#------------------------------------------------------------------------------ #$Date: 2022-11-08 19:20:59 +0000 (Tue, 08 Nov 2022) $ #$Revision: 279106 $ #$URL: svn://www.crystallography.net/cod/cif/2/24/42/2244204.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_2244204 loop_ _publ_author_name 'Banna, Md. Hasan Al' 'Howlader, Md. Belayet Hossain' 'Miyatake, Ryuta' 'Sheikh, Md. Chanmiya' 'Zangrando, Ennio' _publ_section_title ; Crystal structure of bis{4-[(4-methylbenzyl)oxy]-N'-(4-methylbenzylidene)benzohydrazidato}nickel(II) ; _journal_coeditor_code WM5661 _journal_issue 10 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first 1081 _journal_page_last 1083 _journal_paper_doi 10.1107/S2056989022009392 _journal_volume 78 _journal_year 2022 _chemical_formula_iupac '[Ni (C23 H21 N2 O2)2]' _chemical_formula_moiety 'C46 H42 N4 Ni O4' _chemical_formula_sum 'C46 H42 N4 Ni O4' _chemical_formula_weight 773.54 _chemical_name_systematic Bis{4-[(4-methylbenzyl)oxy]-N'-(4-methylbenzylidene)benzohydrazidato}nickel(II) _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _atom_sites_solution_hydrogens geom _audit_creation_method SHELXL-2019/2 _cell_angle_alpha 68.441(5) _cell_angle_beta 83.739(6) _cell_angle_gamma 88.032(6) _cell_formula_units_Z 1 _cell_length_a 4.6914(2) _cell_length_b 13.0677(7) _cell_length_c 16.9923(8) _cell_measurement_reflns_used 8457 _cell_measurement_temperature 173(2) _cell_measurement_theta_max 27.46 _cell_measurement_theta_min 1.70 _cell_volume 963.05(9) _computing_cell_refinement ; CrystalStructure (Rigaku, 2018) ; _computing_data_collection ; CrystalStructure (Rigaku, 2018) ; _computing_data_reduction ; CrystalStructure (Rigaku, 2018) ; _computing_molecular_graphics ; DIAMOND (Brandenburg, 1999) ; _computing_publication_material ; WinGX (Farrugia, 2012) ; _computing_structure_refinement ; SHELXL (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXT (Sheldrick, 2015a) ; _diffrn_ambient_temperature 173(2) _diffrn_detector_area_resol_mean 10.000 _diffrn_measured_fraction_theta_full 0.997 _diffrn_measured_fraction_theta_max 0.996 _diffrn_measurement_device_type 'Rigaku R-AXIS RAPID' _diffrn_measurement_method \w _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71075 _diffrn_reflns_av_R_equivalents 0.0242 _diffrn_reflns_av_unetI/netI 0.0330 _diffrn_reflns_limit_h_max 5 _diffrn_reflns_limit_h_min -6 _diffrn_reflns_limit_k_max 16 _diffrn_reflns_limit_k_min -16 _diffrn_reflns_limit_l_max 22 _diffrn_reflns_limit_l_min -22 _diffrn_reflns_number 9456 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.463 _diffrn_reflns_theta_min 2.465 _exptl_absorpt_coefficient_mu 0.554 _exptl_absorpt_correction_T_max 0.984 _exptl_absorpt_correction_T_min 0.761 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (ABSCOR; Rigaku, 1995) ; _exptl_crystal_colour orange _exptl_crystal_density_diffrn 1.334 _exptl_crystal_description platelet _exptl_crystal_F_000 406 _exptl_crystal_size_max 0.320 _exptl_crystal_size_mid 0.080 _exptl_crystal_size_min 0.030 _refine_diff_density_max 0.415 _refine_diff_density_min -0.187 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.063 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 252 _refine_ls_number_reflns 4375 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.063 _refine_ls_R_factor_all 0.0447 _refine_ls_R_factor_gt 0.0367 _refine_ls_shift/su_max 0.006 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0564P)^2^+0.1727P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0924 _refine_ls_wR_factor_ref 0.0963 _reflns_number_gt 3883 _reflns_number_total 4375 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file wm5661sup1.cif _cod_data_source_block I _cod_database_code 2244204 _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 0.843 _shelx_estimated_absorpt_t_max 0.984 _shelx_hkl_file ; 0 0 2 1007.39 16.91 0 0 -2 1037.23 17.21 0 0 3 168.50 1.75 0 0 -3 163.71 1.68 0 0 4 10.73 0.30 0 0 -4 9.61 0.27 0 0 5 439.05 6.10 0 0 -5 432.24 6.08 0 0 6 8.01 0.34 0 0 -6 7.11 0.29 0 0 7 134.59 1.78 0 0 -7 136.78 1.88 0 0 8 187.96 2.56 0 0 -8 179.68 2.40 0 0 9 4.73 0.39 0 0 -9 5.34 0.51 0 0 10 5.58 0.44 0 0 -10 6.32 0.38 0 0 11 40.54 1.49 0 0 11 38.41 1.16 0 0 12 35.70 1.61 0 0 12 38.07 0.93 0 0 -12 36.99 0.83 0 0 13 41.94 1.85 0 0 13 46.08 1.45 0 0 -13 42.21 0.93 0 0 14 20.16 1.58 0 0 14 21.23 0.85 0 0 -14 19.49 0.73 0 0 15 41.58 2.18 0 0 15 42.96 1.67 0 0 -15 43.86 1.42 0 0 16 20.45 1.92 0 0 16 20.74 0.99 0 0 -16 21.19 0.85 0 0 17 214.44 6.27 0 0 -17 196.48 4.29 0 0 18 18.60 2.16 0 0 -18 16.40 0.93 0 0 19 5.23 1.91 0 0 -19 4.26 0.77 0 0 20 2.15 1.94 0 -1 19 4.56 2.01 0 1 -18 3.81 0.62 0 -1 18 3.99 1.86 0 1 -17 4.69 0.62 0 -1 17 4.45 1.75 0 1 -16 186.76 3.38 0 -1 16 200.58 5.81 0 1 -15 60.91 1.23 0 -1 15 66.18 2.73 0 1 -14 9.16 0.56 0 -1 14 9.70 1.49 0 1 -13 26.08 0.71 0 -1 13 27.43 1.62 0 1 -12 9.01 0.65 0 -1 12 9.64 1.84 0 -1 12 8.38 0.54 0 1 -11 3.59 0.35 0 -1 11 3.62 0.98 0 -1 11 3.78 0.43 0 1 -10 36.56 0.67 0 -1 10 37.74 1.41 0 -1 10 38.11 0.77 0 1 -9 92.64 1.43 0 -1 9 89.80 2.11 0 -1 9 90.50 1.34 0 1 -8 240.85 3.15 0 -1 8 240.91 4.46 0 -1 8 239.82 3.31 0 1 -7 358.13 4.92 0 -1 7 360.93 6.47 0 -1 7 366.50 5.20 0 1 -6 117.29 1.36 0 -1 6 122.27 2.12 0 -1 6 117.49 1.44 0 1 -5 58.66 0.68 0 -1 5 59.44 1.21 0 -1 5 56.63 0.72 0 1 -4 20.29 0.40 0 -1 4 21.07 0.70 0 -1 4 20.88 0.35 0 1 -3 739.81 13.11 0 1 -3 757.03 11.58 0 -1 3 737.41 13.08 0 1 -2 3421.16 112.07 0 1 -2 3411.49 104.70 0 -1 2 3397.40 111.48 0 1 -1 855.59 14.61 0 1 -1 944.74 14.68 0 -1 1 887.78 15.17 0 -1 1 946.64 14.85 0 1 1 0.62 0.14 0 -1 -1 0.14 0.07 0 1 2 538.77 7.16 0 -1 -2 523.98 6.99 0 1 3 223.31 2.51 0 -1 -3 221.66 2.49 0 1 4 11.84 0.33 0 -1 -4 11.85 0.32 0 1 5 37.04 0.59 0 -1 -5 36.66 0.58 0 1 6 120.52 1.73 0 -1 -6 122.65 1.53 0 1 7 32.60 0.62 0 -1 -7 29.85 0.58 0 1 8 142.30 1.98 0 -1 -8 139.07 1.89 0 1 9 4.69 0.41 0 -1 -9 6.44 0.38 0 1 10 130.99 2.02 0 -1 -10 127.09 1.90 0 1 11 65.13 1.56 0 -1 -11 66.32 1.17 0 1 12 20.72 0.74 0 -1 -12 20.24 0.66 0 1 13 29.36 0.91 0 -1 -13 29.82 0.84 0 1 14 56.28 1.33 0 -1 -14 55.37 1.24 0 1 15 36.17 1.94 0 1 15 33.82 1.14 0 -1 -15 35.41 1.43 0 1 16 56.99 2.53 0 1 16 54.95 1.48 0 -1 -16 52.56 1.38 0 1 17 16.56 2.00 0 1 17 17.41 1.07 0 -1 -17 17.70 1.35 0 1 18 139.28 4.75 0 1 18 136.77 3.88 0 -1 -18 131.14 2.87 0 1 19 92.61 3.99 0 1 19 93.40 2.47 0 -1 -19 84.26 2.82 0 1 20 5.04 1.98 0 -1 -20 4.74 0.89 0 -2 19 7.03 2.13 0 -2 18 26.66 2.45 0 -2 17 1.64 1.67 0 2 -16 0.48 0.45 0 -2 16 0.04 2.42 0 2 -15 105.40 2.15 0 -2 15 110.90 3.75 0 2 -14 114.70 1.86 0 -2 14 116.45 3.68 0 2 -13 20.21 0.59 0 -2 13 21.09 1.65 0 2 -12 15.22 0.48 0 -2 12 15.42 1.44 0 2 -11 28.34 0.58 0 -2 11 28.59 1.50 0 2 -10 7.32 0.49 0 -2 10 6.43 1.58 0 2 -9 149.71 2.09 0 -2 9 153.80 3.98 0 2 -8 561.44 8.96 0 -2 8 539.90 12.00 0 2 -7 161.80 1.94 0 -2 7 158.84 3.01 0 2 -6 55.53 0.68 0 -2 6 53.14 1.31 0 2 -5 34.80 0.46 0 -2 5 38.52 1.05 0 2 -4 3.41 0.54 0 2 -4 2.72 0.18 0 2 -4 2.56 0.23 0 -2 4 3.21 0.55 0 2 -3 78.57 1.38 0 2 -3 82.61 0.91 0 -2 3 75.63 1.36 0 2 -2 50.74 0.94 0 2 -2 53.13 0.60 0 -2 2 50.07 0.96 0 -2 2 52.01 0.62 0 2 -1 17.46 0.51 0 2 -1 17.53 0.39 0 -2 1 15.67 0.52 0 -2 1 17.15 0.31 0 2 0 28.32 0.52 0 2 0 29.25 0.39 0 -2 0 28.14 0.54 0 -2 0 30.19 0.39 0 2 1 234.77 2.61 0 -2 -1 221.70 2.49 0 2 2 161.25 1.80 0 -2 -2 161.08 1.96 0 2 3 7311.93 348.58 0 -2 -3 7094.49 339.13 0 2 4 250.29 3.44 0 -2 -4 251.71 3.23 0 2 5 66.05 0.94 0 -2 -5 63.74 0.92 0 2 6 49.67 1.01 0 -2 -6 47.12 0.78 0 2 7 1.29 0.33 0 -2 -7 0.45 0.33 0 2 8 414.64 6.47 0 -2 -8 396.61 6.24 0 2 9 239.28 3.61 0 -2 -9 235.86 3.54 0 2 10 301.19 4.81 0 -2 -10 298.55 4.69 0 2 11 48.99 1.07 0 -2 -11 51.59 1.37 0 2 12 44.83 1.44 0 -2 -12 44.77 1.03 0 2 13 2.72 0.60 0 -2 -13 3.33 0.55 0 2 14 24.49 0.96 0 -2 -14 23.96 0.88 0 2 15 60.14 1.53 0 -2 -15 59.42 1.48 0 2 16 75.97 1.91 0 -2 -16 74.38 1.76 0 2 17 79.50 2.64 0 -2 -17 78.59 2.51 0 2 18 93.94 3.78 0 -2 -18 91.88 2.29 0 2 19 24.26 2.31 0 2 19 20.84 1.37 0 -2 -19 22.37 1.71 0 2 20 40.18 2.86 0 2 20 41.14 1.75 0 -2 -20 37.34 1.58 0 2 21 2.04 1.85 0 2 21 1.22 1.02 0 -2 -21 0.16 1.39 0 -3 18 15.45 2.34 0 -3 17 1.50 1.79 0 -3 16 20.53 3.22 0 3 -15 4.32 0.43 0 3 -15 5.48 0.59 0 -3 15 4.50 1.61 0 3 -14 3.91 0.41 0 3 -14 3.40 0.86 0 -3 14 3.30 1.50 0 3 -13 109.60 1.64 0 3 -13 108.16 1.97 0 -3 13 112.03 3.52 0 3 -12 13.91 0.44 0 3 -12 13.55 0.64 0 -3 12 14.26 1.44 0 3 -11 9.39 0.37 0 3 -11 9.14 0.52 0 -3 11 10.39 1.30 0 3 -10 16.99 0.41 0 3 -10 17.91 0.57 0 -3 10 19.26 1.30 0 3 -9 25.84 0.61 0 3 -9 23.47 0.60 0 -3 9 25.81 1.33 0 3 -8 142.07 1.73 0 3 -8 139.55 2.18 0 -3 8 137.29 2.98 0 3 -7 848.29 15.17 0 3 -7 856.27 15.97 0 -3 7 850.72 19.13 0 3 -6 576.61 11.56 0 3 -6 571.00 8.67 0 3 -6 585.99 9.34 0 -3 6 579.64 12.26 0 3 -5 41.88 1.21 0 3 -5 44.58 0.58 0 3 -5 44.90 0.65 0 -3 5 41.56 1.20 0 3 -4 57.92 1.32 0 3 -4 57.99 0.88 0 -3 4 56.28 1.29 0 3 -3 63.55 1.32 0 3 -3 63.48 0.77 0 -3 3 63.04 0.83 0 3 -2 150.79 2.37 0 3 -2 151.82 1.72 0 -3 2 149.88 2.31 0 -3 2 155.96 1.84 0 3 -1 257.55 3.85 0 3 -1 268.23 3.23 0 -3 1 256.32 3.81 0 -3 1 264.04 3.29 0 3 0 101.18 1.55 0 3 0 103.63 1.23 0 -3 0 100.72 1.53 0 -3 0 107.49 1.29 0 3 1 296.37 3.78 0 -3 -1 303.00 3.92 0 3 2 312.18 4.08 0 -3 -2 309.62 4.10 0 3 3 115.86 1.52 0 -3 -3 122.10 1.60 0 3 4 424.84 6.24 0 -3 -4 432.60 6.41 0 3 5 114.52 1.58 0 -3 -5 122.50 1.95 0 3 6 49.31 0.87 0 -3 -6 45.66 0.85 0 3 7 147.08 2.10 0 -3 -7 146.09 2.10 0 3 8 73.98 1.23 0 -3 -8 74.01 1.26 0 3 9 29.19 0.76 0 -3 -9 29.77 0.77 0 3 10 231.23 3.66 0 -3 -10 220.83 3.54 0 3 11 339.41 5.76 0 -3 -11 328.88 5.62 0 3 12 4.68 0.60 0 -3 -12 4.76 0.58 0 3 13 18.18 0.83 0 -3 -13 16.03 1.14 0 3 14 40.19 1.64 0 -3 -14 41.50 1.20 0 3 15 59.71 1.58 0 -3 -15 51.89 1.43 0 3 16 69.09 1.81 0 -3 -16 64.78 1.68 0 3 17 33.72 1.39 0 -3 -17 34.11 1.31 0 3 18 4.90 0.99 0 -3 -18 4.04 0.93 0 3 19 17.56 1.84 0 -3 -19 15.53 1.70 0 3 20 -1.62 1.75 0 3 20 -0.45 0.99 0 -3 -20 0.55 0.92 0 3 21 11.39 2.15 0 3 21 9.82 1.34 0 -3 -21 8.44 1.16 0 -4 17 20.66 3.64 0 -4 16 -3.29 1.80 0 -4 15 29.69 2.36 0 4 -14 15.04 0.44 0 4 -14 13.95 0.57 0 -4 14 16.37 1.90 0 4 -13 8.90 0.37 0 4 -13 8.77 0.75 0 -4 13 9.56 1.62 0 4 -12 51.01 0.80 0 -4 12 56.31 2.33 0 4 -11 1.14 0.40 0 4 -11 0.49 0.37 0 -4 11 2.27 1.20 0 4 -10 329.22 4.64 0 4 -10 327.09 5.38 0 -4 10 326.96 7.53 0 4 -9 136.40 1.87 0 4 -9 139.16 2.15 0 -4 9 140.08 3.38 0 4 -8 357.83 4.98 0 4 -8 356.51 5.37 0 -4 8 367.23 7.66 0 4 -7 5.62 0.97 0 4 -7 6.06 0.26 0 4 -7 5.47 0.47 0 -4 7 4.25 1.49 0 4 -6 310.33 5.98 0 4 -6 309.38 4.12 0 4 -6 315.68 4.56 0 -4 6 319.91 6.07 0 4 -5 1083.13 25.82 0 4 -5 1153.24 23.09 0 -4 5 1077.04 25.69 0 4 -4 18.45 0.93 0 4 -4 16.97 0.51 0 -4 4 17.32 0.90 0 4 -3 289.13 4.99 0 4 -3 289.65 3.74 0 -4 3 280.85 4.81 0 -4 3 292.15 3.96 0 4 -2 1.60 0.91 0 4 -2 0.75 0.24 0 -4 2 0.34 0.54 0 -4 2 0.46 0.29 0 4 -1 59.29 1.24 0 4 -1 59.17 0.81 0 -4 1 56.51 1.20 0 -4 1 59.53 1.06 0 4 0 32.07 0.86 0 4 0 29.31 0.73 0 -4 0 30.80 0.60 0 4 1 7.63 0.58 0 4 1 7.77 0.38 0 -4 -1 7.94 0.59 0 4 2 36.19 0.67 0 -4 -2 38.17 0.71 0 4 3 665.68 11.16 0 -4 -3 686.68 11.61 0 4 4 5.45 0.44 0 -4 -4 4.89 0.46 0 4 5 36.28 0.77 0 -4 -5 36.68 1.10 0 4 6 18.88 0.60 0 -4 -6 20.35 0.63 0 4 7 313.64 4.82 0 -4 -7 310.21 4.86 0 4 8 239.96 3.61 0 -4 -8 217.98 3.49 0 4 9 304.14 4.90 0 -4 -9 302.10 4.95 0 4 10 65.77 1.31 0 -4 -10 62.45 1.28 0 4 11 151.22 2.60 0 -4 -11 150.85 2.66 0 4 12 348.79 6.26 0 -4 -12 343.76 6.26 0 4 13 56.28 1.42 0 -4 -13 53.09 1.36 0 4 14 2.48 0.71 0 -4 -14 1.58 0.69 0 4 15 30.40 1.19 0 -4 -15 30.40 1.16 0 4 16 23.69 1.19 0 -4 -16 23.56 1.64 0 4 17 9.46 1.03 0 -4 -17 12.58 1.02 0 4 18 8.49 1.09 0 -4 -18 8.24 1.01 0 4 19 3.08 1.03 0 -4 -19 1.85 1.49 0 4 20 14.44 1.37 0 -4 -20 14.04 1.31 0 4 21 19.65 2.21 0 -4 -21 15.84 1.38 0 -5 17 37.99 3.12 0 -5 16 36.20 2.83 0 -5 15 11.57 2.06 0 -5 14 0.11 1.58 0 5 -13 31.71 0.65 0 -5 13 35.50 2.29 0 5 -12 69.28 0.94 0 -5 12 79.37 2.99 0 5 -11 12.25 0.33 0 5 -11 11.32 0.41 0 -5 11 14.00 1.59 0 5 -10 92.50 1.34 0 5 -10 86.69 1.27 0 -5 10 95.09 2.96 0 5 -9 15.76 0.52 0 5 -9 15.28 0.44 0 -5 9 15.55 1.42 0 5 -8 32.50 1.63 0 5 -8 30.62 0.59 0 -5 8 33.88 2.33 0 5 -7 13.71 1.82 0 5 -7 15.24 0.52 0 5 -7 14.28 0.55 0 -5 7 14.90 1.18 0 5 -6 37.59 1.46 0 5 -6 40.58 0.64 0 5 -6 40.18 0.64 0 -5 6 38.71 1.45 0 5 -5 211.96 4.25 0 5 -5 210.91 2.76 0 -5 5 213.21 4.82 0 5 -4 528.44 10.63 0 5 -4 524.50 8.37 0 -5 4 532.50 10.50 0 -5 4 533.08 8.66 0 5 -3 83.81 2.38 0 5 -3 82.42 1.27 0 -5 3 81.61 1.75 0 5 -2 15.87 0.91 0 5 -2 16.94 0.44 0 -5 2 16.34 0.87 0 -5 2 17.26 0.54 0 5 -1 190.74 3.32 0 5 -1 196.36 2.57 0 -5 1 189.57 3.24 0 -5 1 193.65 2.70 0 5 0 365.52 6.19 0 5 0 357.98 5.21 0 -5 0 364.82 5.50 0 5 1 600.57 10.93 0 5 1 591.20 9.79 0 -5 -1 600.93 10.27 0 5 2 117.37 1.69 0 -5 -2 120.04 1.78 0 5 3 78.39 1.53 0 -5 -3 74.70 1.26 0 5 4 60.78 1.05 0 -5 -4 57.51 1.07 0 5 5 290.77 4.37 0 -5 -5 289.07 4.83 0 5 6 6.36 0.52 0 -5 -6 6.24 0.55 0 5 7 6.09 0.56 0 -5 -7 6.81 0.57 0 5 8 339.92 5.55 0 -5 -8 325.00 5.95 0 5 9 338.01 5.61 0 -5 -9 325.54 5.59 0 5 10 412.07 7.24 0 -5 -10 392.51 7.09 0 5 11 267.30 4.69 0 -5 -11 259.37 4.63 0 5 12 73.86 1.60 0 -5 -12 68.12 1.62 0 5 13 149.22 2.91 0 -5 -13 139.68 2.78 0 5 14 118.86 3.12 0 -5 -14 111.06 3.01 0 5 15 2.83 0.87 0 -5 -15 5.42 0.85 0 5 16 27.21 1.29 0 -5 -16 26.96 1.26 0 5 17 10.78 1.07 0 -5 -17 9.69 1.07 0 5 18 0.69 0.97 0 -5 -18 1.04 0.92 0 5 19 1.03 0.99 0 -5 -19 -0.89 0.97 0 5 20 1.23 1.08 0 -5 -20 -0.32 1.03 0 5 21 2.76 1.91 0 -5 -21 3.12 1.18 0 -6 16 14.06 2.41 0 -6 15 6.90 2.03 0 -6 14 13.02 2.04 0 -6 13 4.88 1.70 0 6 -12 3.00 0.25 0 6 -12 2.76 0.20 0 -6 12 3.29 1.59 0 6 -11 13.81 0.32 0 6 -11 12.83 0.35 0 -6 11 15.72 1.70 0 6 -10 85.71 1.19 0 -6 10 101.21 3.19 0 6 -9 4.27 0.28 0 6 -9 3.53 0.29 0 -6 9 4.04 1.25 0 6 -8 22.38 1.57 0 6 -8 19.95 0.45 0 6 -8 18.22 0.46 0 -6 8 21.16 2.26 0 6 -7 370.01 8.29 0 6 -7 373.51 5.76 0 6 -7 357.21 5.39 0 -6 7 372.87 8.16 0 6 -6 67.14 2.07 0 6 -6 62.18 0.93 0 -6 6 65.23 1.96 0 6 -5 445.96 9.47 0 6 -5 442.86 6.87 0 -6 5 467.01 10.59 0 6 -4 33.15 1.39 0 6 -4 34.50 0.64 0 -6 4 33.85 1.30 0 -6 4 35.47 0.77 0 6 -3 235.78 4.61 0 6 -3 233.30 3.22 0 -6 3 239.92 4.46 0 -6 3 242.19 3.63 0 6 -2 1399.01 37.08 0 6 -2 1452.59 33.37 0 -6 2 1575.23 41.27 0 -6 2 1466.09 34.94 0 6 -1 46.67 1.35 0 6 -1 45.30 0.80 0 -6 1 46.53 1.34 0 -6 1 48.04 0.93 0 6 0 1679.02 44.65 0 6 0 1624.57 40.62 0 -6 0 1737.67 43.61 0 6 1 2.58 0.71 0 6 1 1.99 0.41 0 -6 -1 4.09 0.46 0 6 2 150.12 2.69 0 6 2 151.53 2.24 0 -6 -2 148.28 2.33 0 6 3 12.61 0.84 0 -6 -3 14.17 0.63 0 6 4 109.40 1.75 0 -6 -4 114.38 1.85 0 6 5 42.56 0.94 0 -6 -5 40.63 0.99 0 6 6 486.92 8.42 0 -6 -6 487.81 8.59 0 6 7 56.39 1.20 0 -6 -7 55.62 1.64 0 6 8 504.41 9.59 0 -6 -8 495.82 9.10 0 6 9 192.96 3.30 0 -6 -9 181.48 3.22 0 6 10 396.61 7.16 0 -6 -10 398.20 7.34 0 6 11 21.24 0.91 0 -6 -11 20.27 0.98 0 6 12 99.70 2.11 0 -6 -12 98.15 2.14 0 6 13 113.23 2.39 0 -6 -13 115.99 2.50 0 6 14 6.96 0.93 0 -6 -14 7.37 0.90 0 6 15 114.54 2.64 0 -6 -15 112.87 2.69 0 6 16 21.64 1.28 0 -6 -16 20.90 1.28 0 6 17 2.04 1.50 0 -6 -17 0.05 0.92 0 6 18 3.65 1.07 0 -6 -18 4.00 1.06 0 6 19 8.75 1.29 0 -6 -19 9.63 1.22 0 6 20 4.51 1.27 0 -6 -20 4.94 1.22 0 6 21 1.92 1.24 0 -6 -21 1.21 1.84 0 -7 15 2.38 2.00 0 -7 14 12.90 2.29 0 -7 13 16.84 2.18 0 -7 12 4.41 1.73 0 7 -11 1.28 0.21 0 -7 11 4.15 1.51 0 7 -10 38.78 0.58 0 7 -10 34.98 0.68 0 -7 10 42.65 2.23 0 7 -9 89.50 3.20 0 7 -9 87.93 1.18 0 7 -9 79.50 1.15 0 -7 9 91.23 2.98 0 7 -8 68.85 2.63 0 7 -8 70.89 1.02 0 7 -8 64.61 0.97 0 -7 8 65.79 2.50 0 7 -7 229.23 5.57 0 7 -7 230.39 3.53 0 7 -7 214.16 3.12 0 -7 7 237.99 5.45 0 7 -6 50.41 2.03 0 7 -6 49.68 0.84 0 -7 6 48.94 1.97 0 7 -5 55.13 1.99 0 7 -5 53.82 0.88 0 -7 5 53.43 1.90 0 7 -4 199.27 4.34 0 7 -4 194.19 3.00 0 -7 4 187.71 4.09 0 -7 4 197.54 3.10 0 7 -3 279.78 5.79 0 7 -3 270.17 3.99 0 -7 3 267.39 5.41 0 -7 3 286.64 4.55 0 7 -2 171.56 3.62 0 7 -2 173.25 2.48 0 -7 2 176.18 3.57 0 -7 2 179.74 2.83 0 7 -1 160.11 3.28 0 7 -1 154.91 2.53 0 -7 1 156.67 2.49 0 7 0 61.63 1.69 0 7 0 60.54 1.07 0 -7 0 63.36 1.25 0 7 1 36.32 1.30 0 7 1 38.13 1.09 0 -7 -1 35.61 1.23 0 7 2 107.95 2.26 0 7 2 112.88 1.81 0 -7 -2 111.88 1.91 0 -7 -3 36.44 1.29 0 7 4 7.62 0.59 0 -7 -4 9.17 0.64 0 7 5 9.87 0.91 0 -7 -5 8.11 0.66 0 7 6 2.33 0.57 0 -7 -6 2.44 0.60 0 7 7 256.30 4.27 0 -7 -7 248.99 4.31 0 7 8 177.41 3.07 0 -7 -8 171.16 3.11 0 7 9 0.68 0.65 0 -7 -9 1.89 0.65 0 7 10 2.36 0.69 0 -7 -10 2.14 1.13 0 7 11 75.12 1.72 0 -7 -11 68.98 1.72 0 7 12 9.77 0.89 0 -7 -12 8.97 0.91 0 7 13 69.20 1.84 0 -7 -13 63.11 1.79 0 7 14 105.69 2.49 0 -7 -14 98.91 2.46 0 7 15 2.36 0.95 0 -7 -15 1.87 1.50 0 7 16 15.73 1.27 0 -7 -16 19.67 1.92 0 7 17 43.73 1.83 0 -7 -17 44.36 1.85 0 7 18 100.73 3.88 0 -7 -18 98.27 2.94 0 7 19 49.66 2.12 0 -7 -19 49.63 2.14 0 7 20 14.97 2.33 0 -7 -20 13.50 1.51 0 7 21 0.11 1.29 0 -7 -21 2.57 1.30 0 -8 14 10.89 2.37 0 -8 13 24.26 2.50 0 -8 12 24.35 2.40 0 -8 11 9.41 1.88 0 8 -10 5.59 0.22 0 8 -10 5.41 0.23 0 -8 10 5.63 1.66 0 8 -9 53.45 2.67 0 -8 9 52.77 2.47 0 8 -8 151.07 4.36 0 8 -8 142.53 2.21 0 8 -8 130.57 1.88 0 -8 8 147.93 4.24 0 8 -7 28.83 1.93 0 8 -7 26.59 0.78 0 -8 7 27.56 2.71 0 8 -6 99.11 3.15 0 8 -6 94.53 1.44 0 -8 6 100.05 2.94 0 8 -5 37.11 1.88 0 8 -5 33.82 0.73 0 -8 5 37.92 1.74 0 8 -4 4.74 1.19 0 8 -4 3.27 0.62 0 -8 4 4.67 1.14 0 -8 4 4.14 0.56 0 8 -3 1.85 1.07 0 8 -3 2.05 0.40 0 -8 3 1.60 1.02 0 -8 3 1.81 0.56 0 8 -2 209.51 4.66 0 8 -2 213.30 3.24 0 -8 2 216.69 3.66 0 8 -1 25.52 1.37 0 8 -1 27.03 0.72 0 -8 1 27.72 0.88 0 8 0 25.26 1.24 0 8 0 21.25 0.94 0 -8 0 21.81 0.83 0 8 1 274.38 5.47 0 8 1 269.11 4.36 0 -8 -1 272.52 4.65 0 8 2 12.25 1.02 0 8 2 13.15 0.63 0 -8 -2 11.31 0.73 0 8 3 336.01 6.49 0 8 3 334.37 5.56 0 -8 -3 332.30 5.87 0 8 4 19.18 0.77 0 -8 -4 16.90 1.23 0 8 5 80.34 1.57 0 -8 -5 81.24 1.74 0 8 6 1.53 0.58 0 -8 -6 1.14 0.68 0 8 7 12.76 1.14 0 -8 -7 11.24 0.86 0 8 8 -0.20 0.67 0 -8 -8 -2.11 1.11 0 8 9 216.88 4.57 0 -8 -9 205.74 3.95 0 8 10 82.53 1.91 0 -8 -10 79.69 1.98 0 8 11 237.25 4.55 0 -8 -11 229.62 4.65 0 8 12 69.35 1.92 0 -8 -12 71.01 1.98 0 8 13 5.22 0.95 0 -8 -13 7.86 0.98 0 8 14 -0.39 0.90 0 -8 -14 1.97 0.93 0 8 15 207.31 4.66 0 -8 -15 210.57 4.88 0 8 16 280.80 6.44 0 -8 -16 271.46 6.47 0 8 17 21.54 1.51 0 -8 -17 20.71 1.58 0 8 18 86.06 2.75 0 -8 -18 77.72 2.71 0 8 19 0.14 1.24 0 -8 -19 1.39 1.21 0 8 20 2.07 1.31 0 -8 -20 1.24 2.04 0 8 21 2.21 2.09 0 -8 -21 1.78 1.43 0 -9 13 17.51 2.60 0 -9 12 0.69 2.93 0 -9 11 24.80 3.62 0 -9 10 37.84 2.62 0 9 -9 32.94 2.60 0 -9 9 36.05 2.30 0 9 -8 62.04 2.99 0 9 -8 58.58 1.00 0 9 -8 55.02 0.94 0 -9 8 63.14 2.76 0 9 -7 109.40 5.07 0 9 -7 101.65 1.64 0 9 -7 95.79 1.54 0 -9 7 104.59 3.52 0 9 -6 38.71 2.28 0 -9 6 47.38 3.19 0 9 -5 54.51 2.45 0 9 -5 51.51 1.25 0 -9 5 50.94 2.27 0 9 -4 46.28 2.20 0 9 -4 45.92 1.24 0 -9 4 49.04 2.01 0 -9 4 47.38 1.22 0 9 -3 24.77 1.73 0 9 -3 26.83 1.02 0 -9 3 27.56 0.98 0 9 -2 64.57 3.09 0 9 -2 55.23 1.12 0 -9 2 55.44 1.80 0 9 -1 160.27 3.88 0 9 -1 155.94 2.54 0 -9 1 155.77 2.89 0 9 0 187.45 4.36 0 9 0 193.09 3.15 0 -9 0 192.57 3.46 0 9 1 43.54 1.73 0 9 1 43.29 1.04 0 -9 -1 47.31 1.27 0 9 2 142.75 3.26 0 9 2 136.91 2.37 0 -9 -2 141.76 2.68 0 9 3 126.06 2.95 0 9 3 127.45 2.26 0 -9 -3 130.27 2.51 0 9 4 78.69 2.18 0 9 4 78.93 1.63 0 -9 -4 79.75 1.79 0 9 5 97.19 1.89 0 -9 -5 92.56 2.61 0 9 6 83.44 1.77 0 -9 -6 86.14 1.96 0 9 7 48.47 1.79 0 -9 -7 49.29 2.02 0 9 8 92.96 2.03 0 -9 -8 91.94 2.16 0 9 9 126.11 2.57 0 -9 -9 117.32 2.73 0 9 10 196.98 3.95 0 -9 -10 193.66 4.05 0 9 11 97.40 2.32 0 -9 -11 90.47 3.19 0 9 12 41.24 1.52 0 -9 -12 37.94 1.60 0 9 13 19.07 1.25 0 -9 -13 17.46 1.34 0 9 14 10.46 1.15 0 -9 -14 9.61 1.21 0 9 15 1.98 1.06 0 -9 -15 5.51 1.17 0 9 16 67.37 3.10 0 -9 -16 57.39 2.30 0 9 17 101.90 3.06 0 -9 -17 98.27 3.07 0 9 18 10.00 2.14 0 -9 -18 6.68 2.28 0 9 19 1.17 1.33 0 -9 -19 0.88 1.37 0 9 20 1.63 2.13 0 -9 -20 0.98 1.43 0 9 21 17.34 1.81 0 -9 -21 13.99 1.88 0 -10 11 20.17 2.56 0 -10 10 89.88 4.00 0 10 -9 40.48 2.97 0 -10 9 41.62 4.06 0 10 -8 40.11 2.78 0 -10 8 43.08 2.66 0 10 -7 28.67 3.42 0 10 -7 26.70 0.77 0 10 -7 25.28 0.68 0 -10 7 29.84 2.20 0 10 -6 32.56 2.33 0 10 -6 29.20 1.02 0 -10 6 34.45 2.23 0 10 -5 27.30 2.16 0 10 -5 23.51 1.01 0 10 -4 29.79 2.06 0 10 -4 28.99 0.81 0 -10 4 29.18 1.11 0 10 -3 10.63 2.45 0 -10 3 9.25 0.83 0 10 -2 5.60 1.46 0 10 -2 6.27 0.58 0 -10 2 7.83 0.80 0 10 -1 238.54 5.83 0 10 -1 225.16 3.85 0 -10 1 221.30 4.94 0 10 0 88.57 2.83 0 10 0 86.91 2.08 0 -10 0 91.05 2.02 0 10 1 283.12 6.59 0 10 1 277.84 4.91 0 -10 -1 296.71 5.64 0 10 2 38.33 1.75 0 10 2 39.41 1.12 0 -10 -2 36.64 1.27 0 10 3 97.97 2.76 0 10 3 103.07 1.99 0 -10 -3 96.26 2.75 0 10 4 80.93 3.26 0 10 4 70.48 2.11 0 -10 -4 71.89 1.84 0 10 5 127.43 3.23 0 10 5 124.78 2.46 0 -10 -5 127.72 2.73 0 10 6 28.50 1.14 0 -10 -6 29.79 1.32 0 10 7 94.43 2.71 0 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1.62 0 -11 0 78.10 2.03 0 11 1 13.52 1.59 0 11 1 9.00 0.78 0 -11 -1 10.90 1.00 0 11 2 249.96 6.17 0 11 2 251.74 4.61 0 -11 -2 249.45 5.15 0 11 3 173.57 4.51 0 11 3 176.63 3.87 0 -11 -3 171.53 3.67 0 11 4 37.82 1.95 0 11 4 37.87 1.24 0 -11 -4 34.04 1.41 0 11 5 40.68 1.98 0 11 5 44.51 1.42 0 -11 -5 42.81 1.60 0 11 6 9.03 1.41 0 11 6 12.92 0.95 0 -11 -6 12.61 1.13 0 11 7 28.54 1.27 0 -11 -7 28.75 1.49 0 11 8 256.48 5.19 0 -11 -8 249.94 5.48 0 11 9 348.47 7.19 0 -11 -9 340.57 7.57 0 11 10 149.72 3.43 0 -11 -10 149.61 3.79 0 11 11 104.21 2.75 0 -11 -11 105.40 3.09 0 11 12 16.47 1.35 0 -11 -12 13.04 1.36 0 11 13 0.81 1.14 0 -11 -13 2.53 1.23 0 11 14 12.23 1.31 0 -11 -14 8.19 1.46 0 11 15 7.17 1.33 0 -11 -15 4.99 1.47 0 11 16 0.19 1.19 0 -11 -16 -0.48 1.31 0 11 17 5.62 2.18 0 -11 -17 7.24 1.58 0 11 18 -0.93 1.36 0 -11 -18 0.37 1.45 0 11 19 44.08 2.50 0 -11 -19 48.62 2.65 0 11 20 53.66 2.78 0 -11 -20 53.56 4.08 0 12 -8 2.71 2.27 0 12 -7 85.18 4.30 0 12 -6 18.38 2.58 0 12 -5 77.22 3.79 0 12 -5 71.52 1.53 0 12 -4 26.84 2.38 0 12 -4 21.40 0.86 0 -12 4 20.39 1.75 0 12 -3 8.42 1.92 0 12 -3 5.86 0.67 0 -12 3 5.02 0.97 0 12 -2 0.02 1.62 0 12 -2 0.16 0.91 0 -12 2 0.52 0.87 0 12 -1 5.99 2.55 0 12 -1 1.26 0.97 0 -12 1 1.66 1.42 0 12 0 0.85 1.61 0 12 0 2.22 1.04 0 -12 0 1.73 0.93 0 12 1 57.82 2.68 0 12 1 54.98 1.48 0 -12 -1 56.15 1.80 0 12 2 0.95 1.40 0 12 2 0.24 0.70 0 -12 -2 1.78 1.44 0 12 3 211.12 6.99 0 12 3 192.93 3.87 0 -12 -3 197.43 4.49 0 12 4 136.87 4.18 0 12 4 134.61 2.89 0 -12 -4 133.76 3.25 0 12 5 14.65 1.74 0 12 5 16.95 1.08 0 -12 -5 16.17 1.29 0 12 6 337.54 8.22 0 12 6 326.83 7.49 0 -12 -6 334.60 7.42 0 12 7 88.13 3.04 0 12 7 89.75 2.29 0 -12 -7 83.33 2.53 0 12 8 250.68 5.36 0 -12 -8 255.57 5.90 0 12 9 9.83 1.20 0 -12 -9 9.29 1.39 0 12 10 111.90 2.94 0 -12 -10 115.19 3.21 0 12 11 0.32 1.05 0 -12 -11 -0.23 1.19 0 12 12 9.84 1.31 0 -12 -12 11.89 1.54 0 12 13 24.45 1.69 0 -12 -13 25.05 1.92 0 12 14 4.73 1.33 0 -12 -14 8.15 1.59 0 12 15 2.44 1.99 0 -12 -15 0.33 1.51 0 12 16 9.20 1.56 0 -12 -16 12.67 1.78 0 12 17 1.27 1.36 0 -12 -17 0.03 1.57 0 12 18 6.62 1.63 0 -12 -18 2.93 1.88 0 12 19 5.03 1.71 0 -12 -19 5.29 1.90 0 12 20 31.06 3.57 0 -12 -20 27.92 2.64 0 13 -6 40.04 3.48 0 13 -5 46.70 5.11 0 13 -4 20.24 2.50 0 13 -4 16.67 0.85 0 -13 4 17.84 1.27 0 13 -3 22.90 2.45 0 13 -3 19.60 1.34 0 -13 3 19.01 2.00 0 13 -2 11.12 3.37 0 13 -2 9.73 0.82 0 -13 2 11.08 1.21 0 13 -1 41.10 2.97 0 13 -1 41.58 1.31 0 -13 1 40.33 1.79 0 13 0 55.88 3.07 0 13 0 50.46 1.47 0 -13 0 48.14 1.92 0 13 1 44.84 2.76 0 13 1 45.55 1.46 0 -13 -1 48.77 1.87 0 13 2 47.99 2.68 0 13 2 42.50 1.44 0 -13 -2 43.02 1.77 0 13 3 18.72 2.13 0 13 3 16.22 1.09 0 -13 -3 17.13 1.42 0 13 4 39.57 2.53 0 13 4 41.08 2.06 0 -13 -4 41.32 1.86 0 13 5 112.81 4.06 0 13 5 121.62 2.81 0 -13 -5 128.85 3.35 0 13 6 55.67 2.55 0 13 6 51.13 1.75 0 -13 -6 50.59 2.87 0 13 7 13.92 1.94 0 13 7 13.08 1.18 0 -13 -7 15.93 1.43 0 13 8 4.36 1.61 0 13 8 2.30 1.05 0 -13 -8 3.23 1.30 0 13 9 22.84 2.18 0 -13 -9 21.53 1.72 0 13 10 8.77 1.28 0 -13 -10 8.97 1.52 0 13 11 91.33 2.80 0 -13 -11 83.57 3.08 0 13 12 68.01 3.44 0 -13 -12 63.40 3.84 0 13 13 3.68 1.35 0 -13 -13 3.45 1.53 0 13 14 3.19 1.36 0 -13 -14 6.04 1.62 0 13 15 3.22 2.14 0 -13 -15 0.33 1.60 0 13 16 12.11 1.71 0 -13 -16 9.87 1.96 0 13 17 24.00 2.07 0 -13 -17 22.72 2.34 0 13 18 12.80 1.93 0 -13 -18 13.90 2.20 0 13 19 14.58 2.02 0 -13 -19 14.82 2.36 0 14 -4 46.33 3.70 0 14 -3 7.99 3.65 0 14 -3 5.95 0.82 0 -14 3 7.09 1.19 0 14 -2 34.54 3.19 0 14 -2 36.32 1.32 0 -14 2 39.91 1.86 0 14 -1 10.91 2.45 0 14 -1 11.00 0.93 0 -14 1 9.84 2.09 0 14 0 37.86 4.31 0 14 0 32.20 1.30 0 -14 0 30.67 2.65 0 14 1 18.50 2.41 0 14 1 16.26 1.08 0 -14 -1 17.27 2.31 0 14 2 1.59 1.95 0 14 2 2.24 0.86 0 -14 -2 0.91 1.21 0 14 3 15.62 3.30 0 14 3 9.99 1.05 0 -14 -3 9.67 1.38 0 14 4 65.93 3.32 0 14 4 61.56 1.94 0 -14 -4 66.73 2.47 0 14 5 5.89 1.93 0 14 5 6.70 1.08 0 -14 -5 8.76 1.43 0 14 6 -0.56 1.71 0 14 6 0.53 0.96 0 -14 -6 0.61 1.21 0 14 7 1.11 1.73 0 14 7 1.38 1.05 0 -14 -7 3.26 1.29 0 14 8 3.23 2.78 0 14 8 3.62 1.80 0 -14 -8 3.84 1.38 0 14 9 88.96 3.62 0 14 9 82.99 2.69 0 -14 -9 85.65 3.07 0 14 10 9.43 1.41 0 -14 -10 9.72 2.60 0 14 11 58.42 2.30 0 -14 -11 57.51 2.73 0 14 12 19.61 2.64 0 -14 -12 19.73 1.97 0 14 13 106.35 3.54 0 -14 -13 109.73 4.00 0 14 14 10.90 1.76 0 -14 -14 14.93 2.03 0 14 15 17.74 2.91 0 -14 -15 17.03 2.21 0 14 16 29.23 2.26 0 -14 -16 29.91 3.82 0 14 17 7.05 1.80 0 -14 -17 1.65 3.13 0 14 18 14.10 3.29 0 -14 -18 20.82 3.61 0 15 -2 14.97 2.76 0 15 -2 9.69 0.96 0 -15 2 10.28 1.44 0 15 -1 19.27 4.30 0 15 -1 14.65 1.62 0 -15 1 14.27 1.59 0 15 0 19.68 1.16 0 -15 0 23.94 1.76 0 15 1 28.13 2.99 0 15 1 26.07 1.33 0 -15 -1 24.99 1.89 0 15 2 60.88 3.76 0 15 2 57.79 1.89 0 -15 -2 58.04 2.47 0 15 3 13.26 2.53 0 15 3 13.73 1.20 0 -15 -3 13.87 2.47 0 15 4 5.53 2.14 0 15 4 6.41 1.08 0 -15 -4 4.01 1.43 0 15 5 50.22 3.23 0 15 5 47.18 1.88 0 -15 -5 52.87 2.46 0 15 6 40.10 2.93 0 15 6 35.80 2.45 0 -15 -6 36.61 2.23 0 15 7 5.67 2.10 0 15 7 5.38 1.26 0 -15 -7 4.50 1.53 0 15 8 9.17 1.37 0 -15 -8 7.91 1.62 0 15 9 11.55 2.27 0 15 9 17.74 1.58 0 -15 -9 13.29 1.82 0 15 10 22.86 2.53 0 15 10 25.19 1.82 0 -15 -10 23.28 2.12 0 15 11 9.13 2.21 0 15 11 11.51 1.60 0 -15 -11 10.54 1.91 0 15 12 11.00 1.63 0 -15 -12 9.14 1.95 0 15 13 2.35 1.49 0 -15 -13 5.44 1.78 0 15 14 46.42 2.55 0 -15 -14 47.24 2.93 0 15 15 12.86 2.91 0 -15 -15 12.06 2.34 0 15 16 3.98 1.73 0 -15 -16 3.04 2.06 0 16 1 6.55 2.77 0 16 1 7.87 1.20 0 -16 -1 11.14 1.67 0 16 2 12.70 2.89 0 16 2 10.48 1.25 0 -16 -2 12.82 1.80 0 16 3 90.61 6.57 0 16 3 83.41 2.60 0 -16 -3 80.94 3.30 0 16 4 26.15 2.94 0 16 4 22.57 1.55 0 -16 -4 21.95 3.08 0 16 5 3.46 2.22 0 16 5 2.98 1.13 0 -16 -5 2.56 1.50 0 16 6 1.20 2.15 0 16 6 2.06 1.19 0 -16 -6 1.99 1.58 0 16 7 15.62 2.65 0 16 7 17.60 1.63 0 -16 -7 16.23 2.11 0 16 8 8.54 2.28 0 16 8 4.35 1.37 0 -16 -8 6.52 1.74 0 16 9 3.22 2.15 0 16 9 4.37 1.36 0 -16 -9 -0.22 1.64 0 16 10 11.89 2.42 0 16 10 10.85 2.41 0 -16 -10 11.08 2.01 0 16 11 1.14 2.11 0 16 11 1.99 1.46 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41.75 2.79 -1 14 7 42.35 2.00 1 -14 -6 23.17 2.07 -1 14 6 28.50 3.60 -1 14 6 27.77 1.62 1 -14 -5 37.61 3.21 -1 14 5 30.69 2.53 -1 14 5 33.31 1.72 1 -14 -4 28.38 2.12 -1 14 4 26.03 2.49 1 -14 -3 71.09 2.97 -1 14 3 73.68 4.81 -1 14 3 72.70 2.31 1 -14 -2 35.43 2.21 -1 14 2 37.03 2.77 -1 14 2 35.29 1.71 1 -14 -1 5.57 1.56 -1 14 1 4.06 1.97 -1 14 1 5.24 1.13 1 -14 0 30.53 2.13 -1 14 0 26.45 2.68 -1 14 0 26.29 1.48 1 -14 1 8.21 1.58 -1 14 -1 4.97 2.13 -1 14 -1 6.07 1.11 1 -14 2 61.31 3.70 -1 14 -2 66.80 3.58 -1 14 -2 57.06 2.01 1 -14 3 31.29 3.08 -1 14 -3 32.17 3.04 -1 14 -3 31.43 1.52 -1 14 -4 7.41 2.23 -1 14 -4 3.51 1.01 1 -13 -18 -1.50 1.90 -1 13 18 2.38 1.53 1 -13 -17 1.77 1.78 -1 13 17 0.82 1.50 1 -13 -16 9.93 2.09 -1 13 16 13.00 1.80 1 -13 -15 5.76 1.85 -1 13 15 3.92 1.59 1 -13 -14 35.11 2.51 -1 13 14 35.75 2.12 1 -13 -13 19.65 2.16 -1 13 13 24.12 1.90 1 -13 -12 13.40 1.87 -1 13 12 11.75 1.53 1 -13 -11 77.31 3.33 -1 13 11 78.91 2.76 1 -13 -10 126.53 4.16 -1 13 10 129.14 3.64 1 -13 -9 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34.91 2.06 1 -12 -14 12.74 1.89 -1 12 14 12.71 1.55 1 -12 -13 101.95 3.74 -1 12 13 110.16 3.34 1 -12 -12 110.65 3.84 -1 12 12 120.00 4.50 1 -12 -11 28.22 2.11 -1 12 11 34.33 1.86 1 -12 -10 26.88 1.91 -1 12 10 27.11 1.62 1 -12 -9 -0.60 1.31 -1 12 9 1.08 1.10 1 -12 -8 78.83 2.80 -1 12 8 87.99 2.52 1 -12 -6 378.24 9.17 -1 12 6 388.53 8.51 1 -12 -5 7.26 1.39 -1 12 5 4.93 1.58 -1 12 5 7.16 1.15 1 -12 -4 23.37 1.65 -1 12 4 28.69 2.82 -1 12 4 21.92 1.97 1 -12 -3 2.29 1.23 -1 12 3 3.23 1.43 -1 12 3 1.62 0.92 1 -12 -2 13.32 2.20 -1 12 2 11.72 1.76 -1 12 2 13.68 1.10 1 -12 -1 11.68 1.45 -1 12 1 11.29 1.67 -1 12 1 11.57 1.02 1 -12 0 8.65 1.37 -1 12 0 12.47 1.72 -1 12 0 9.98 1.02 1 -12 1 30.80 1.75 -1 12 -1 26.36 2.17 -1 12 -1 32.76 1.89 1 -12 2 39.98 1.93 -1 12 -2 46.00 2.56 -1 12 -2 37.66 1.45 1 -12 3 70.32 2.44 -1 12 -3 70.78 3.26 -1 12 -3 68.58 1.92 1 -12 4 18.10 1.51 -1 12 -4 21.50 2.17 -1 12 -4 17.31 1.11 -1 12 -5 31.98 3.84 -1 12 -5 26.23 1.24 -1 12 -6 2.50 1.83 -1 12 -6 0.09 0.78 -1 12 -7 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1.53 1 -10 -5 236.50 5.19 -1 10 5 233.37 4.66 1 -10 -4 2.60 1.59 -1 10 4 2.56 0.80 1 -10 -3 549.54 12.21 -1 10 3 552.79 12.73 -1 10 3 564.26 11.69 1 -10 -2 26.85 1.47 -1 10 2 26.00 1.60 -1 10 2 27.23 1.22 1 -10 -1 120.37 2.92 -1 10 1 117.19 3.14 -1 10 1 111.63 3.03 1 -10 0 25.47 1.98 -1 10 0 25.10 1.61 -1 10 0 25.65 1.14 1 -10 1 10.55 1.15 -1 10 -1 11.15 1.43 -1 10 -1 12.38 0.90 1 -10 2 85.28 2.37 -1 10 -2 90.95 3.91 -1 10 -2 84.28 1.96 1 -10 3 40.78 2.29 -1 10 -3 41.47 2.09 -1 10 -3 39.20 1.82 1 -10 4 112.29 3.66 -1 10 -4 111.31 3.51 -1 10 -4 108.84 2.40 -1 10 -5 25.47 1.98 -1 10 -5 24.75 1.10 -1 10 -6 73.03 2.99 -1 10 -6 65.62 1.73 -1 10 -7 44.66 2.60 -1 10 -7 45.20 1.41 -1 10 -8 45.62 3.68 -1 10 -8 33.70 1.26 -1 10 -9 2.48 1.86 -1 10 -9 6.38 0.85 -1 10 -9 4.60 0.78 -1 10 -10 33.58 2.70 1 -9 -20 34.18 2.46 -1 9 20 38.43 2.21 1 -9 -19 155.40 5.22 -1 9 19 172.58 4.76 1 -9 -18 16.21 1.85 -1 9 18 19.05 1.60 1 -9 -17 2.47 1.32 -1 9 17 1.76 1.16 1 -9 -16 3.07 1.30 -1 9 16 1.75 1.10 1 -9 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1.27 -1 7 17 6.86 1.11 -1 7 16 98.96 2.57 1 -7 -15 6.90 1.76 -1 7 15 6.90 0.97 1 -7 -14 41.54 2.41 -1 7 14 50.77 1.63 1 -7 -13 79.94 2.92 -1 7 13 87.78 2.12 1 -7 -12 72.71 2.81 -1 7 12 78.83 1.91 1 -7 -11 80.15 2.18 -1 7 11 86.60 2.03 1 -7 -10 174.40 3.63 -1 7 10 184.27 3.50 1 -7 -9 38.10 1.37 -1 7 9 41.25 1.24 1 -7 -8 53.76 2.12 -1 7 8 63.81 1.50 1 -7 -7 1.34 0.74 -1 7 7 0.68 0.64 1 -7 -6 26.84 1.09 -1 7 6 28.75 1.02 1 -7 -5 55.18 1.48 -1 7 5 55.74 1.31 1 -7 -4 254.85 5.27 -1 7 4 263.92 4.53 1 -7 -3 333.62 6.14 -1 7 3 328.03 5.66 1 -7 -2 583.36 11.58 -1 7 2 599.34 11.44 1 -7 -1 591.52 11.86 -1 7 1 584.11 11.67 -1 7 1 581.49 11.75 1 -7 0 120.72 2.42 -1 7 0 114.43 2.39 -1 7 0 120.22 2.18 1 -7 1 78.10 1.79 -1 7 -1 76.32 1.85 -1 7 -1 82.67 1.62 1 -7 2 198.46 3.73 -1 7 -2 198.13 4.56 -1 7 -2 193.37 3.38 1 -7 3 141.61 2.74 -1 7 -3 141.49 3.07 -1 7 -3 141.30 2.98 1 -7 4 100.19 2.16 -1 7 -4 100.51 2.42 -1 7 -4 98.47 1.92 -1 7 -5 4.10 1.00 -1 7 -5 3.96 0.63 1 -7 6 43.62 1.64 -1 7 -6 42.27 1.74 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8 274.85 4.78 1 -6 -7 98.25 2.03 -1 6 7 102.23 1.93 1 -6 -6 13.25 0.82 -1 6 6 11.81 0.74 1 -6 -5 111.96 2.20 -1 6 5 112.79 1.99 1 -6 -4 193.82 3.40 -1 6 4 200.01 3.31 1 -6 -3 230.44 4.06 -1 6 3 239.72 3.94 1 -6 -2 149.56 2.67 1 -6 -1 48.61 1.25 -1 6 1 47.04 1.16 1 -6 0 639.41 12.51 -1 6 0 616.06 12.03 -1 6 0 627.70 11.83 1 -6 1 76.30 1.64 -1 6 -1 75.59 1.63 -1 6 -1 76.88 1.50 1 -6 2 210.38 3.74 -1 6 -2 212.86 3.83 -1 6 -2 208.70 3.46 1 -6 3 126.90 2.40 -1 6 -3 130.95 2.29 1 -6 4 82.21 1.77 -1 6 -4 82.28 1.93 -1 6 -4 86.81 1.70 1 -6 5 5.27 0.83 -1 6 -5 4.04 0.85 -1 6 -5 3.18 0.61 1 -6 6 2.18 0.82 -1 6 -6 4.05 0.90 -1 6 -6 1.60 0.60 1 -6 7 64.52 1.82 -1 6 -7 67.28 1.96 -1 6 -7 60.87 1.43 1 -6 8 62.83 2.64 -1 6 -8 66.81 2.11 -1 6 -8 66.34 1.44 -1 6 -8 66.22 1.54 1 -6 9 198.22 4.52 -1 6 -9 203.42 4.73 -1 6 -9 193.73 3.38 -1 6 -9 191.61 3.64 1 -6 10 8.13 1.26 -1 6 -10 8.51 0.70 -1 6 -10 8.96 0.78 1 -6 11 1.16 1.15 -1 6 -11 0.92 0.57 -1 6 -11 0.39 0.70 1 -6 12 34.09 2.70 -1 6 -12 30.21 1.40 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1.35 2 -5 -1 603.33 12.67 -2 5 1 621.93 12.55 2 -5 0 508.42 10.45 -2 5 0 512.85 10.11 2 -5 1 23.66 1.72 -2 5 -1 20.12 1.07 2 -5 2 33.96 1.35 -2 5 -2 34.29 0.92 -2 5 -2 34.76 1.32 2 -5 3 225.93 4.61 -2 5 -3 229.61 3.88 -2 5 -3 233.57 5.19 -2 5 -4 36.39 1.37 -2 5 -4 33.40 1.36 -2 5 -5 20.43 0.86 -2 5 -5 20.29 1.17 -2 5 -6 67.42 1.57 -2 5 -6 66.67 1.93 -2 5 -7 1.43 0.70 -2 5 -7 0.65 0.91 -2 5 -8 33.18 1.21 -2 5 -8 28.86 1.21 -2 5 -8 29.65 1.45 2 -5 9 107.19 2.37 -2 5 -9 111.41 2.49 -2 5 -9 105.50 2.44 -2 5 -9 102.25 2.73 2 -5 10 8.13 0.94 -2 5 -10 9.23 0.98 -2 5 -10 11.03 1.18 2 -5 11 50.89 2.26 -2 5 -11 49.01 1.57 -2 5 -11 48.40 1.88 2 -5 12 26.39 1.39 -2 5 -12 26.43 1.27 -2 5 -12 25.03 1.57 2 -5 13 22.25 1.44 -2 5 -13 25.34 1.84 -2 5 -13 22.29 1.58 2 -5 14 34.68 1.81 -2 5 -14 37.78 1.51 -2 5 -14 35.69 1.90 2 -5 15 33.81 1.85 -2 5 -15 34.51 1.47 -2 5 -15 28.70 1.85 2 -5 16 48.97 2.34 -2 5 -16 51.21 1.83 -2 5 -16 47.63 2.27 2 -4 -19 3.36 1.14 -2 4 19 4.40 0.93 2 -4 -18 1.19 1.56 -2 4 18 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2.27 1.44 -5 0 1 5.43 0.96 -5 0 1 5.35 1.29 -5 0 1 3.89 1.56 -5 0 0 12.26 1.43 -5 0 0 11.20 2.26 -5 0 0 15.15 1.80 -5 0 -1 11.75 0.83 -5 0 -1 14.81 1.56 -5 0 -1 11.71 1.88 -5 0 -2 0.19 0.44 -5 0 -2 -1.62 1.25 -5 0 -2 0.30 1.55 -5 0 -3 1.63 0.34 -5 0 -3 0.47 1.40 -5 0 -3 3.69 1.68 -5 0 -5 22.02 1.94 -5 0 -5 24.08 2.41 -5 0 -6 48.00 2.52 -5 0 -6 54.74 3.10 -5 0 -7 95.24 5.04 -5 0 -7 87.89 4.05 -5 0 -8 26.46 2.19 -5 0 -8 29.81 2.82 -5 0 -9 16.08 2.10 -5 0 -9 30.66 2.95 -5 0 -10 6.99 1.95 -5 0 -10 6.57 3.68 -5 0 -11 36.85 2.56 -5 0 -11 28.11 3.30 -5 0 -12 75.17 3.53 -5 0 -12 72.03 4.51 -5 0 -13 34.71 2.63 -5 0 -13 33.88 3.49 -5 -1 9 5.65 2.01 -5 -1 8 8.19 1.96 -5 -1 8 9.60 1.12 -5 -1 8 8.88 1.68 -5 -1 7 15.56 2.01 -5 -1 7 15.19 1.27 -5 -1 7 14.02 1.28 -5 -1 6 3.67 1.55 -5 -1 6 3.51 1.05 -5 -1 6 3.42 1.12 -5 -1 5 17.21 1.76 -5 -1 5 16.71 1.35 -5 -1 5 18.60 1.49 -5 -1 4 17.94 1.65 -5 -1 4 16.60 1.41 -5 -1 4 21.12 1.53 -5 -1 3 41.92 1.90 -5 -1 3 40.77 1.83 -5 -1 3 37.48 2.99 -5 -1 2 1.27 1.61 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3 26.52 1.80 -5 -2 2 1.30 1.72 -5 -2 2 3.54 1.06 -5 -2 2 3.47 1.32 -5 -2 1 27.44 1.46 -5 -2 1 29.66 1.58 -5 -2 1 30.38 1.93 -5 -2 0 1.92 0.87 -5 -2 0 0.78 1.10 -5 -2 0 -0.08 1.38 -5 -2 -1 30.93 1.71 -5 -2 -1 32.16 1.76 -5 -2 -1 34.68 2.15 -5 -2 -2 11.43 2.10 -5 -2 -2 9.48 1.67 -5 -2 -3 1.41 0.44 -5 -2 -3 1.97 1.18 -5 -2 -3 0.13 1.60 -5 -2 -4 5.00 1.30 -5 -2 -4 4.63 1.77 -5 -2 -5 0.85 1.37 -5 -2 -5 16.30 2.86 -5 -2 -6 42.97 2.28 -5 -2 -6 50.46 2.95 -5 -2 -7 29.76 2.09 -5 -2 -7 32.30 2.68 -5 -2 -8 12.19 1.79 -5 -2 -8 14.65 2.41 -5 -2 -9 18.79 2.01 -5 -2 -9 22.01 3.98 -5 -2 -10 81.83 3.39 -5 -2 -10 81.24 4.23 -5 -2 -11 44.31 2.64 -5 -2 -11 44.99 3.56 -5 -2 -12 24.06 2.26 -5 -2 -12 22.32 3.10 -5 -2 -13 18.04 2.13 -5 -2 -13 17.68 3.06 -5 -2 -14 12.93 2.20 -5 -2 -14 18.36 3.06 -5 -3 8 4.86 2.00 -5 -3 7 13.74 2.05 -5 -3 6 8.85 1.81 -5 -3 6 7.74 0.92 -5 -3 6 7.41 1.56 -5 -3 5 1.53 2.21 -5 -3 5 0.11 1.31 -5 -3 5 0.96 0.96 -5 -3 4 2.99 1.39 -5 -3 4 1.44 0.91 -5 -3 4 2.10 1.04 -5 -3 3 9.28 1.43 -5 -3 3 7.48 1.04 -5 -3 3 8.82 1.33 -5 -3 2 42.13 2.70 -5 -3 2 40.46 1.64 -5 -3 2 37.70 2.03 -5 -3 1 11.94 1.22 -5 -3 1 8.50 1.17 -5 -3 1 8.74 1.51 -5 -3 0 47.69 1.72 -5 -3 0 45.25 1.81 -5 -3 0 46.53 2.31 -5 -3 -1 2.48 1.26 -5 -3 -1 1.17 1.07 -5 -3 -1 2.49 1.47 -5 -3 -2 9.36 0.84 -5 -3 -2 11.58 1.34 -5 -3 -2 9.24 1.74 -5 -3 -3 24.66 2.39 -5 -3 -3 27.45 2.17 -5 -3 -4 8.62 1.39 -5 -3 -4 9.20 2.81 -5 -3 -5 17.43 1.54 -5 -3 -5 13.95 2.10 -5 -3 -6 -0.74 1.22 -5 -3 -6 0.08 1.72 -5 -3 -7 35.18 2.07 -5 -3 -7 34.22 2.72 -5 -3 -8 65.73 2.76 -5 -3 -8 63.77 3.43 -5 -3 -9 64.43 2.78 -5 -3 -9 65.50 3.80 -5 -3 -10 27.26 2.19 -5 -3 -10 30.23 2.94 -5 -3 -11 56.56 4.05 -5 -3 -11 52.03 3.80 -5 -3 -12 23.40 2.21 -5 -3 -12 16.38 2.96 -5 -3 -13 14.14 2.06 -5 -3 -14 22.70 3.63 -5 -4 7 4.65 2.01 -5 -4 6 -1.24 1.71 -5 -4 5 14.84 1.86 -5 -4 5 11.05 0.94 -5 -4 5 10.87 1.10 -5 -4 4 16.59 1.85 -5 -4 4 16.09 1.10 -5 -4 4 15.60 1.24 -5 -4 3 30.55 2.04 -5 -4 3 33.60 1.97 -5 -4 3 31.22 1.71 -5 -4 2 101.60 3.18 -5 -4 2 93.63 3.24 -5 -4 2 94.57 3.08 -5 -4 1 50.81 2.09 -5 -4 1 53.26 1.87 -5 -4 1 54.83 2.30 -5 -4 0 13.98 1.81 -5 -4 0 12.95 1.19 -5 -4 0 12.45 1.60 -5 -4 -1 12.24 1.08 -5 -4 -1 11.14 1.22 -5 -4 -1 9.15 1.62 -5 -4 -2 80.38 2.06 -5 -4 -2 86.74 2.57 -5 -4 -2 85.69 3.22 -5 -4 -3 17.87 2.17 -5 -4 -3 19.43 2.95 -5 -4 -4 19.31 1.51 -5 -4 -4 18.69 2.03 -5 -4 -5 1.09 1.17 -5 -4 -5 0.60 1.69 -5 -4 -6 1.57 1.34 -5 -4 -6 6.37 1.81 -5 -4 -7 1.30 1.29 -5 -4 -7 0.62 1.77 -5 -4 -8 11.03 1.69 -5 -4 -8 11.60 2.22 -5 -4 -9 76.98 4.10 -5 -4 -10 38.86 2.25 -5 -4 -11 28.77 2.25 -5 -4 -12 22.83 2.19 -5 -4 -13 17.89 2.09 -5 -4 -14 0.26 1.68 -5 -5 6 36.65 2.93 -5 -5 5 55.73 3.10 -5 -5 4 46.59 3.65 -5 -5 4 40.99 1.84 -5 -5 4 37.37 1.58 -5 -5 3 6.62 1.52 -5 -5 3 6.99 0.88 -5 -5 3 5.84 1.15 -5 -5 2 5.30 1.40 -5 -5 2 4.40 0.88 -5 -5 2 4.11 1.19 -5 -5 1 8.68 1.38 -5 -5 1 9.87 1.04 -5 -5 1 10.10 1.36 -5 -5 0 62.48 2.21 -5 -5 0 62.28 2.67 -5 -5 0 61.10 2.54 -5 -5 -1 21.84 1.36 -5 -5 -1 24.21 2.03 -5 -5 -1 24.23 1.85 -5 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21.43 2.24 -5 -6 -14 45.77 2.73 -5 -7 3 1.15 1.61 -5 -7 2 5.23 1.61 -5 -7 1 -0.09 1.34 -5 -7 1 0.37 0.75 -5 -7 1 0.55 1.04 -5 -7 0 0.46 1.24 -5 -7 0 1.63 0.84 -5 -7 0 1.71 1.21 -5 -7 -1 0.69 1.13 -5 -7 -1 0.40 0.86 -5 -7 -1 0.16 1.27 -5 -7 -2 56.76 2.07 -5 -7 -2 52.08 1.84 -5 -7 -2 52.35 2.50 -5 -7 -3 112.13 3.00 -5 -7 -3 113.67 5.11 -5 -7 -4 13.04 1.31 -5 -7 -4 11.84 1.85 -5 -7 -5 17.92 1.46 -5 -7 -6 29.91 1.74 -5 -7 -7 8.76 1.37 -5 -7 -8 12.55 1.56 -5 -7 -9 23.84 1.89 -5 -7 -10 23.16 1.98 -5 -7 -11 12.18 1.84 -5 -7 -12 54.33 2.75 -5 -7 -13 25.71 3.32 -5 -8 1 3.88 1.57 -5 -8 0 1.87 1.38 -5 -8 0 0.62 0.75 -5 -8 0 0.30 1.78 -5 -8 -1 1.89 1.29 -5 -8 -1 1.28 1.30 -5 -8 -1 2.20 1.29 -5 -8 -2 1.98 0.87 -5 -8 -2 -0.57 1.38 -5 -8 -3 28.48 1.51 -5 -8 -3 29.99 2.08 -5 -8 -4 86.27 2.56 -5 -8 -4 83.96 3.39 -5 -8 -5 45.34 1.89 -5 -8 -6 4.02 1.19 -5 -8 -7 26.57 1.74 -5 -8 -8 5.24 1.39 -5 -8 -9 18.80 1.74 -5 -8 -10 63.09 2.73 -5 -8 -11 42.87 2.41 -5 -8 -12 8.31 1.78 -5 -9 -1 1.91 1.43 -5 -9 -1 1.12 0.83 -5 -9 -1 0.06 1.24 -5 -9 -2 4.96 1.43 -5 -9 -2 3.60 1.46 -5 -9 -3 10.49 1.12 -5 -9 -3 9.32 1.67 -5 -9 -4 14.80 1.30 -5 -9 -5 28.96 1.61 -5 -9 -6 48.61 2.03 -5 -9 -7 20.21 2.36 -5 -9 -8 42.56 2.99 -5 -9 -9 8.34 2.24 -5 -9 -10 5.57 2.30 -5 -9 -11 26.01 2.08 -5 -10 -5 43.07 1.90 -5 -10 -6 37.58 1.86 -5 -10 -7 17.70 2.36 -5 -10 -8 16.76 2.40 -6 2 0 14.27 2.15 -6 2 0 6.82 2.37 -6 2 -1 3.11 1.90 -6 2 -1 0.58 2.14 -6 2 -2 0.24 1.85 -6 2 -2 3.21 2.20 -6 1 1 1.82 1.65 -6 1 1 2.35 1.87 -6 1 0 2.89 1.85 -6 1 0 5.85 2.07 -6 1 -1 10.85 2.01 -6 1 -1 13.57 2.36 -6 1 -2 8.12 2.04 -6 1 -2 6.77 2.40 -6 1 -3 36.09 4.02 -6 1 -3 35.87 3.27 -6 1 -4 10.31 2.23 -6 1 -4 10.64 2.71 -6 0 1 3.52 2.60 -6 0 1 7.98 1.98 -6 0 0 6.58 2.64 -6 0 0 6.46 2.03 -6 0 -1 21.50 2.14 -6 0 -1 17.52 2.63 -6 0 -2 21.62 2.21 -6 0 -2 20.72 2.66 -6 0 -3 4.76 1.90 -6 0 -3 12.72 3.71 -6 0 -4 11.60 2.18 -6 0 -4 1.41 2.39 -6 0 -5 29.82 3.86 -6 0 -5 14.50 2.90 -6 -1 0 2.62 1.42 -6 -1 0 -1.54 1.79 -6 -1 -1 -3.61 2.03 -6 -1 -2 7.97 2.91 -6 -1 -2 11.75 2.50 -6 -1 -3 29.43 2.36 -6 -1 -3 26.31 2.88 -6 -1 -4 13.82 2.03 -6 -1 -4 13.47 2.64 -6 -1 -5 6.68 1.89 -6 -1 -5 10.69 3.93 -6 -2 -1 13.59 1.71 -6 -2 -1 9.76 2.21 -6 -2 -2 3.22 1.54 -6 -2 -2 3.08 1.95 -6 -2 -3 6.98 1.78 -6 -2 -3 6.16 2.21 -6 -2 -4 42.27 3.75 -6 -2 -4 30.72 3.23 -6 -2 -5 17.72 2.13 -6 -2 -5 14.47 2.74 -6 -3 -2 0.40 1.39 -6 -3 -2 3.98 1.89 -6 -3 -3 0.26 1.45 -6 -3 -3 4.81 3.00 -6 -3 -4 1.70 1.50 -6 -3 -4 -0.33 2.01 -6 -3 -5 41.52 3.68 -6 -3 -5 29.25 3.20 0 0 0 0.00 0.00 ; _shelx_hkl_checksum 88778 _shelx_res_file ; TITL SH175 shelx.res created by SHELXL-2019/2 at 08:52:46 on 16-Sep-2022 CELL 0.71075 4.69138 13.06769 16.99228 68.44130 83.73910 88.03240 ZERR 1 0.00022 0.00068 0.00083 0.00480 0.00590 0.00620 LATT 1 SFAC C H N NI O UNIT 46 42 4 1 4 L.S. 5 FMAP 2 PLAN 25 EQIV $1 -x+2, -y, -z+2 HTAB C8 O1_$1 HTAB C3 N2 HTAB C11 O1 BOND $H CONF LIST 4 TEMP -100.0 ACTA OMIT 0 1 1 SIZE 0.320 0.080 0.030 WGHT 0.056400 0.172700 FVAR 0.58614 NI1 4 1.000000 0.000000 1.000000 10.50000 0.02565 0.01922 = 0.02805 -0.00788 -0.01098 0.00079 O1 5 0.870780 0.134213 0.931851 11.00000 0.02893 0.02184 = 0.03045 -0.00835 -0.01194 0.00028 O2 5 0.267959 0.520333 0.658882 11.00000 0.04705 0.02340 = 0.03183 -0.00687 -0.01947 0.00400 N1 3 0.770095 -0.053846 0.940607 11.00000 0.02651 0.02172 = 0.02686 -0.00728 -0.00893 0.00181 N2 3 0.632863 0.027669 0.877292 11.00000 0.03048 0.02124 = 0.03027 -0.00736 -0.01315 0.00230 C1 1 0.184048 -0.326486 0.854475 11.00000 0.02769 0.03245 = 0.04124 -0.02139 -0.00711 0.00149 C2 1 0.253265 -0.216515 0.809075 11.00000 0.04789 0.03291 = 0.03935 -0.01282 -0.02179 0.00324 AFIX 43 H2 2 0.183365 -0.181019 0.755246 11.00000 -1.20000 AFIX 0 C3 1 0.420133 -0.156805 0.839332 11.00000 0.04567 0.02477 = 0.03600 -0.00774 -0.01698 -0.00198 AFIX 43 H3 2 0.457644 -0.081018 0.807386 11.00000 -1.20000 AFIX 0 C4 1 0.533956 -0.208302 0.917270 11.00000 0.02875 0.02339 = 0.03063 -0.01171 -0.00842 0.00176 C5 1 0.469354 -0.319173 0.962200 11.00000 0.03535 0.02532 = 0.03130 -0.01057 -0.00926 0.00083 AFIX 43 H5 2 0.546693 -0.355980 1.014716 11.00000 -1.20000 AFIX 0 C6 1 0.295079 -0.377028 0.932142 11.00000 0.03629 0.02515 = 0.03760 -0.01264 -0.00503 -0.00409 AFIX 43 H6 2 0.250866 -0.452077 0.964938 11.00000 -1.20000 AFIX 0 C7 1 -0.003198 -0.388376 0.820471 11.00000 0.03731 0.04421 = 0.05253 -0.02912 -0.01186 -0.00262 AFIX 137 H7A 2 -0.191485 -0.353241 0.813325 11.00000 -1.20000 H7B 2 -0.026408 -0.464591 0.860552 11.00000 -1.20000 H7C 2 0.086306 -0.387620 0.765383 11.00000 -1.20000 AFIX 0 C8 1 0.718993 -0.156740 0.955966 11.00000 0.02818 0.02354 = 0.02973 -0.00878 -0.00969 0.00188 AFIX 43 H8 2 0.818971 -0.207025 0.999831 11.00000 -1.20000 AFIX 0 C9 1 0.701586 0.123065 0.879710 11.00000 0.02359 0.02451 = 0.02640 -0.00856 -0.00545 0.00040 C10 1 0.578261 0.224515 0.821016 11.00000 0.02510 0.02291 = 0.02521 -0.00748 -0.00517 0.00099 C11 1 0.653663 0.326654 0.822637 11.00000 0.03238 0.02557 = 0.02938 -0.00995 -0.01144 0.00103 AFIX 43 H11 2 0.782209 0.329648 0.861251 11.00000 -1.20000 AFIX 0 C12 1 0.542747 0.422682 0.768663 11.00000 0.03962 0.02256 = 0.03283 -0.00979 -0.01260 -0.00034 AFIX 43 H12 2 0.592488 0.491322 0.770952 11.00000 -1.20000 AFIX 0 C13 1 0.358359 0.419418 0.710896 11.00000 0.03082 0.02348 = 0.02507 -0.00545 -0.00685 0.00252 C14 1 0.280249 0.318913 0.708383 11.00000 0.03335 0.02752 = 0.03157 -0.01074 -0.01419 0.00161 AFIX 43 H14 2 0.154229 0.316308 0.669017 11.00000 -1.20000 AFIX 0 C15 1 0.388912 0.222534 0.764155 11.00000 0.03177 0.02360 = 0.03294 -0.01033 -0.00950 -0.00098 AFIX 43 H15 2 0.332585 0.153781 0.763416 11.00000 -1.20000 AFIX 0 C16 1 0.104221 0.523696 0.591178 11.00000 0.04151 0.02896 = 0.03230 -0.00948 -0.01749 0.00387 AFIX 23 H16A 2 -0.077691 0.482264 0.614859 11.00000 -1.20000 H16B 2 0.214098 0.489949 0.553892 11.00000 -1.20000 AFIX 0 C17 1 0.043286 0.642485 0.541172 11.00000 0.04192 0.02808 = 0.03290 -0.00785 -0.01755 0.00194 C18 1 0.193595 0.697249 0.463331 11.00000 0.06392 0.03729 = 0.03517 -0.00896 -0.00610 0.00296 AFIX 43 H18 2 0.341540 0.660436 0.441520 11.00000 -1.20000 AFIX 0 C19 1 0.130379 0.806483 0.416160 11.00000 0.07883 0.03806 = 0.03582 -0.00208 -0.01432 -0.00774 AFIX 43 H19 2 0.235121 0.842724 0.362308 11.00000 -1.20000 AFIX 0 C20 1 -0.078211 0.862025 0.445794 11.00000 0.07096 0.02967 = 0.05888 -0.00333 -0.03223 0.00277 C21 1 -0.227929 0.806988 0.524998 11.00000 0.06263 0.04077 = 0.07930 -0.01203 -0.00878 0.01781 AFIX 43 H21 2 -0.372618 0.844499 0.547317 11.00000 -1.20000 AFIX 0 C22 1 -0.168500 0.698134 0.571697 11.00000 0.04898 0.03785 = 0.05048 -0.00546 -0.00472 0.00697 AFIX 43 H22 2 -0.274742 0.661553 0.625238 11.00000 -1.20000 AFIX 0 C23 1 -0.149997 0.980054 0.393548 11.00000 0.11099 0.03587 = 0.09700 0.00470 -0.04465 0.00878 AFIX 137 H23A 2 -0.100061 1.028406 0.422521 11.00000 -1.20000 H23B 2 -0.355632 0.985730 0.387091 11.00000 -1.20000 H23C 2 -0.040649 1.002234 0.337299 11.00000 -1.20000 AFIX 0 HKLF 4 REM SH175 REM wR2 = 0.0963, GooF = S = 1.063, Restrained GooF = 1.063 for all data REM R1 = 0.0367 for 3883 Fo > 4sig(Fo) and 0.0447 for all 4375 data REM 252 parameters refined using 0 restraints END WGHT 0.0427 0.2892 REM Highest difference peak 0.415, deepest hole -0.187, 1-sigma level 0.063 Q1 1 1.1155 0.0059 1.0402 11.00000 0.05 0.41 Q2 1 0.5756 0.2711 0.8281 11.00000 0.05 0.38 Q3 1 0.2326 -0.3440 0.8914 11.00000 0.05 0.37 Q4 1 0.4843 -0.1858 0.8830 11.00000 0.05 0.37 Q5 1 0.3063 0.3665 0.7200 11.00000 0.05 0.35 Q6 1 0.2314 -0.2726 0.8341 11.00000 0.05 0.34 Q7 1 0.4494 0.4204 0.7417 11.00000 0.05 0.32 Q8 1 0.6161 -0.1784 0.9340 11.00000 0.05 0.31 Q9 1 0.1860 0.5207 0.6313 11.00000 0.05 0.31 Q10 1 0.7127 0.0761 0.8721 11.00000 0.05 0.31 Q11 1 0.1002 -0.3555 0.8405 11.00000 0.05 0.31 Q12 1 0.9069 -0.0625 1.0247 11.00000 0.05 0.31 Q13 1 0.4704 -0.2587 0.9376 11.00000 0.05 0.30 Q14 1 0.6932 -0.1034 0.9600 11.00000 0.05 0.30 Q15 1 0.6602 0.1772 0.8430 11.00000 0.05 0.29 Q16 1 0.7914 0.1225 0.9064 11.00000 0.05 0.29 Q17 1 0.9705 0.0427 1.0349 11.00000 0.05 0.28 Q18 1 0.9992 0.0751 0.9475 11.00000 0.05 0.28 Q19 1 0.3845 -0.3428 0.9382 11.00000 0.05 0.28 Q20 1 0.0630 0.5885 0.5639 11.00000 0.05 0.27 Q21 1 0.5033 0.2209 0.7866 11.00000 0.05 0.27 Q22 1 0.8610 0.1590 0.9514 11.00000 0.05 0.27 Q23 1 -0.1847 0.8204 0.4791 11.00000 0.05 0.26 Q24 1 0.3805 0.2797 0.7252 11.00000 0.05 0.26 Q25 1 0.1840 -0.1988 0.8031 11.00000 0.05 0.26 ; _shelx_res_checksum 33260 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' 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 Ni Ni1 1.000000 0.000000 1.000000 0.02390(10) Uani d 1 . . O O1 0.8708(2) 0.13421(8) 0.93185(7) 0.0267(2) Uani d 1 . . O O2 0.2680(3) 0.52033(9) 0.65888(7) 0.0339(3) Uani d 1 . . N N1 0.7701(3) -0.05385(10) 0.94061(8) 0.0250(3) Uani d 1 . . N N2 0.6329(3) 0.02767(10) 0.87729(8) 0.0272(3) Uani d 1 . . C C1 0.1840(3) -0.32649(13) 0.85447(11) 0.0313(3) Uani d 1 . . C C2 0.2533(4) -0.21651(14) 0.80907(11) 0.0389(4) Uani d 1 . . H H2 0.183365 -0.181019 0.755246 0.047 Uiso calc 1 . . C C3 0.4201(4) -0.15681(13) 0.83933(11) 0.0354(4) Uani d 1 . . H H3 0.457644 -0.081018 0.807386 0.042 Uiso calc 1 . . C C4 0.5340(3) -0.20830(12) 0.91727(10) 0.0267(3) Uani d 1 . . C C5 0.4694(4) -0.31917(12) 0.96220(10) 0.0302(3) Uani d 1 . . H H5 0.546693 -0.355980 1.014716 0.036 Uiso calc 1 . . C C6 0.2951(4) -0.37703(13) 0.93214(11) 0.0325(3) Uani d 1 . . H H6 0.250866 -0.452077 0.964938 0.039 Uiso calc 1 . . C C7 -0.0032(4) -0.38838(15) 0.82047(13) 0.0408(4) Uani d 1 . . H H7A -0.191485 -0.353241 0.813325 0.049 Uiso calc 1 . . H H7B -0.026408 -0.464591 0.860552 0.049 Uiso calc 1 . . H H7C 0.086306 -0.387620 0.765383 0.049 Uiso calc 1 . . C C8 0.7190(3) -0.15674(12) 0.95597(10) 0.0269(3) Uani d 1 . . H H8 0.818971 -0.207025 0.999831 0.032 Uiso calc 1 . . C C9 0.7016(3) 0.12306(12) 0.87971(9) 0.0248(3) Uani d 1 . . C C10 0.5783(3) 0.22452(12) 0.82102(9) 0.0246(3) Uani d 1 . . C C11 0.6537(4) 0.32665(12) 0.82264(10) 0.0285(3) Uani d 1 . . H H11 0.782209 0.329648 0.861251 0.034 Uiso calc 1 . . C C12 0.5427(4) 0.42268(12) 0.76866(10) 0.0311(3) Uani d 1 . . H H12 0.592488 0.491322 0.770952 0.037 Uiso calc 1 . . C C13 0.3584(3) 0.41942(12) 0.71090(9) 0.0272(3) Uani d 1 . . C C14 0.2802(4) 0.31891(13) 0.70838(10) 0.0300(3) Uani d 1 . . H H14 0.154229 0.316308 0.669017 0.036 Uiso calc 1 . . C C15 0.3889(4) 0.22253(12) 0.76416(10) 0.0289(3) Uani d 1 . . H H15 0.332585 0.153781 0.763416 0.035 Uiso calc 1 . . C C16 0.1042(4) 0.52370(13) 0.59118(10) 0.0338(4) Uani d 1 . . H H16A -0.077691 0.482264 0.614859 0.041 Uiso calc 1 . . H H16B 0.214098 0.489949 0.553892 0.041 Uiso calc 1 . . C C17 0.0433(4) 0.64249(13) 0.54117(10) 0.0342(4) Uani d 1 . . C C18 0.1936(5) 0.69725(15) 0.46333(12) 0.0467(5) Uani d 1 . . H H18 0.341540 0.660436 0.441520 0.056 Uiso calc 1 . . C C19 0.1304(6) 0.80648(16) 0.41616(13) 0.0533(5) Uani d 1 . . H H19 0.235121 0.842724 0.362308 0.064 Uiso calc 1 . . C C20 -0.0782(5) 0.86203(16) 0.44579(14) 0.0549(6) Uani d 1 . . C C21 -0.2279(6) 0.80699(18) 0.52500(17) 0.0641(6) Uani d 1 . . H H21 -0.372618 0.844499 0.547317 0.077 Uiso calc 1 . . C C22 -0.1685(5) 0.69813(16) 0.57170(14) 0.0490(5) Uani d 1 . . H H22 -0.274742 0.661553 0.625238 0.059 Uiso calc 1 . . C C23 -0.1500(7) 0.98005(19) 0.3935(2) 0.0871(10) Uani d 1 . . H H23A -0.100061 1.028406 0.422521 0.104 Uiso calc 1 . . H H23B -0.355632 0.985730 0.387091 0.104 Uiso calc 1 . . H H23C -0.040649 1.002234 0.337299 0.104 Uiso calc 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_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Ni1 0.02565(16) 0.01922(14) 0.02805(16) 0.00079(10) -0.01098(11) -0.00788(11) O1 0.0289(6) 0.0218(5) 0.0305(5) 0.0003(4) -0.0119(4) -0.0083(4) O2 0.0470(7) 0.0234(5) 0.0318(6) 0.0040(5) -0.0195(5) -0.0069(5) N1 0.0265(6) 0.0217(6) 0.0269(6) 0.0018(5) -0.0089(5) -0.0073(5) N2 0.0305(7) 0.0212(6) 0.0303(6) 0.0023(5) -0.0131(5) -0.0074(5) C1 0.0277(8) 0.0324(8) 0.0412(9) 0.0015(6) -0.0071(7) -0.0214(7) C2 0.0479(11) 0.0329(8) 0.0393(9) 0.0032(8) -0.0218(8) -0.0128(7) C3 0.0457(10) 0.0248(7) 0.0360(9) -0.0020(7) -0.0170(7) -0.0077(7) C4 0.0287(8) 0.0234(7) 0.0306(8) 0.0018(6) -0.0084(6) -0.0117(6) C5 0.0353(9) 0.0253(7) 0.0313(8) 0.0008(6) -0.0093(7) -0.0106(6) C6 0.0363(9) 0.0252(7) 0.0376(8) -0.0041(6) -0.0050(7) -0.0126(7) C7 0.0373(10) 0.0442(10) 0.0525(11) -0.0026(8) -0.0119(8) -0.0291(9) C8 0.0282(8) 0.0235(7) 0.0297(7) 0.0019(6) -0.0097(6) -0.0088(6) C9 0.0236(7) 0.0245(7) 0.0264(7) 0.0004(6) -0.0054(6) -0.0086(6) C10 0.0251(7) 0.0229(7) 0.0252(7) 0.0010(6) -0.0052(6) -0.0075(6) C11 0.0324(8) 0.0256(7) 0.0294(8) 0.0010(6) -0.0114(6) -0.0100(6) C12 0.0396(9) 0.0226(7) 0.0328(8) -0.0003(6) -0.0126(7) -0.0098(6) C13 0.0308(8) 0.0235(7) 0.0251(7) 0.0025(6) -0.0069(6) -0.0055(6) C14 0.0333(8) 0.0275(7) 0.0316(8) 0.0016(6) -0.0142(7) -0.0107(6) C15 0.0318(8) 0.0236(7) 0.0329(8) -0.0010(6) -0.0095(6) -0.0103(6) C16 0.0415(10) 0.0290(8) 0.0323(8) 0.0039(7) -0.0175(7) -0.0095(7) C17 0.0419(10) 0.0281(8) 0.0329(8) 0.0019(7) -0.0176(7) -0.0079(7) C18 0.0639(13) 0.0373(10) 0.0352(9) 0.0030(9) -0.0061(9) -0.0090(8) C19 0.0788(16) 0.0381(10) 0.0358(10) -0.0077(10) -0.0143(10) -0.0021(8) C20 0.0710(15) 0.0297(9) 0.0589(13) 0.0028(9) -0.0322(11) -0.0033(9) C21 0.0626(15) 0.0408(11) 0.0793(16) 0.0178(10) -0.0088(13) -0.0120(11) C22 0.0490(12) 0.0379(10) 0.0505(11) 0.0070(9) -0.0047(9) -0.0055(9) C23 0.111(2) 0.0359(12) 0.097(2) 0.0088(13) -0.0446(19) 0.0047(13) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Ni Ni 0.3393 1.1124 '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 O1 Ni1 O1 2_757 . 180.0 ? O1 Ni1 N1 2_757 . 96.53(5) ? O1 Ni1 N1 . . 83.47(5) ? O1 Ni1 N1 2_757 2_757 83.47(5) ? O1 Ni1 N1 . 2_757 96.53(5) ? N1 Ni1 N1 . 2_757 180.00(5) ? C9 O1 Ni1 . . 111.02(9) ? C13 O2 C16 . . 117.77(12) ? C8 N1 N2 . . 119.42(12) ? C8 N1 Ni1 . . 125.97(11) ? N2 N1 Ni1 . . 114.52(9) ? C9 N2 N1 . . 107.12(12) ? C2 C1 C6 . . 117.53(15) ? C2 C1 C7 . . 121.02(16) ? C6 C1 C7 . . 121.45(15) ? C3 C2 C1 . . 122.41(16) ? C3 C2 H2 . . 118.8 ? C1 C2 H2 . . 118.8 ? C2 C3 C4 . . 119.88(15) ? C2 C3 H3 . . 120.1 ? C4 C3 H3 . . 120.1 ? C5 C4 C3 . . 117.81(14) ? C5 C4 C8 . . 116.21(13) ? C3 C4 C8 . . 125.97(14) ? C6 C5 C4 . . 121.58(15) ? C6 C5 H5 . . 119.2 ? C4 C5 H5 . . 119.2 ? C5 C6 C1 . . 120.75(15) ? C5 C6 H6 . . 119.6 ? C1 C6 H6 . . 119.6 ? C1 C7 H7A . . 109.5 ? C1 C7 H7B . . 109.5 ? H7A C7 H7B . . 109.5 ? C1 C7 H7C . . 109.5 ? H7A C7 H7C . . 109.5 ? H7B C7 H7C . . 109.5 ? N1 C8 C4 . . 130.93(14) ? N1 C8 H8 . . 114.5 ? C4 C8 H8 . . 114.5 ? O1 C9 N2 . . 123.84(13) ? O1 C9 C10 . . 117.23(12) ? N2 C9 C10 . . 118.93(13) ? C15 C10 C11 . . 118.51(14) ? C15 C10 C9 . . 122.35(13) ? C11 C10 C9 . . 119.15(13) ? C12 C11 C10 . . 120.54(14) ? C12 C11 H11 . . 119.7 ? C10 C11 H11 . . 119.7 ? C11 C12 C13 . . 120.22(14) ? C11 C12 H12 . . 119.9 ? C13 C12 H12 . . 119.9 ? O2 C13 C12 . . 114.99(13) ? O2 C13 C14 . . 124.86(14) ? C12 C13 C14 . . 120.15(14) ? C15 C14 C13 . . 119.15(14) ? C15 C14 H14 . . 120.4 ? C13 C14 H14 . . 120.4 ? C14 C15 C10 . . 121.40(14) ? C14 C15 H15 . . 119.3 ? C10 C15 H15 . . 119.3 ? O2 C16 C17 . . 107.78(13) ? O2 C16 H16A . . 110.2 ? C17 C16 H16A . . 110.2 ? O2 C16 H16B . . 110.2 ? C17 C16 H16B . . 110.2 ? H16A C16 H16B . . 108.5 ? C18 C17 C22 . . 118.55(17) ? C18 C17 C16 . . 120.82(17) ? C22 C17 C16 . . 120.61(16) ? C17 C18 C19 . . 120.5(2) ? C17 C18 H18 . . 119.7 ? C19 C18 H18 . . 119.7 ? C20 C19 C18 . . 121.3(2) ? C20 C19 H19 . . 119.3 ? C18 C19 H19 . . 119.3 ? C19 C20 C21 . . 118.14(18) ? C19 C20 C23 . . 121.1(2) ? C21 C20 C23 . . 120.7(2) ? C22 C21 C20 . . 120.8(2) ? C22 C21 H21 . . 119.6 ? C20 C21 H21 . . 119.6 ? C17 C22 C21 . . 120.6(2) ? C17 C22 H22 . . 119.7 ? C21 C22 H22 . . 119.7 ? C20 C23 H23A . . 109.5 ? C20 C23 H23B . . 109.5 ? H23A C23 H23B . . 109.5 ? C20 C23 H23C . . 109.5 ? H23A C23 H23C . . 109.5 ? H23B C23 H23C . . 109.5 ? 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 Ni1 O1 2_757 1.8363(10) ? Ni1 O1 . 1.8363(10) ? Ni1 N1 . 1.8677(12) ? Ni1 N1 2_757 1.8678(12) ? O1 C9 . 1.3009(18) ? O2 C13 . 1.3736(17) ? O2 C16 . 1.4383(18) ? N1 C8 . 1.2977(19) ? N1 N2 . 1.4030(16) ? N2 C9 . 1.3145(18) ? C1 C2 . 1.389(2) ? C1 C6 . 1.391(2) ? C1 C7 . 1.504(2) ? C2 C3 . 1.382(2) ? C2 H2 . 0.9500 ? C3 C4 . 1.402(2) ? C3 H3 . 0.9500 ? C4 C5 . 1.393(2) ? C4 C8 . 1.460(2) ? C5 C6 . 1.385(2) ? C5 H5 . 0.9500 ? C6 H6 . 0.9500 ? C7 H7A . 0.9800 ? C7 H7B . 0.9800 ? C7 H7C . 0.9800 ? C8 H8 . 0.9500 ? C9 C10 . 1.479(2) ? C10 C15 . 1.389(2) ? C10 C11 . 1.403(2) ? C11 C12 . 1.378(2) ? C11 H11 . 0.9500 ? C12 C13 . 1.390(2) ? C12 H12 . 0.9500 ? C13 C14 . 1.392(2) ? C14 C15 . 1.389(2) ? C14 H14 . 0.9500 ? C15 H15 . 0.9500 ? C16 C17 . 1.506(2) ? C16 H16A . 0.9900 ? C16 H16B . 0.9900 ? C17 C18 . 1.376(3) ? C17 C22 . 1.378(3) ? C18 C19 . 1.396(3) ? C18 H18 . 0.9500 ? C19 C20 . 1.360(3) ? C19 H19 . 0.9500 ? C20 C21 . 1.393(3) ? C20 C23 . 1.518(3) ? C21 C22 . 1.386(3) ? C21 H21 . 0.9500 ? C22 H22 . 0.9500 ? C23 H23A . 0.9800 ? C23 H23B . 0.9800 ? C23 H23C . 0.9800 ? 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 C8 H8 O1 2_757 0.95 2.38 2.9455(18) 118.1 yes C3 H3 N2 . 0.95 2.37 2.945(2) 118.2 yes C11 H11 O1 . 0.95 2.43 2.7590(19) 99.9 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 N1 Ni1 O1 C9 . . . . -1.22(10) ? N1 Ni1 O1 C9 2_757 . . . 178.78(10) ? O1 Ni1 N1 C8 2_757 . . . 5.45(14) ? O1 Ni1 N1 C8 . . . . -174.55(14) ? O1 Ni1 N1 N2 2_757 . . . -178.16(10) ? O1 Ni1 N1 N2 . . . . 1.84(10) ? C8 N1 N2 C9 . . . . 174.67(14) ? Ni1 N1 N2 C9 . . . . -1.98(15) ? C6 C1 C2 C3 . . . . -1.5(3) ? C7 C1 C2 C3 . . . . 178.71(17) ? C1 C2 C3 C4 . . . . 2.2(3) ? C2 C3 C4 C5 . . . . -0.9(3) ? C2 C3 C4 C8 . . . . 178.31(16) ? C3 C4 C5 C6 . . . . -1.0(3) ? C8 C4 C5 C6 . . . . 179.76(15) ? C4 C5 C6 C1 . . . . 1.6(3) ? C2 C1 C6 C5 . . . . -0.4(3) ? C7 C1 C6 C5 . . . . 179.40(16) ? N2 N1 C8 C4 . . . . 0.3(3) ? Ni1 N1 C8 C4 . . . . 176.52(13) ? C5 C4 C8 N1 . . . . -164.03(17) ? C3 C4 C8 N1 . . . . 16.8(3) ? Ni1 O1 C9 N2 . . . . 0.40(19) ? Ni1 O1 C9 C10 . . . . 179.52(10) ? N1 N2 C9 O1 . . . . 1.0(2) ? N1 N2 C9 C10 . . . . -178.07(12) ? O1 C9 C10 C15 . . . . -178.23(14) ? N2 C9 C10 C15 . . . . 0.9(2) ? O1 C9 C10 C11 . . . . 1.6(2) ? N2 C9 C10 C11 . . . . -179.24(15) ? C15 C10 C11 C12 . . . . -0.3(2) ? C9 C10 C11 C12 . . . . 179.90(14) ? C10 C11 C12 C13 . . . . -1.1(3) ? C16 O2 C13 C12 . . . . 172.90(15) ? C16 O2 C13 C14 . . . . -6.6(2) ? C11 C12 C13 O2 . . . . -178.27(15) ? C11 C12 C13 C14 . . . . 1.3(3) ? O2 C13 C14 C15 . . . . 179.45(15) ? C12 C13 C14 C15 . . . . 0.0(3) ? C13 C14 C15 C10 . . . . -1.4(3) ? C11 C10 C15 C14 . . . . 1.5(2) ? C9 C10 C15 C14 . . . . -178.65(15) ? C13 O2 C16 C17 . . . . -177.34(14) ? O2 C16 C17 C18 . . . . 103.66(19) ? O2 C16 C17 C22 . . . . -77.6(2) ? C22 C17 C18 C19 . . . . -0.6(3) ? C16 C17 C18 C19 . . . . 178.15(17) ? C17 C18 C19 C20 . . . . 0.6(3) ? C18 C19 C20 C21 . . . . 0.1(3) ? C18 C19 C20 C23 . . . . -178.8(2) ? C19 C20 C21 C22 . . . . -0.9(4) ? C23 C20 C21 C22 . . . . 178.1(2) ? C18 C17 C22 C21 . . . . -0.2(3) ? C16 C17 C22 C21 . . . . -178.91(19) ? C20 C21 C22 C17 . . . . 0.9(4) ? _cod_database_fobs_code 2244204