53 15.30 14 13 -9 0 4.17 16.72 14 13 -9 1 19.13 17.96 14 -2 9 -3 1.33 5.21 14 -2 12 -3 75.12 6.60 14 -1 3 -2 1644.21 18.26 14 -1 8 -5 451.66 8.32 14 -1 13 -5 5.18 7.65 14 -1 16 -4 17.75 10.64 14 0 6 -6 529.52 9.16 14 3 -4 2 94.10 5.44 14 3 6 -9 20.23 7.88 14 4 -5 2 88.30 5.17 14 7 -6 5 4.12 6.09 14 8 -7 4 55.60 6.49 14 9 -8 2 381.06 8.43 14 10 -5 8 2.73 10.80 14 11 -8 4 57.77 9.41 14 8 -4 -7 26.74 19.22 13 8 -5 -6 45.66 13.20 14 11 -4 -8 6.48 25.58 14 1 5 8 1.00 10.73 14 2 5 9 26.85 13.48 14 4 7 11 21.44 22.26 14 12 -7 -5 3.37 19.12 14 -2 13 -3 5.22 8.79 15 -2 13 4 0.12 10.76 15 -2 15 -2 9.42 10.88 15 -2 15 3 22.66 12.10 15 -2 16 -1 9.77 12.97 15 -2 16 2 10.43 13.07 15 -1 5 -4 6.09 5.84 15 -1 14 -5 8.19 11.90 15 -1 14 6 38.57 13.50 15 0 16 -6 37.70 18.02 15 1 5 -7 31.50 7.55 15 1 10 -8 31.48 11.09 15 1 11 -8 70.07 13.19 15 2 -3 0 1.20 7.38 15 2 -3 1 107.22 8.38 15 2 -2 4 431.62 10.00 15 2 5 -8 14.64 8.88 15 4 1 9 0.44 8.90 15 4 7 -10 37.94 13.48 15 6 3 -10 22.50 13.43 15 6 3 11 89.54 16.04 15 7 -7 -1 3.27 7.27 15 7 -7 2 46.46 7.52 15 7 -2 9 -4.75 12.84 15 8 -5 7 99.48 11.17 15 8 -4 8 131.08 11.58 15 9 -8 0 -0.06 8.92 15 9 -8 1 56.83 9.15 15 10 -8 -2 6.58 10.79 15 10 -8 3 137.42 11.32 15 11 -6 -6 43.85 14.50 15 11 -6 7 -4.87 15.44 15 12 -8 -3 5.42 15.21 15 12 -8 4 1.95 15.17 15 13 -8 -3 65.51 18.22 15 -2 5 0 -0.60 4.36 15 -2 8 -3 49.74 5.59 15 -2 14 -3 1.90 7.57 15 -1 7 -5 63.28 5.65 15 -1 17 -4 -1.97 11.01 15 0 11 -7 -0.11 7.68 15 1 12 -8 7.77 9.33 15 4 -5 0 -1.05 4.11 15 4 -5 1 1033.70 12.09 15 5 -5 4 221.41 6.71 15 8 -1 10 33.29 11.06 15 9 -6 6 126.73 8.30 15 10 -7 5 -3.33 8.97 15 4 1 -8 62.26 11.30 15 11 -5 -7 31.84 19.18 15 -2 5 1 -0.24 6.02 16 -2 6 -2 2.20 5.81 16 -2 8 4 21.78 7.60 16 -2 14 4 19.26 11.02 16 -2 16 -2 6.86 12.94 16 -2 16 3 7.46 13.18 16 -2 17 -1 13.64 15.10 16 -2 17 0 -2.88 15.10 16 -2 17 1 12.28 15.17 16 -1 15 -5 122.73 13.49 16 0 9 -7 0.94 8.85 16 0 10 -7 2.42 10.57 16 0 12 -7 -1.39 11.84 16 0 13 -7 0.77 13.01 16 1 -1 3 3849.50 30.09 16 1 3 7 24.40 7.66 16 1 9 -8 55.66 11.09 16 1 13 -8 0.57 15.34 16 2 1 7 232.40 9.46 16 2 9 -9 16.72 12.92 16 2 10 -9 8.95 13.19 16 2 11 -9 15.01 15.39 16 2 12 -9 21.98 16.84 16 3 -4 0 -0.01 6.16 16 3 -4 1 318.64 9.23 16 3 -3 4 1.74 5.81 16 3 1 8 2.40 8.85 16 3 3 9 0.16 8.93 16 3 5 -9 265.94 12.29 16 4 -4 4 167.23 8.33 16 4 3 -9 1.39 10.77 16 5 -5 -3 196.42 9.64 16 5 0 9 0.70 10.68 16 5 2 10 4.01 12.90 16 5 5 11 64.35 16.16 16 6 -6 3 2.83 7.22 16 6 -5 5 -2.62 7.21 16 6 -1 9 95.39 11.23 16 7 -7 0 404.91 9.69 16 7 -7 1 1.00 7.25 16 7 -5 6 26.01 8.87 16 7 -3 8 111.37 11.31 16 7 0 10 59.84 13.48 16 8 -7 3 4.48 8.70 16 9 -3 9 1.14 15.19 16 10 -8 -1 2.88 10.74 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126.65 9.48 18 -3 13 0 4.69 8.91 18 -3 13 1 -1.68 8.85 18 -2 5 2 32.61 6.60 18 -2 8 -4 22.16 7.34 18 -2 15 -4 10.44 12.82 18 -2 17 3 -11.95 15.64 18 -1 14 -6 50.76 13.11 18 0 1 -3 -1.91 6.85 18 0 7 -7 0.56 8.68 18 1 1 -5 7.02 5.88 18 1 4 -7 49.05 7.66 18 2 2 -7 474.01 11.68 18 2 4 -8 3.01 8.68 18 2 7 -9 -0.50 10.96 18 3 0 7 0.25 7.22 18 3 2 -8 24.80 8.97 18 3 9 -10 39.08 15.52 18 5 -5 3 193.55 8.43 18 5 -1 8 34.46 8.97 18 6 -6 -1 346.32 9.95 18 6 -5 -4 52.27 7.99 18 6 -3 7 31.39 8.82 18 6 4 11 7.56 18.06 18 8 -7 -1 69.67 9.17 18 8 -5 6 44.36 9.05 18 9 -7 3 55.72 9.11 18 10 -5 7 5.69 12.90 18 10 -4 8 7.57 15.21 18 11 -8 0 -1.31 10.86 18 11 -7 -4 13.96 12.98 18 11 -6 6 43.86 14.25 18 12 -8 -1 9.46 13.01 18 12 -8 1 14.34 12.94 18 12 -7 -4 32.82 15.34 18 13 -8 -1 22.73 15.39 18 13 -8 2 28.41 15.61 18 -3 9 0 8.13 5.14 18 -3 10 -1 3.88 5.02 18 -3 13 -1 2.13 6.22 18 -3 14 0 2.71 7.54 18 -2 6 -3 37.93 4.50 18 -2 17 -3 -1.38 10.92 18 -1 2 -1 438.17 12.52 18 -1 3 -3 17.39 4.62 18 -1 4 -4 100.90 5.48 18 -1 8 -6 4.45 6.29 18 -1 15 -6 1.43 10.77 18 3 -2 5 26.56 4.36 18 3 8 -10 5.81 10.78 18 4 -3 5 224.71 6.99 18 6 -6 1 344.64 7.84 18 7 -1 9 34.11 7.96 18 8 -7 1 64.06 6.62 18 8 -4 7 20.84 7.79 18 8 -3 8 8.98 7.78 18 8 0 10 85.73 11.41 18 9 -6 5 153.26 8.29 18 11 -7 4 10.82 9.08 18 11 -5 7 40.42 10.85 18 11 -4 8 9.14 12.50 18 12 -8 0 99.36 9.72 18 12 -6 6 0.39 10.93 18 13 -8 0 -4.94 10.89 18 13 -8 1 15.45 10.92 18 -2 11 5 28.36 11.10 18 -2 12 5 331.16 15.38 18 -1 16 6 15.60 22.20 18 1 0 -4 17.48 7.81 18 4 -4 -3 90.61 8.76 18 7 -6 -3 2.90 8.83 18 8 -6 -4 11.28 10.66 18 -3 9 -1 258.91 8.82 19 -3 9 1 264.09 9.22 19 -3 11 -2 9.93 8.14 19 -3 11 2 10.45 8.15 19 -3 12 -2 8.75 8.81 19 -3 12 2 15.96 8.81 19 -3 13 -2 36.35 8.98 19 -3 13 2 37.04 9.08 19 -3 14 -1 0.99 10.74 19 -3 14 1 -2.39 10.79 19 -3 15 0 15.78 10.91 19 -2 5 -2 32.75 6.22 19 -2 11 -5 27.86 8.95 19 -2 12 -5 340.89 11.79 19 -2 13 5 8.60 10.86 19 -2 16 -4 -0.95 15.19 19 -2 16 4 7.54 15.29 19 -1 16 -6 15.82 17.91 19 1 2 -6 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78.36 8.27 20 -3 16 -1 5.45 9.22 20 -3 16 1 2.58 9.19 20 -2 15 -5 2.15 9.31 20 -1 11 -7 23.91 7.75 20 -1 12 -7 42.68 9.11 20 -1 13 -7 8.32 9.17 20 0 9 -8 66.21 7.98 20 5 6 -11 14.23 12.68 20 7 -3 7 37.19 6.47 20 9 -7 -1 105.54 6.97 20 9 -7 1 103.60 6.83 20 11 -7 -3 123.46 8.61 20 11 -6 5 -0.60 9.08 20 12 -7 3 -1.12 9.18 20 0 6 7 0.71 14.36 18 0 12 8 2.05 20.69 19 0 4 6 1526.91 29.35 20 0 13 8 95.27 22.70 20 3 -3 -3 572.22 18.24 20 3 4 9 136.39 14.14 20 4 5 10 5.26 15.81 20 5 3 -10 8.64 15.95 20 6 0 -9 1.54 13.25 20 7 1 -10 65.50 16.95 20 -3 9 2 141.91 8.51 21 -3 10 -3 186.86 8.34 21 -3 11 3 3.96 8.65 21 -3 12 3 8.67 8.92 21 -3 13 3 6.15 10.02 21 -3 14 -3 6.48 10.77 21 -3 16 -2 2.52 13.01 21 -3 17 0 1.99 15.18 21 -2 4 0 150.46 8.57 21 -2 15 5 1.17 13.21 21 -2 16 -5 -9.10 15.45 21 -1 10 -7 9.72 10.73 21 -1 14 -7 2.78 15.19 21 -1 15 -7 12.95 17.72 21 1 -1 2 2045.88 25.01 21 1 9 -9 -1.59 12.94 21 2 3 -8 0.22 8.75 21 2 10 -10 -4.44 15.68 21 3 2 8 25.16 8.87 21 4 2 -9 232.86 12.53 21 5 -5 1 53.93 6.22 21 5 -4 4 12.04 7.25 21 6 -4 5 621.09 10.61 21 6 -1 8 102.48 9.40 21 7 -6 -2 141.75 8.53 21 7 -6 2 160.05 8.08 21 8 -6 3 80.40 9.13 21 8 -5 5 128.89 9.24 21 8 -1 9 -1.09 13.03 21 9 -7 0 194.05 9.73 21 9 -6 4 85.50 9.14 21 10 -7 -2 53.52 11.09 21 10 -7 2 58.81 10.89 21 10 -5 6 -6.68 11.89 21 10 -3 8 3.98 15.06 21 11 -6 -5 -5.63 13.15 21 12 -7 -3 -0.95 13.10 21 12 -6 5 22.98 15.12 21 13 -7 -3 18.67 15.56 21 13 -7 3 10.29 15.49 21 -3 8 -2 293.51 7.48 21 -3 15 -3 120.15 9.69 21 -3 16 2 7.86 9.21 21 -3 17 -1 2.56 10.78 21 -3 17 1 -1.87 10.84 21 -2 4 -1 213.01 7.47 21 -2 5 -3 262.56 7.03 21 -2 6 -4 404.60 8.15 21 -2 8 -5 8.55 5.19 21 -1 6 -6 316.46 7.61 21 -1 9 -7 407.18 8.66 21 0 8 -8 -1.22 7.57 21 1 5 -8 3.62 6.15 21 1 8 -9 34.84 7.85 21 3 6 -10 22.44 9.33 21 4 -4 2 84.49 5.16 21 6 -5 3 38.23 5.39 21 8 1 10 30.61 11.04 21 10 -4 7 12.75 9.25 21 11 -7 2 202.20 8.71 21 11 -5 6 13.63 9.19 21 -2 9 5 49.21 9.61 21 1 1 5 7.45 7.19 21 1 6 8 75.70 12.02 21 3 -1 -6 1004.31 23.07 21 -3 7 0 266.93 8.27 22 -3 9 -3 72.25 7.60 22 -3 10 3 174.82 8.91 22 -3 14 3 5.67 10.90 22 -3 15 3 128.01 13.52 22 -3 16 -3 136.30 13.61 22 -3 17 -2 31.77 15.41 22 -2 4 1 216.54 9.76 22 -2 11 -6 50.50 10.85 22 -2 12 -6 233.87 11.70 22 -2 13 -6 99.88 12.95 22 -2 14 -6 59.41 13.19 22 -2 16 5 -6.24 15.63 22 -1 2 -2 3179.10 28.21 22 0 5 -7 2.68 7.20 22 1 3 -7 25.68 7.51 22 2 2 7 441.90 11.46 22 2 5 -9 27.16 10.91 22 2 9 -10 -5.66 15.42 22 4 1 8 57.45 9.16 22 4 4 -10 29.45 13.20 22 5 -5 -1 59.10 6.32 22 5 -5 0 1241.62 14.12 22 5 0 8 3.10 8.70 22 5 4 10 19.10 13.05 22 6 -3 6 -2.17 7.20 22 6 -2 7 7.12 8.83 22 6 4 -11 14.00 18.04 22 7 -6 1 17.65 7.30 22 7 -5 4 64.36 7.64 22 7 0 9 -4.83 10.93 22 8 -6 -3 78.25 9.40 22 8 -4 6 213.68 9.82 22 8 -2 8 36.04 11.05 22 9 -6 -4 84.73 9.54 22 9 -1 9 21.77 15.19 22 10 -7 -1 28.12 9.03 22 10 -7 0 2.27 8.81 22 10 -7 1 30.89 9.05 22 10 -6 4 5.91 10.58 22 11 -7 -2 213.58 12.01 22 11 -4 7 20.25 15.06 22 11 -3 8 187.38 16.18 22 12 -7 2 97.81 13.24 22 12 -6 -5 31.94 15.42 22 12 -5 6 -5.21 15.34 22 13 -7 2 -3.27 15.24 22 -3 7 -1 230.10 6.56 22 -3 11 -4 450.13 8.83 22 -3 12 -4 -4.94 6.32 22 -3 13 -4 49.41 7.92 22 -3 14 -4 142.91 8.41 22 -3 18 0 0.81 12.71 22 -2 10 -6 170.60 7.22 22 -2 15 -6 21.83 10.93 22 -1 8 -7 48.51 6.56 22 4 -3 4 7.00 4.16 22 4 7 -11 18.52 12.96 22 7 -6 -1 16.28 5.29 22 7 -6 0 1.47 5.11 22 7 2 10 5.03 10.70 22 8 -3 7 28.80 7.77 22 9 -5 5 98.41 6.92 22 11 -7 1 1.89 7.63 22 11 -6 4 184.76 8.73 22 12 -7 -2 90.96 9.66 22 12 -4 7 5.08 12.56 22 13 -7 -2 -6.59 10.92 22 0 11 8 14.04 24.18 20 0 14 8 4.82 25.52 22 4 -1 -7 29.33 10.96 22 7 -4 -6 3.47 12.44 22 9 -4 -7 -0.69 15.51 22 -1 12 7 40.55 16.08 22 -1 13 7 4.49 16.11 22 0 1 3 -0.54 8.22 22 3 0 -7 -0.71 9.00 22 3 8 10 4.05 18.54 22 -3 7 1 243.67 8.31 23 -3 8 -3 815.14 11.58 23 -3 8 2 323.41 10.04 23 -3 10 -4 286.38 10.03 23 -3 15 -4 12.43 12.99 23 -3 16 3 119.03 13.79 23 -3 17 -3 9.65 15.47 23 -3 17 2 24.26 15.51 23 -2 4 -2 92.36 7.07 23 -2 7 -5 98.82 7.84 23 -1 3 -4 209.44 8.11 23 -1 4 -5 108.32 6.73 23 0 2 -5 -0.38 5.72 23 0 7 -8 59.43 9.27 23 1 7 -9 220.11 11.95 23 2 -1 4 341.51 9.58 23 2 4 8 0.73 8.77 23 2 8 -10 52.81 13.37 23 3 -3 2 316.59 9.08 23 3 -2 4 106.13 6.90 23 3 3 -9 -0.15 8.91 23 4 -4 -2 83.79 7.21 23 4 3 9 2.47 10.69 23 5 -3 5 85.93 7.73 23 5 -1 7 163.80 9.71 23 5 2 9 97.86 11.31 23 5 5 -11 74.59 16.16 23 6 -5 -3 41.68 7.69 23 6 1 9 92.42 11.35 23 6 3 10 24.86 13.16 23 8 -6 2 27.03 7.38 23 9 -6 3 143.79 9.45 23 10 -5 -6 2.23 11.93 23 10 -1 9 49.01 15.89 23 11 -7 -1 5.72 10.71 23 11 -7 0 38.79 10.97 23 12 -7 -1 13.47 12.89 23 12 -7 0 7.60 12.77 23 12 -7 1 28.53 12.86 23 12 -6 4 3.10 13.07 23 13 -7 -1 9.74 15.10 23 13 -7 0 0.16 15.09 23 13 -7 1 5.51 15.20 23 13 -6 4 33.04 15.48 23 -3 7 -2 26.35 4.26 23 -3 16 -4 76.13 11.08 23 -2 9 -6 117.07 6.92 23 0 12 -9 -4.28 11.07 23 2 -2 2 1548.94 18.02 23 4 -4 1 37.86 4.70 23 5 -2 6 126.37 6.23 23 9 -4 6 22.93 7.72 23 9 -2 8 70.93 9.44 23 10 -5 5 241.66 8.93 23 9 -3 -8 149.26 24.68 22 -1 14 7 0.93 18.72 23 1 4 7 44.48 9.57 23 2 0 -6 35.86 9.34 23 5 -4 -4 12.92 9.00 23 8 -5 -5 118.45 11.87 23 -3 9 -4 62.27 7.64 24 -3 9 3 73.28 7.91 24 -1 5 -6 13.45 7.36 24 -1 7 -7 2.97 8.66 24 -1 11 -8 69.66 13.16 24 -1 12 -8 8.26 13.04 24 -1 13 -8 4.78 15.28 24 0 3 -6 527.45 11.22 24 0 11 -9 2.19 15.10 24 1 4 -8 12.27 8.85 24 2 1 6 207.46 9.29 24 2 7 -10 9.63 13.11 24 3 1 7 227.88 9.17 24 3 5 -10 23.41 12.93 24 4 -2 5 866.46 12.28 24 4 0 7 1.84 7.20 24 4 6 10 7.09 13.12 24 5 -4 3 1020.00 11.92 24 6 -5 2 94.16 7.81 24 7 -4 5 -0.22 8.04 24 7 -1 8 114.13 11.30 24 8 -6 -2 21.07 7.46 24 8 -5 4 33.65 8.73 24 8 0 9 -2.55 12.90 24 9 -3 7 16.71 10.90 24 10 -6 -4 1.02 10.83 24 10 -6 3 6.73 10.60 24 11 -5 -6 11.89 13.20 24 -3 12 -5 5.09 7.52 24 -3 13 -5 60.64 7.94 24 -3 14 -5 21.78 9.09 24 -3 17 -4 9.00 12.62 24 -3 17 3 2.50 11.06 24 -2 5 -4 517.01 8.68 24 -2 8 -6 10.36 6.28 24 -1 10 -8 27.31 7.84 24 0 10 -9 -5.15 9.25 24 2 0 5 1.33 4.03 24 4 6 -11 56.56 11.53 24 6 -4 4 38.61 5.41 24 7 -5 3 -0.55 5.06 24 7 -3 6 600.47 9.56 24 7 -2 7 1.56 6.20 24 8 -6 1 326.94 7.45 24 8 2 10 38.50 11.09 24 9 -6 2 188.87 7.48 24 10 -4 6 5.57 7.62 24 10 -2 8 -1.86 9.35 24 11 -6 3 3.85 7.70 24 11 -5 5 22.05 9.01 24 12 -5 5 -0.87 9.36 24 13 -6 3 2.88 10.77 24 13 -5 5 29.25 11.01 24 -1 11 7 25.35 15.74 24 -1 15 7 6.28 22.02 24 2 1 -7 231.25 11.29 24 2 7 9 0.61 13.40 24 3 5 9 253.24 15.05 24 4 0 -8 8.15 10.80 24 -4 12 -1 0.20 8.86 25 -4 12 0 28.01 8.85 25 -4 13 -1 516.92 11.28 25 -4 13 0 -1.59 8.82 25 -4 14 -1 26.18 10.91 25 -4 14 0 90.87 11.13 25 -3 6 -1 767.31 11.45 25 -3 7 -3 7.10 7.19 25 -3 11 -5 24.32 8.83 25 -3 12 4 1.45 8.83 25 -3 13 4 50.09 11.11 25 -3 14 4 149.33 11.89 25 -3 15 -5 17.09 14.16 25 -2 6 -5 3.06 7.07 25 -2 12 -7 183.32 13.45 25 -2 13 -7 0.37 13.01 25 -2 14 -7 64.12 15.57 25 0 1 -4 2358.77 23.60 25 0 4 -7 0.37 7.24 25 0 6 -8 175.25 9.81 25 0 9 -9 3.55 12.81 25 1 6 -9 8.54 10.76 25 1 10 -10 13.55 15.64 25 2 4 -9 153.00 10.13 25 3 -1 5 415.93 9.37 25 3 0 6 159.20 8.64 25 3 1 -8 2.93 8.79 25 4 -4 -1 41.78 6.43 25 4 -4 0 138.79 7.40 25 4 -1 6 16.35 7.30 25 6 0 8 18.88 8.94 25 7 -5 -4 62.71 7.92 25 8 -6 -1 334.61 9.54 25 8 -6 0 229.71 8.73 25 9 -6 -3 153.37 9.88 25 10 -3 7 5.50 12.80 25 11 -6 -4 206.94 12.29 25 11 -4 6 33.21 12.95 25 11 -2 8 40.96 15.65 25 12 -6 -4 9.42 13.08 25 12 -6 3 4.89 12.81 25 12 -5 -6 0.96 15.51 25 13 -6 -4 39.27 15.65 25 -4 11 -1 19.41 6.33 25 -4 11 0 -1.00 6.17 25 -4 12 -2 77.19 6.67 25 -4 13 -2 27.23 6.50 25 -4 14 -2 120.49 8.33 25 -4 15 -1 47.76 9.21 25 -4 15 0 2.88 7.63 25 -3 6 0 0.94 4.19 25 -3 8 -4 146.60 6.27 25 -3 10 -5 81.95 6.71 25 -3 16 -5 126.40 11.49 25 -2 4 -3 81.32 5.20 25 -2 11 -7 10.83 7.61 25 -1 2 -3 4142.21 28.26 25 -1 9 -8 53.86 8.00 25 6 -5 1 51.04 5.52 25 7 1 9 32.99 7.96 25 7 3 10 1.32 10.68 25 8 -4 5 0.63 6.13 25 8 -1 8 0.88 7.72 25 9 -5 4 -2.07 6.30 25 9 0 9 2.83 10.64 25 10 -6 2 44.55 6.50 25 11 -3 7 13.38 10.67 25 12 -4 6 -2.92 10.74 25 12 -3 7 3.46 11.04 25 -2 5 3 289.79 12.62 25 3 9 10 31.86 19.17 25 6 -4 -5 611.04 16.44 25 10 -4 -7 14.20 16.20 25 -4 10 -1 421.16 9.66 26 -4 11 -2 2.60 8.65 26 -4 11 1 27.92 8.90 26 -4 12 1 6.52 8.78 26 -4 13 1 496.76 11.50 26 -4 14 1 32.94 10.89 26 -4 15 -2 5.48 12.79 26 -4 15 1 49.21 12.08 26 -4 16 -1 1.47 13.05 26 -4 16 0 82.77 13.39 26 -3 6 -2 59.87 6.21 26 -3 7 2 26.95 6.03 26 -3 11 4 476.20 12.65 26 -3 15 4 17.82 13.15 26 -3 16 4 83.07 15.68 26 -2 7 -6 46.76 7.50 26 -2 10 -7 220.63 11.57 26 -1 6 -7 1.45 8.65 26 1 9 -10 0.56 15.31 26 2 6 -10 29.01 12.98 26 3 -3 1 2752.83 22.57 26 3 3 8 66.79 9.33 26 4 -3 3 1101.49 13.03 26 4 3 -10 0.45 11.89 26 5 1 8 34.85 8.97 26 5 2 -10 1.12 12.97 26 5 5 10 22.39 13.13 26 6 -5 -2 90.05 7.97 26 6 -3 5 286.58 8.98 26 6 4 10 12.49 13.20 26 9 -6 -2 198.89 9.98 26 9 -6 1 127.55 9.45 26 10 -6 -3 2.55 10.64 26 10 0 9 -6.12 15.64 26 11 -6 2 6.22 10.67 26 13 -6 2 6.28 14.99 26 14 -6 2 8.90 17.71 26 -4 10 0 230.31 7.09 26 -4 12 -3 20.38 6.39 26 -4 13 -3 371.83 9.41 26 -4 14 -3 151.02 8.60 26 -4 16 -2 33.95 9.36 26 -3 9 -5 171.81 7.25 26 0 8 -9 -3.79 7.78 26 3 7 -11 2.57 11.05 26 4 2 8 10.48 6.22 26 6 -5 0 2.54 5.02 26 6 -1 7 5.14 6.13 26 6 2 9 27.54 8.02 26 7 -5 2 24.58 5.33 26 8 -5 3 210.18 6.68 26 8 -3 6 4.39 6.26 26 8 -2 7 59.54 7.89 26 10 -5 4 161.50 8.34 26 12 -6 2 -1.41 8.99 26 -2 8 5 9.30 10.42 26 0 3 5 1.26 8.02 26 -2 12 6 218.00 15.24 26 -2 13 6 91.94 16.57 26 -2 14 6 61.66 16.48 26 1 1 -6 1.99 8.88 26 2 2 -8 9.20 10.74 26 5 4 -11 51.00 19.42 26 6 3 -11 96.11 19.75 26 -4 10 -2 0.07 7.32 27 -4 11 -3 71.49 9.09 27 -4 13 2 28.27 9.12 27 -4 14 2 133.57 11.53 27 -4 15 -3 47.37 13.04 27 -4 16 -3 17.17 15.22 27 -4 16 1 -3.49 13.14 27 -4 17 -2 14.69 15.55 27 -4 17 -1 7.54 15.42 27 -4 17 0 0.53 15.34 27 -3 6 1 841.27 13.17 27 -3 7 -4 210.78 8.44 27 -3 8 3 858.95 14.64 27 -3 10 4 280.88 11.43 27 -3 12 -6 6.26 10.82 27 -3 13 -6 6.33 12.84 27 -3 14 -6 38.95 13.31 27 -3 15 -6 93.10 15.64 27 -2 9 -7 34.95 9.02 27 -1 8 -8 -1.06 10.79 27 1 -1 1 69.90 8.96 27 1 2 -7 42.75 7.76 27 1 8 -10 100.47 13.77 27 3 4 -10 32.35 11.23 27 4 4 9 30.47 10.93 27 4 5 -11 -1.40 15.59 27 4 7 10 35.57 13.50 27 5 -4 2 11.62 5.68 27 5 -3 4 8.80 7.19 27 5 3 9 -1.61 10.88 27 6 -5 -1 63.00 7.71 27 6 -2 6 68.72 7.66 27 7 -4 4 482.76 9.81 27 8 1 9 2.46 13.09 27 9 -6 -1 123.78 9.55 27 9 -6 0 2.32 8.75 27 9 -5 -5 111.62 10.05 27 9 -4 5 87.69 9.21 27 9 -1 8 9.08 12.94 27 10 -6 1 14.07 8.88 27 11 -6 -3 8.54 10.90 27 11 -5 4 4.90 10.86 27 11 -4 -7 5.47 15.57 27 12 -6 -3 9.72 12.96 27 12 -5 4 34.38 12.96 27 13 -6 -3 0.87 15.30 27 13 -6 1 2.42 13.09 27 13 -5 4 0.73 15.20 27 14 -6 -2 -6.04 17.96 27 14 -6 1 -1.43 15.59 27 -4 9 -1 83.30 5.81 27 -4 10 1 398.71 8.47 27 -3 6 -3 210.60 6.18 27 -3 11 -6 200.98 8.58 27 2 -2 1 60.28 6.72 27 6 -4 3 101.72 5.96 27 7 0 8 223.05 8.93 27 8 3 10 31.71 11.29 27 11 -6 1 -1.15 7.60 27 12 -6 1 45.95 7.98 27 14 -6 -1 2.91 11.04 27 14 -6 0 0.19 11.11 27 10 -2 -9 53.71 32.07 25 8 0 -10 96.14 28.09 26 10 -3 -8 3.22 21.54 27 -2 4 2 97.46 9.39 27 -2 15 6 25.71 19.02 27 0 2 4 7.67 7.56 27 3 -3 -2 329.32 12.77 27 6 1 -10 10.53 16.13 27 12 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172 -2 7 -11 -0.49 15.65 172 -2 10 -9 10.66 13.02 172 -1 -9 -5 70.64 8.06 172 -1 -9 -4 7.38 7.32 172 -1 2 -11 23.38 13.07 172 -1 5 1 52.60 7.01 172 -1 6 -10 89.63 13.28 172 -1 7 0 514.83 10.27 172 -1 10 -5 207.20 9.64 172 -1 10 -4 41.20 7.42 172 0 -6 -3 -0.19 5.77 172 0 3 -9 -2.82 8.82 172 0 7 -6 250.16 8.80 172 1 1 -4 326.50 10.77 172 1 2 -5 333.08 9.69 172 -9 -11 5 28.35 10.82 172 -8 -10 5 328.48 9.47 172 -7 -6 6 31.02 6.45 172 -6 16 -2 16.93 10.96 172 -5 -14 -1 24.32 7.81 172 -5 -10 3 0.72 6.20 172 -5 12 2 98.27 7.11 172 -4 -10 2 -0.51 5.09 172 -4 -6 4 64.45 5.74 172 -4 14 -7 4.36 10.85 172 -4 14 -2 127.26 8.29 172 -3 -12 -2 10.13 6.27 172 -3 -6 3 210.06 6.29 172 -3 13 -6 9.84 9.00 172 -3 13 -3 11.05 7.47 172 -2 11 -2 230.01 6.84 172 -1 9 -2 74.20 5.72 172 0 5 -8 136.54 7.26 172 0 6 -2 148.30 5.85 172 0 7 -4 523.01 9.03 172 -6 8 5 5.01 10.67 172 -2 -10 -8 5.71 13.59 172 -2 -3 -12 23.55 22.14 172 -1 -1 -11 10.53 15.93 172 0 -2 -9 0.47 10.80 172 1 0 -4 17.58 7.67 172 -10 -7 7 3.39 15.13 173 -10 0 8 2.89 13.15 173 -9 -14 3 -8.18 18.04 173 -9 -9 6 3.41 13.02 173 -9 -6 7 30.94 12.99 173 -8 -12 4 10.78 12.98 173 -8 -4 7 24.01 10.88 173 -7 -11 4 87.14 11.02 173 -7 -9 5 169.93 11.34 173 -7 14 2 37.13 13.32 173 -7 15 1 13.90 15.15 173 -6 -15 -1 2.20 13.18 173 -6 -4 6 11.08 8.86 173 -6 13 2 20.63 10.98 173 -6 14 1 18.11 11.92 173 -5 -15 -5 6.80 15.65 173 -5 -15 -4 3.92 15.29 173 -5 13 1 69.86 11.03 173 -5 15 -2 27.21 13.03 173 -4 -14 -5 19.10 13.25 173 -4 -14 -4 5.95 12.83 173 -4 -13 -8 7.74 18.19 173 -4 -13 -1 502.47 11.23 173 -4 0 5 0.40 7.14 173 -3 -2 4 110.87 7.37 173 -3 10 1 3.59 7.26 173 -3 12 -8 -3.45 15.02 173 -3 12 -1 130.29 9.41 173 -3 13 -5 64.49 11.15 173 -3 13 -4 49.77 10.94 173 -2 -11 -6 47.44 11.07 173 -2 -11 -3 3.37 8.81 173 -2 -9 0 3.54 7.12 173 -2 3 -12 28.43 17.96 173 -2 6 2 1.31 5.80 173 -2 8 1 102.51 6.82 173 -2 11 -7 4.99 10.82 173 -1 -9 -6 88.24 9.76 173 -1 -9 -3 3.38 7.22 173 -1 0 -11 1.16 12.95 173 -1 1 -11 11.79 12.94 173 -1 5 -10 58.70 11.25 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8.71 174 -6 10 4 24.17 9.13 174 -5 -13 1 60.59 11.05 174 -5 -6 5 198.63 8.59 174 -5 15 -5 7.99 15.29 174 -5 15 -4 -1.32 15.09 174 -5 15 -3 4.17 13.00 174 -4 -14 -6 0.10 15.33 174 -4 -14 -3 172.22 11.76 174 -4 -2 5 879.71 14.06 174 -4 13 -8 11.51 17.66 174 -4 13 -1 502.34 11.25 174 -4 14 -5 21.20 13.04 174 -4 14 -4 6.24 12.65 174 -3 -13 -5 63.99 11.32 174 -3 -13 -4 48.41 11.05 174 -3 -10 1 -0.17 7.24 174 -3 -3 4 0.72 5.74 174 -3 10 -10 41.90 18.02 174 -3 11 -9 -2.36 15.43 174 -2 -8 1 108.70 6.58 174 -2 -6 2 3.45 5.78 174 -2 2 -12 41.81 15.83 174 -2 6 -11 39.91 15.46 174 -2 9 -9 9.27 12.91 174 -2 9 0 -0.25 7.17 174 -2 10 -8 3.42 10.92 174 -2 10 -1 95.38 7.78 174 -2 11 -6 45.83 10.84 174 -2 11 -3 1.61 8.70 174 -1 -8 -1 134.06 7.05 174 -1 9 -6 98.63 9.15 174 -1 9 -3 2.89 7.19 174 0 0 -9 0.13 8.71 174 0 1 -9 1.03 8.75 174 0 4 -8 8.75 8.74 174 0 4 -1 -0.98 6.95 174 -8 -15 2 41.57 11.13 174 -7 -15 1 13.96 10.66 174 -7 -13 3 22.81 9.06 174 -7 -7 6 58.23 6.59 174 -6 -12 3 15.12 7.60 174 -6 15 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175 -4 -12 1 13.21 8.66 175 -4 -7 4 114.82 7.92 175 -4 10 2 -0.16 7.23 175 -4 12 0 26.75 8.85 175 -3 -13 -6 8.66 12.96 175 -3 -13 -3 13.98 10.75 175 -3 -9 2 139.41 8.06 175 -3 -7 3 5.26 7.17 175 -2 -11 -7 8.19 11.03 175 -2 -11 -2 257.04 8.93 175 -2 -3 3 1969.52 19.48 175 -2 1 -12 1.10 15.57 175 -1 -9 -2 76.24 7.83 175 -1 -7 0 534.28 10.14 175 -1 -5 1 56.05 6.85 175 -1 4 -10 0.05 10.83 175 -1 6 -9 8.58 10.72 175 -1 8 -7 51.31 9.00 175 0 5 -7 -0.74 7.17 175 0 5 -2 1772.14 16.96 175 0 6 -5 0.29 7.17 175 -8 -9 6 6.90 8.96 175 -7 -12 4 56.62 8.04 175 -7 15 0 -0.93 10.72 175 -7 16 -2 15.28 12.62 175 -5 -11 3 7.79 6.28 175 -4 -13 0 1.07 6.26 175 -4 -11 2 -3.48 6.20 175 -4 -3 5 224.33 7.60 175 -4 13 -7 3.77 10.59 175 -3 12 -6 5.51 7.57 175 -2 5 -11 47.99 10.78 175 -2 7 -10 7.10 9.18 175 -2 10 -7 186.68 8.59 175 -1 7 -8 2.91 6.31 175 -1 8 -2 618.85 9.48 175 0 -6 -2 140.11 6.66 175 0 6 -4 138.17 5.55 175 -2 -8 -10 42.20 23.67 174 -8 8 6 1.60 15.21 175 -1 -8 -8 -0.05 15.28 175 -9 9 6 1.65 15.99 175 -7 9 5 142.94 14.53 175 -2 -1 -12 1.82 19.01 175 -2 0 -12 3.89 19.13 175 0 -7 -5 0.15 8.87 175 0 -7 -4 602.09 14.63 175 -10 -4 8 12.24 15.22 176 -9 11 5 31.67 15.33 176 -8 -13 4 -8.68 15.19 176 -8 -6 7 276.03 12.35 176 -8 13 3 28.95 13.32 176 -8 15 1 16.18 15.43 176 -7 -2 7 -1.23 8.82 176 -7 1 7 62.64 9.69 176 -6 -16 -1 3.63 15.37 176 -6 -11 4 10.95 10.67 176 -6 -9 5 32.98 8.97 176 -6 14 0 268.65 12.02 176 -6 15 -2 -0.15 13.17 176 -5 -15 -1 33.26 12.90 176 -5 -7 5 99.87 7.91 176 -5 13 0 11.57 10.68 176 -5 14 -2 56.15 11.13 176 -4 11 1 23.48 8.94 176 -4 13 -2 28.23 9.95 176 -3 -13 -2 32.96 9.07 176 -3 -4 4 275.99 8.33 176 -3 6 3 200.42 9.22 176 -3 8 2 305.60 9.94 176 -3 9 -10 27.82 15.47 176 -3 10 -9 34.08 14.21 176 -3 11 -8 87.07 13.29 176 -3 12 -5 0.71 10.64 176 -3 12 -4 -1.98 8.75 176 -3 12 -3 12.56 8.69 176 -2 10 -2 125.82 7.96 176 -1 -9 -7 421.12 13.50 176 -1 3 -10 49.75 11.15 176 -1 4 1 2561.50 27.47 176 -1 6 0 2.20 5.84 176 0 3 -8 7.47 8.70 176 -8 14 2 -1.16 10.71 176 -7 -8 6 89.26 8.08 176 -7 -3 7 36.83 6.64 176 -6 -6 6 80.18 6.69 176 -4 -14 -1 27.93 7.75 176 -4 13 -6 21.80 9.20 176 -3 11 -1 275.58 7.15 176 -2 -12 -4 250.54 8.28 176 -2 -10 0 316.84 7.58 176 -2 -7 2 292.72 6.99 176 -2 8 -9 2.96 7.73 176 -2 9 -8 96.44 8.15 176 -2 10 -6 170.25 7.24 176 -1 -10 -4 35.94 5.54 176 -1 7 -1 453.91 8.57 176 -1 8 -6 5.21 6.23 176 0 -5 -1 1.88 4.34 176 -4 2 5 908.80 23.83 176 -8 10 5 307.65 15.90 176 -5 8 4 32.42 9.23 176 -4 6 4 65.15 9.97 176 -10 -9 7 10.17 17.86 177 -10 -5 8 5.31 15.32 177 -9 -8 7 3.88 13.15 177 -9 -1 8 12.26 12.95 177 -7 -15 2 20.72 15.36 177 -7 -14 3 88.47 13.34 177 -7 12 3 30.30 11.08 177 -7 14 1 31.91 12.97 177 -6 -15 1 8.66 13.14 177 -6 -14 2 3.06 12.84 177 -6 11 3 15.86 8.98 177 -6 13 1 26.18 10.96 177 -6 15 -5 2.89 17.80 177 -6 15 -4 9.90 15.47 177 -6 15 -3 6.36 15.08 177 -5 -16 -4 10.75 17.03 177 -5 -16 -3 4.92 15.57 177 -5 -14 1 22.76 10.89 177 -5 -13 2 34.76 11.01 177 -5 -10 4 41.78 8.94 177 -5 -1 6 27.71 7.56 177 -5 11 2 563.53 12.16 177 -5 12 1 12.92 8.97 177 -5 14 -6 -0.15 15.25 177 -5 14 -3 5.94 12.68 177 -4 -15 -5 -2.26 15.50 177 -4 -15 -4 11.29 13.21 177 -4 -10 3 0.66 7.97 177 -4 -8 4 291.88 9.09 177 -4 -4 5 100.70 7.96 177 -4 12 -8 -2.97 15.26 177 -4 13 -5 72.65 11.15 177 -4 13 -4 2.67 10.76 177 -4 13 -3 407.03 12.32 177 -3 -13 -7 16.01 13.49 177 -3 -12 0 2.39 8.71 177 -3 -11 1 306.77 8.99 177 -3 7 -11 -2.39 16.71 177 -2 -12 -5 331.08 12.75 177 -2 -12 -3 75.91 9.17 177 -2 -11 -1 147.06 8.20 177 -2 -9 1 969.20 12.35 177 -2 -4 3 90.71 6.91 177 -2 4 -11 8.19 13.21 177 -2 7 1 281.86 8.74 177 -2 10 -3 0.58 7.21 177 -1 -10 -5 209.34 10.47 177 -1 -10 -3 0.38 7.31 177 -1 5 -9 6.58 10.65 177 -1 8 -3 282.04 8.88 177 0 -7 -3 0.66 5.70 177 0 -2 0 414.95 15.30 177 0 2 -8 469.28 12.18 177 0 4 -7 -0.33 7.24 177 0 5 -6 232.12 8.89 177 -9 -11 6 8.44 10.93 177 -8 -12 5 -0.65 10.71 177 -8 -10 6 2.11 9.29 177 -7 -16 1 14.96 12.53 177 -7 -11 5 43.06 7.92 177 -7 -4 7 13.77 6.27 177 -7 13 2 17.39 7.83 177 -7 15 -1 8.75 10.78 177 -6 -13 3 81.93 8.02 177 -5 14 -5 14.78 9.17 177 -5 14 -4 3.58 9.09 177 -4 -15 -3 42.37 9.33 177 -4 11 -9 -1.03 10.98 177 -3 -8 3 795.16 10.26 177 -3 -5 4 48.33 5.56 177 -3 9 1 230.45 7.32 177 -3 10 0 -1.05 5.13 177 -3 11 -7 42.18 7.97 177 -2 6 -10 24.49 9.20 177 -2 9 -1 876.60 10.78 177 -2 10 -5 37.96 6.45 177 -2 10 -4 2.62 5.10 177 -1 -6 1 6.21 4.29 177 -1 7 -7 1.53 6.17 177 -1 8 -5 454.29 8.18 177 -1 8 -4 37.88 5.41 177 0 5 -3 0.69 4.09 177 ; _shelx_hkl_checksum 37020 _shelx_res_file ; ip1-1956.res created by SHELXL-2014/7 TITL ip1956 in Pccn CELL 0.71073 11.5094 13.9839 9.4247 90.000 90.000 90.000 ZERR 4.00 0.0009 0.0008 0.0005 0.000 0.000 0.000 LATT 1 SYMM 1/2 - X, 1/2 - Y, Z SYMM 1/2 + X, - Y, 1/2 - Z SYMM - X, 1/2 + Y, 1/2 - Z SFAC C H LI N O UNIT 24 32 8 32 48 MERG 2 OMIT 4 4 0 SADI 0.01 H1 H2A H1 H2B SADI 0.01 O5 H1 O5 H2A O5 H2B EQIV $1 0.5-X, Y, 0.5+Z EQIV $2 1-X, 0.5+Y, 0.5-Z EQIV $3 1.5-X, Y, 0.5+Z EQIV $4 X, 0.5-Y, -0.5+Z EQIV $5 1.5-X, 0.5-Y, Z EQIV $6 1.5-X, Y, -0.5+Z RTAB H..O H1 O4_$1 RTAB H..O H2A O2_$2 RTAB H..O H2B O6_$3 RTAB H..O H3 O1_$4 RTAB H..O H4A O6_$5 RTAB H..O H4B O5_$6 RTAB O..O O5 O4_$1 RTAB O..O O5 O2_$2 RTAB O..O O5 O6_$3 RTAB O..O O6 O1_$4 RTAB O..O O6 O6_$5 RTAB O..O O6 O5_$6 RTAB XHY O5 H1 O4_$1 RTAB XHY O5 H2A O2_$2 RTAB XHY O5 H2B O6_$3 RTAB XHY O6 H3 O1_$4 RTAB XHY O6 H4A O6_$5 RTAB XHY O6 H4B O5_$6 FREE LI1 H2A FREE LI1 H2B FMAP 2 PLAN 8 SIZE 0.20 0.22 0.25 ACTA BOND BOND $H CONF LIST 4 L.S. 6 TEMP -60.00 WGHT 0.045500 FVAR 0.61171 LI1 3 0.623800 0.422887 0.085875 11.00000 0.02327 0.02558 = 0.02852 0.00423 0.00055 -0.00038 O1 5 0.574653 0.251732 0.186681 11.00000 0.02331 0.04305 = 0.05404 0.01132 -0.01342 -0.00062 O2 5 0.423238 0.163198 0.218077 11.00000 0.04391 0.02334 = 0.03973 0.01324 -0.00545 -0.00570 O3 5 0.174282 0.505514 -0.119381 11.00000 0.03294 0.02639 = 0.04312 0.01327 -0.00589 0.00139 O4 5 0.084998 0.370551 -0.089880 11.00000 0.02185 0.03578 = 0.04057 0.00586 -0.01094 -0.00754 O5 5 0.624031 0.452296 0.293408 11.00000 0.03706 0.03742 = 0.02638 0.00356 -0.00172 -0.00905 O6 5 0.697036 0.344267 -0.071111 11.00000 0.03359 0.03799 = 0.03685 -0.00946 -0.00072 0.00569 N1 4 0.448460 0.388140 0.063625 11.00000 0.01950 0.01765 = 0.02177 0.00197 -0.00245 -0.00269 N2 4 0.366017 0.439471 -0.000295 11.00000 0.01901 0.01864 = 0.01971 0.00141 0.00029 -0.00322 N3 4 0.471071 0.233911 0.169493 11.00000 0.02568 0.02211 = 0.02292 0.00160 -0.00383 -0.00161 N4 4 0.171201 0.422439 -0.077655 11.00000 0.02067 0.02256 = 0.02041 0.00156 -0.00125 -0.00099 C1 1 0.402592 0.301643 0.091984 11.00000 0.01867 0.01781 = 0.01949 0.00144 -0.00114 -0.00281 C2 1 0.288238 0.291803 0.046269 11.00000 0.01842 0.01777 = 0.01672 -0.00131 0.00077 -0.00260 C3 1 0.271711 0.383244 -0.010213 11.00000 0.01766 0.01828 = 0.01742 -0.00069 -0.00059 -0.00215 H1 2 0.558418 0.431749 0.327303 11.00000 0.07136 H2A 2 0.607837 0.513304 0.288558 10.50000 0.06359 H2B 2 0.671006 0.409327 0.326490 10.50000 0.04686 H3 2 0.650749 0.334853 -0.135792 11.00000 0.08902 H4A 2 0.724134 0.283830 -0.053350 10.50000 0.06230 H4B 2 0.749351 0.390420 -0.107737 10.50000 0.08108 HKLF 4 REM ip1956 in Pccn REM R1 = 0.0299 for 1225 Fo > 4sig(Fo) and 0.0468 for all 1817 data REM 151 parameters refined using 4 restraints END WGHT 0.0455 0.0000 REM Highest difference peak 0.278, deepest hole -0.136, 1-sigma level 0.045 Q1 1 0.3579 0.2846 0.0438 11.00000 0.05 0.28 Q2 1 0.2761 0.3322 -0.0065 11.00000 0.05 0.27 Q3 1 0.3408 0.2961 0.0910 11.00000 0.05 0.26 Q4 1 0.4378 0.2683 0.1116 11.00000 0.05 0.24 Q5 1 0.4254 0.3412 0.0894 11.00000 0.05 0.21 Q6 1 0.3018 0.4152 0.0250 11.00000 0.05 0.20 Q7 1 0.2500 0.2500 0.0453 10.50000 0.05 0.19 Q8 1 0.2395 0.3886 -0.0585 11.00000 0.05 0.19 ; _shelx_res_checksum 82069 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, -y+1/2, z' 'x+1/2, -y, -z+1/2' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, y-1/2, -z' '-x-1/2, y, z-1/2' 'x, -y-1/2, z-1/2' loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Li Li1 0.62380(18) 0.42289(16) 0.0859(2) 0.0258(5) Uani d 1 . . O O1 0.57465(8) 0.25173(7) 0.18668(12) 0.0401(3) Uani d 1 . . O O2 0.42324(9) 0.16320(7) 0.21808(12) 0.0357(3) Uani d 1 . . O O3 0.17428(9) 0.50551(7) -0.11938(11) 0.0341(3) Uani d 1 . . O O4 0.08500(8) 0.37055(7) -0.08988(11) 0.0327(3) Uani d 1 . . O O5 0.62403(9) 0.45230(8) 0.29341(11) 0.0336(3) Uani d 1 . . O O6 0.69704(11) 0.34427(9) -0.07111(14) 0.0361(3) Uani d 1 . . N N1 0.44846(8) 0.38814(7) 0.06362(11) 0.0196(2) Uani d 1 . . N N2 0.36602(8) 0.43947(7) -0.00029(12) 0.0191(2) Uani d 1 . . N N3 0.47107(9) 0.23391(7) 0.16949(12) 0.0236(3) Uani d 1 . . N N4 0.17120(9) 0.42244(8) -0.07765(11) 0.0212(2) Uani d 1 . . C C1 0.40259(10) 0.30164(9) 0.09198(13) 0.0187(3) Uani d 1 . . C C2 0.28824(10) 0.29180(9) 0.04627(13) 0.0176(3) Uani d 1 . . C C3 0.27171(10) 0.38324(8) -0.01021(13) 0.0178(3) Uani d 1 . . H H1 0.5584(14) 0.4317(13) 0.327(2) 0.071(7) Uiso d 1 . . H H2A 0.608(3) 0.5133(13) 0.289(4) 0.064(13) Uiso d 0.5 . . H H2B 0.671(2) 0.409(2) 0.326(4) 0.047(10) Uiso d 0.5 . . H H3 0.651(2) 0.3349(17) -0.136(3) 0.089(9) Uiso d 1 . . H H4A 0.724(4) 0.284(3) -0.053(4) 0.062(13) Uiso d 0.5 . . H H4B 0.749(4) 0.390(3) -0.108(5) 0.081(15) Uiso d 0.5 . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Li1 0.0233(10) 0.0256(12) 0.0285(13) -0.0004(9) 0.0005(9) 0.0042(10) O1 0.0233(5) 0.0431(6) 0.0540(7) -0.0006(4) -0.0134(5) 0.0113(5) O2 0.0439(6) 0.0233(5) 0.0397(6) -0.0057(4) -0.0055(5) 0.0132(4) O3 0.0329(5) 0.0264(5) 0.0431(7) 0.0014(4) -0.0059(4) 0.0133(5) O4 0.0219(5) 0.0358(6) 0.0406(6) -0.0075(4) -0.0109(4) 0.0059(5) O5 0.0371(6) 0.0374(7) 0.0264(6) -0.0090(5) -0.0017(5) 0.0036(5) O6 0.0336(6) 0.0380(7) 0.0369(7) 0.0057(5) -0.0007(5) -0.0095(5) N1 0.0195(5) 0.0176(5) 0.0218(6) -0.0027(4) -0.0024(4) 0.0020(4) N2 0.0190(5) 0.0186(5) 0.0197(5) -0.0032(4) 0.0003(4) 0.0014(4) N3 0.0257(6) 0.0221(6) 0.0229(6) -0.0016(4) -0.0038(5) 0.0016(5) N4 0.0207(5) 0.0226(6) 0.0204(6) -0.0010(4) -0.0013(4) 0.0016(5) C1 0.0187(6) 0.0178(6) 0.0195(6) -0.0028(5) -0.0011(5) 0.0014(5) C2 0.0184(6) 0.0178(6) 0.0167(6) -0.0026(5) 0.0008(5) -0.0013(5) C3 0.0177(6) 0.0183(6) 0.0174(6) -0.0021(5) -0.0006(5) -0.0007(5) 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' Li Li -0.0003 0.0001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag O5 Li1 O6 . . 145.63(13) y O5 Li1 N1 . . 98.49(10) y O6 Li1 N1 . . 101.69(11) y O5 Li1 N2 . 5_665 100.84(11) y O6 Li1 N2 . 5_665 101.22(11) y N1 Li1 N2 . 5_665 103.29(10) y O5 Li1 O3 . 5_665 78.28(8) y O6 Li1 O3 . 5_665 85.66(8) y N1 Li1 O3 . 5_665 170.20(11) y N2 Li1 O3 5_665 5_665 68.60(7) y O5 Li1 O1 . . 80.47(8) y O6 Li1 O1 . . 81.94(9) y N1 Li1 O1 . . 67.50(7) y N2 Li1 O1 5_665 . 170.76(11) y O3 Li1 O1 5_665 . 120.49(9) y N3 O1 Li1 . . 110.17(9) n N4 O3 Li1 . 5_665 111.00(9) n Li1 O5 H1 . . 106.9(14) n Li1 O5 H2A . . 99(3) n H1 O5 H2A . . 99.0(19) n Li1 O5 H2B . . 102(2) n H1 O5 H2B . . 100.4(19) n Li1 O6 H3 . . 111.1(18) n Li1 O6 H4A . . 121(2) n H3 O6 H4A . . 102(3) n Li1 O6 H4B . . 99(3) n H3 O6 H4B . . 105(3) n N2 N1 C1 . . 107.11(9) n N2 N1 Li1 . . 127.46(10) n C1 N1 Li1 . . 124.64(10) n N1 N2 C3 . . 106.93(9) n N1 N2 Li1 . 5_665 129.06(9) n C3 N2 Li1 . 5_665 123.87(10) n O2 N3 O1 . . 123.53(11) n O2 N3 C1 . . 118.60(10) n O1 N3 C1 . . 117.84(10) n O3 N4 O4 . . 123.35(11) n O3 N4 C3 . . 118.83(10) n O4 N4 C3 . . 117.81(10) n N1 C1 C2 . . 113.46(11) n N1 C1 N3 . . 118.65(10) n C2 C1 N3 . . 127.80(11) n C1 C2 C3 . . 98.98(10) n C1 C2 C2 . 2 130.38(13) n C3 C2 C2 . 2 130.46(12) n N2 C3 C2 . . 113.51(10) n N2 C3 N4 . . 117.41(10) n C2 C3 N4 . . 129.07(10) n loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Li1 O5 . 1.999(3) y Li1 O6 . 2.027(3) y Li1 N1 . 2.086(2) y Li1 N2 5_665 2.090(2) y Li1 O3 5_665 2.550(2) y Li1 O1 . 2.636(2) y O1 N3 . 1.2287(14) n O2 N3 . 1.2209(14) n O3 N4 . 1.2270(14) n O3 Li1 5_665 2.550(2) n O4 N4 . 1.2346(13) n O5 H1 . 0.869(15) n O5 H2A . 0.874(17) n O5 H2B . 0.866(17) n O6 H3 . 0.82(3) n O6 H4A . 0.92(4) n O6 H4B . 0.95(5) n N1 N2 . 1.3336(14) n N1 C1 . 1.3465(16) n N2 C3 . 1.3435(15) n N2 Li1 5_665 2.090(2) n N3 C1 . 1.4324(16) n N4 C3 . 1.4292(16) n C1 C2 . 1.3917(16) n C2 C3 . 1.3981(17) n C2 C2 2 1.463(2) n loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_site_symmetry_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_publ_flag O5 H1 O4 7_656 0.869(15) 2.017(16) 2.8818(14) 173.8(17) yes O5 H2A O2 4_655 0.874(17) 2.127(17) 3.0010(15) 177(4) yes O5 H2B O6 7_756 0.866(17) 2.02(2) 2.8555(17) 163(3) yes O6 H3 O1 8_565 0.82(3) 2.24(3) 2.9995(17) 153(2) yes O6 H4A O6 2_655 0.92(4) 2.01(4) 2.905(2) 163(4) yes O6 H4B O5 7_755 0.95(5) 1.93(5) 2.8555(17) 164(4) yes loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion _geom_torsion_publ_flag C1 N1 N2 C3 . . . . -0.25(13) n Li1 N1 N2 C3 . . . . 169.92(12) n C1 N1 N2 Li1 . . . 5_665 -176.01(12) n Li1 N1 N2 Li1 . . . 5_665 -5.8(2) n Li1 O1 N3 O2 . . . . -173.04(11) n Li1 O1 N3 C1 . . . . 4.91(15) n Li1 O3 N4 O4 5_665 . . . -175.74(11) n Li1 O3 N4 C3 5_665 . . . 4.81(14) n N2 N1 C1 C2 . . . . 0.78(14) n Li1 N1 C1 C2 . . . . -169.73(11) n N2 N1 C1 N3 . . . . -175.99(10) n Li1 N1 C1 N3 . . . . 13.49(18) n O2 N3 C1 N1 . . . . 166.52(12) n O1 N3 C1 N1 . . . . -11.53(18) n O2 N3 C1 C2 . . . . -9.7(2) n O1 N3 C1 C2 . . . . 172.21(13) n N1 C1 C2 C3 . . . . -0.92(14) n N3 C1 C2 C3 . . . . 175.50(12) n N1 C1 C2 C2 . . . 2 174.43(9) n N3 C1 C2 C2 . . . 2 -9.15(19) n N1 N2 C3 C2 . . . . -0.36(14) n Li1 N2 C3 C2 5_665 . . . 175.68(11) n N1 N2 C3 N4 . . . . -179.10(11) n Li1 N2 C3 N4 5_665 . . . -3.07(17) n C1 C2 C3 N2 . . . . 0.76(14) n C2 C2 C3 N2 2 . . . -174.58(10) n C1 C2 C3 N4 . . . . 179.32(13) n C2 C2 C3 N4 2 . . . 4.0(2) n O3 N4 C3 N2 . . . . -2.02(17) n O4 N4 C3 N2 . . . . 178.50(11) n O3 N4 C3 C2 . . . . 179.46(12) n O4 N4 C3 C2 . . . . 0.0(2) n _cod_database_fobs_code 2022779