#------------------------------------------------------------------------------ #$Date: 2023-04-05 14:15:34 +0300 (Wed, 05 Apr 2023) $ #$Revision: 282400 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/02/27/2022715.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_2022715 loop_ _publ_author_name Vinaya, 'Basavaraju, Yeriyur B.' 'Yathirajan, Hemmige S.' 'Parkin, Sean' _publ_section_title ; Syntheses and crystal structures of four 4-(4-methoxyphenyl)piperazin-1-ium salts: trifluoroacetate, 2,3,4,5,6-pentafluorobenzoate, 4-iodobenzoate, and a polymorph with 4-methylbenzoate ; _journal_coeditor_code VM2279 _journal_issue 4 _journal_name_full 'Acta Crystallographica Section E Crystallographic Communications' _journal_page_first 380 _journal_page_last 385 _journal_paper_doi 10.1107/S2056989023002529 _journal_volume 79 _journal_year 2023 _chemical_formula_iupac 'C11 H17 N2 O +, C7 H4 I O2 -, H2 O' _chemical_formula_moiety 'C11 H17 N2 O +, C7 H4 I O2 -, H2 O' _chemical_formula_sum 'C18 H23 I N2 O4' _chemical_formula_weight 458.28 _chemical_name_systematic ; 4-(4-Methoxyphenyl)piperazin-1-ium 4-iodobenzoate monohydrate ; _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2ybc' _space_group_name_H-M_alt 'P 1 21/c 1' _atom_sites_solution_hydrogens mixed _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _audit_creation_method 'SHELXL-2019/2 and CIFFIX' _cell_angle_alpha 90 _cell_angle_beta 92.970(3) _cell_angle_gamma 90 _cell_formula_units_Z 12 _cell_length_a 20.4117(18) _cell_length_b 7.4255(6) _cell_length_c 36.796(3) _cell_measurement_reflns_used 9052 _cell_measurement_temperature 90.0(2) _cell_measurement_theta_max 27.49 _cell_measurement_theta_min 2.33 _cell_volume 5569.6(8) _computing_cell_refinement ; APEX3 (Bruker, 2016) ; _computing_data_collection ; APEX3 (Bruker, 2016) ; _computing_data_reduction ; APEX3 (Bruker, 2016) ; _computing_molecular_graphics ; XP in SHELXTL (Sheldrick, 2008), Mercury (Macrae et al., 2020) ; _computing_publication_material ; SHELX (Sheldrick, 2008) and publCIF (Westrip, 2010) ; _computing_structure_refinement ; SHELXL2019/2 (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXT (Sheldrick, 2015a) ; _diffrn_ambient_temperature 90.0(2) _diffrn_detector_area_resol_mean 7.41 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.990 _diffrn_measurement_device_type 'Bruker D8 Venture dual source' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0556 _diffrn_reflns_av_unetI/netI 0.0489 _diffrn_reflns_limit_h_max 26 _diffrn_reflns_limit_h_min -26 _diffrn_reflns_limit_k_max 6 _diffrn_reflns_limit_k_min -9 _diffrn_reflns_limit_l_max 47 _diffrn_reflns_limit_l_min -47 _diffrn_reflns_number 72181 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 27.658 _diffrn_reflns_theta_min 1.998 _diffrn_source microsource _exptl_absorpt_coefficient_mu 1.750 _exptl_absorpt_correction_T_max 0.862 _exptl_absorpt_correction_T_min 0.726 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (SADABS; Krause et al., 2015) ; _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 1.640 _exptl_crystal_description plate _exptl_crystal_F_000 2760 _exptl_crystal_size_max 0.300 _exptl_crystal_size_mid 0.130 _exptl_crystal_size_min 0.030 _refine_diff_density_max 0.839 _refine_diff_density_min -0.805 _refine_ls_extinction_coef 0.00017(3) _refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^ _refine_ls_extinction_method ; SHELXL-2019/2 (Sheldrick 2015b) ; _refine_ls_goodness_of_fit_ref 1.029 _refine_ls_hydrogen_treatment mixed _refine_ls_matrix_type full _refine_ls_number_parameters 729 _refine_ls_number_reflns 12876 _refine_ls_number_restraints 12 _refine_ls_restrained_S_all 1.029 _refine_ls_R_factor_all 0.0507 _refine_ls_R_factor_gt 0.0328 _refine_ls_shift/su_max 0.002 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0216P)^2^+1.7628P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0637 _refine_ls_wR_factor_ref 0.0687 _reflns_number_gt 10003 _reflns_number_total 12876 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file vm2279sup1.cif _cod_data_source_block III _cod_original_sg_symbol_H-M 'P 21/c' _cod_database_code 2022715 _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 0.622 _shelx_estimated_absorpt_t_max 0.949 _shelx_hkl_file ; -2 0 0 186.064 10.0627 2 -2 0 0 190.756 10.2333 3 -2 0 0 188.601 10.6511 4 2 0 0 190.103 10.1330 2 2 0 0 180.447 10.5225 3 2 0 0 212.977 10.9713 4 3 0 0 16.4716 2.19118 4 3 0 0 15.0024 1.77366 2 -3 0 0 13.9758 1.58840 2 -3 0 0 14.4533 1.79019 2 -3 0 0 15.5741 1.78824 3 -3 0 0 15.2679 2.08208 4 3 0 0 13.2476 1.61173 2 3 0 0 15.3237 1.95923 3 -4 0 0 1133.97 57.8131 2 -4 0 0 1151.24 58.2196 3 4 0 0 1159.40 57.8093 2 4 0 0 1141.54 58.0897 2 4 0 0 1213.34 58.3523 3 4 0 0 1187.51 58.8225 4 -4 0 0 1178.00 58.1722 2 5 0 0 313.219 17.0508 2 -5 0 0 324.643 18.1539 4 -5 0 0 311.310 17.4040 2 -5 0 0 296.318 16.9266 2 5 0 0 332.606 18.2899 4 5 0 0 327.178 17.6565 3 5 0 0 326.473 18.0700 2 6 0 0 5638.91 270.950 3 -6 0 0 5314.76 270.734 3 6 0 0 5650.83 271.742 4 7 0 0 2211.08 108.996 2 7 0 0 2261.03 109.869 3 7 0 0 2236.75 110.753 4 -7 0 0 2211.15 109.965 3 -7 0 0 2152.05 109.581 2 7 0 0 2146.38 110.339 2 8 0 0 3033.50 152.734 3 8 0 0 2932.74 149.915 2 8 0 0 3148.13 152.099 4 -8 0 0 3057.74 150.769 2 9 0 0 185.133 12.2355 3 9 0 0 181.243 11.4290 2 -9 0 0 172.822 11.9282 2 9 0 0 181.616 13.1961 4 10 0 0 15.8536 3.05938 2 10 0 0 11.7746 3.04941 3 10 0 0 10.9213 4.03509 4 -10 0 0 8.54356 2.99435 2 11 0 0 336.810 20.4189 2 11 0 0 372.708 21.8555 3 -11 0 0 358.403 21.4758 2 11 0 0 361.892 23.0017 4 12 0 0 838.039 45.9220 4 12 0 0 826.689 44.4744 3 -12 0 0 788.000 43.9949 2 12 0 0 788.321 42.9260 2 13 0 0 1659.09 84.7652 2 13 0 0 1694.03 86.3753 3 -13 0 0 1631.68 85.7223 2 14 0 0 531.227 30.6949 2 -14 0 0 567.420 38.0601 2 14 0 0 535.302 32.1134 3 15 0 0 246.176 23.4842 3 15 0 0 228.718 16.0265 2 -15 0 0 253.888 18.2707 2 -16 0 0 35.3697 6.34491 2 16 0 0 25.2742 5.90061 3 16 0 0 26.0515 4.78625 2 17 0 0 79.1614 8.51812 2 -17 0 0 74.7599 9.48988 2 17 0 0 89.3578 9.66906 3 18 0 0 265.185 19.3612 2 18 0 0 268.383 20.6597 3 -18 0 0 294.135 22.2457 2 19 0 0 166.141 13.7824 2 19 0 0 186.628 15.5894 3 -19 0 0 139.780 16.3138 2 -20 0 0 315.806 28.8048 2 20 0 0 423.263 26.1124 2 20 0 0 402.571 27.2119 3 21 0 0 152.420 15.4076 3 21 0 0 156.226 17.3083 2 -22 0 0 43.6949 10.5002 2 22 0 0 26.4350 7.38222 3 22 0 0 24.3897 7.19959 2 23 0 0 4.84242 4.73095 2 23 0 0 3.72139 4.70158 3 24 0 0 25.5081 7.87471 2 -24 0 0 37.2340 12.9073 2 24 0 0 38.7038 9.22000 3 -25 0 0 14.7003 10.7346 2 25 0 0 6.29465 6.34572 3 25 0 0 8.24762 5.93298 2 26 0 0 23.9139 8.68744 3 26 0 0 14.7865 6.94661 2 0 -1 0 -0.0620 0.47461 4 0 1 0 -0.0698 0.46850 4 1 -1 0 114.505 6.71687 2 1 -1 0 124.545 6.96008 4 -1 -1 0 124.035 6.40032 5 1 -1 0 122.708 7.24352 3 1 -1 0 119.795 6.25704 2 -1 -1 0 128.192 6.98122 4 1 1 0 122.648 6.40775 5 -1 1 0 119.844 7.19977 3 -1 1 0 121.981 6.94676 4 -2 -1 0 643.255 31.9165 5 2 -1 0 627.898 32.1230 2 2 -1 0 666.659 32.6047 4 -2 -1 0 662.566 31.8935 2 -2 -1 0 625.499 32.4008 3 2 -1 0 651.327 32.1086 2 2 -1 0 645.160 32.8729 3 -2 1 0 640.287 31.9809 2 2 1 0 626.607 31.9306 5 -2 1 0 637.395 31.9990 2 -2 1 0 650.252 32.9014 3 -2 1 0 670.441 32.6055 4 -3 -1 0 854.950 41.7773 2 -3 -1 0 858.834 41.6647 5 3 -1 0 886.868 42.6604 3 -3 -1 0 821.141 41.9675 3 3 -1 0 802.863 41.7803 2 3 -1 0 824.062 42.0151 2 3 -1 0 864.593 42.3513 4 -3 -1 0 831.167 41.4701 2 -3 1 0 836.960 41.8923 2 -3 1 0 855.245 42.3326 4 3 1 0 820.285 42.0687 3 3 1 0 847.919 41.5186 2 -3 1 0 822.615 41.7714 2 -3 1 0 853.238 42.6551 3 3 1 0 832.051 41.6510 5 3 1 0 838.283 41.4085 2 4 -1 0 1071.17 54.1959 2 4 -1 0 1106.41 55.0027 3 4 -1 0 1103.98 54.8600 4 -4 -1 0 1072.83 54.3399 3 4 -1 0 1100.79 54.6399 2 -4 -1 0 1077.79 53.8522 2 -4 -1 0 1100.57 54.3397 2 4 1 0 1107.96 53.8385 2 -4 1 0 1059.00 54.1789 2 4 1 0 1079.26 54.0738 5 4 1 0 1088.00 54.0630 2 -4 1 0 1110.19 54.8426 4 4 1 0 1097.30 54.4857 3 -4 1 0 1107.04 55.1070 3 -4 1 0 1076.81 54.4099 2 5 -1 0 1196.37 58.7043 4 -5 -1 0 1158.12 58.0549 2 5 -1 0 1105.76 58.1997 2 -5 -1 0 1169.04 58.7879 3 5 -1 0 1184.04 58.6358 3 -5 -1 0 1191.92 57.8581 2 5 -1 0 1147.38 57.8041 2 5 1 0 1174.00 58.1035 3 -5 1 0 1165.80 58.5263 4 -5 1 0 1168.08 58.7500 3 5 1 0 1125.42 57.7137 2 -5 1 0 1114.35 58.0492 2 5 1 0 1126.69 57.7280 5 -5 1 0 1147.91 58.3799 2 5 1 0 1201.21 57.4534 2 6 -1 0 141.297 9.40482 4 6 -1 0 127.001 8.77587 2 6 -1 0 150.742 9.34543 3 -6 -1 0 136.633 8.73800 2 6 -1 0 144.805 8.57046 2 -6 -1 0 129.481 9.42213 4 -6 -1 0 137.933 8.12383 2 -6 -1 0 136.255 8.59740 3 6 1 0 132.385 8.29490 5 -6 1 0 128.343 8.93546 4 6 1 0 139.820 8.76035 3 -6 1 0 130.762 8.71817 2 -6 1 0 130.307 9.21468 3 6 1 0 141.090 8.10962 2 -6 1 0 127.038 8.30079 2 7 -1 0 357.758 20.0077 4 -7 -1 0 340.499 18.9727 2 -7 -1 0 328.922 18.7646 3 7 1 0 352.529 19.0362 3 7 1 0 326.835 18.5254 2 7 1 0 349.683 18.2024 2 7 1 0 299.015 18.2174 5 8 -1 0 134.672 9.23846 2 -8 -1 0 138.496 9.66341 2 8 -1 0 146.574 10.1976 3 8 -1 0 141.882 10.5335 4 -8 1 0 146.682 9.74883 2 8 1 0 131.870 9.27962 2 -9 -1 0 3381.24 169.513 2 9 -1 0 3359.04 169.044 2 9 -1 0 3557.32 170.256 3 9 -1 0 3487.52 171.148 4 9 1 0 3390.65 168.445 2 -9 1 0 3394.20 169.499 2 9 1 0 3391.42 169.458 3 -10 -1 0 3045.26 150.608 2 10 -1 0 3119.74 151.571 3 10 -1 0 3180.76 150.413 2 -10 1 0 2965.46 150.463 2 10 1 0 2882.38 149.306 2 10 1 0 2943.53 150.473 3 -11 -1 0 136.295 10.5564 2 11 -1 0 140.438 11.7592 4 11 -1 0 136.053 10.3211 2 11 -1 0 147.498 11.3497 3 11 1 0 140.841 10.5966 3 11 1 0 144.866 9.83549 2 -11 1 0 144.241 10.6888 2 12 -1 0 156.943 11.4188 2 12 -1 0 166.931 13.6933 4 12 -1 0 167.253 12.7032 3 -12 -1 0 161.611 11.9969 2 12 1 0 148.068 11.6661 3 12 1 0 156.552 10.8843 2 -12 1 0 165.275 12.0026 2 -13 -1 0 13.7902 3.84430 2 13 -1 0 16.2773 4.43658 3 13 -1 0 11.9372 4.44409 4 13 -1 0 18.6506 3.87935 2 13 1 0 6.34388 2.61139 2 13 1 0 12.1926 3.36390 3 -13 1 0 11.5188 3.85087 2 14 -1 0 141.940 13.1118 3 14 -1 0 160.605 15.0160 4 -14 -1 0 159.842 13.0647 2 14 -1 0 168.220 13.7506 2 14 1 0 157.812 11.6008 2 14 1 0 168.161 12.7963 3 15 -1 0 330.493 22.3567 3 -15 -1 0 345.467 21.7122 2 15 -1 0 313.678 20.6409 2 15 -1 0 313.598 23.2154 4 15 1 0 359.843 22.4001 3 15 1 0 309.938 21.3653 2 -15 1 0 317.610 21.6672 2 16 -1 0 387.359 29.0417 4 16 -1 0 427.034 27.1392 3 16 -1 0 405.314 25.6275 2 -16 -1 0 398.091 27.1324 2 -16 1 0 436.318 27.1848 2 16 1 0 423.368 25.4588 2 16 1 0 437.780 26.8364 3 -17 -1 0 466.392 31.9027 2 17 -1 0 493.168 30.5213 2 17 -1 0 508.733 33.5709 4 17 -1 0 447.469 31.1857 3 17 1 0 539.125 31.6582 3 -17 1 0 496.264 32.1725 2 17 1 0 514.884 29.7857 2 18 -1 0 258.070 19.0665 2 18 -1 0 256.054 22.0530 4 18 -1 0 238.546 19.6233 3 -18 -1 0 254.982 20.3364 2 18 1 0 276.833 19.7346 3 18 1 0 250.499 17.9142 2 -18 1 0 224.149 21.6445 2 19 -1 0 111.564 12.7580 3 -19 -1 0 140.702 13.8364 2 19 -1 0 102.220 11.1871 2 19 1 0 111.689 11.0531 2 -19 1 0 110.898 13.7381 2 19 1 0 131.249 12.3900 3 20 -1 0 17.1447 6.20971 3 20 -1 0 20.6917 6.09994 2 20 1 0 28.4711 6.26801 3 -20 1 0 35.0489 8.59917 2 20 1 0 18.5584 5.49752 2 -21 -1 0 18.4738 8.32900 2 21 -1 0 24.5887 7.21209 2 21 1 0 14.6351 5.18420 2 21 1 0 19.5770 6.56094 3 -21 1 0 26.6861 9.72275 2 22 -1 0 63.9700 10.2044 3 -22 -1 0 91.1572 14.5849 2 22 -1 0 60.6098 9.81243 2 22 1 0 71.3764 11.5716 3 -22 1 0 84.7883 15.3375 2 23 -1 0 139.394 16.8046 3 23 -1 0 181.097 16.7590 2 23 1 0 192.877 17.3777 3 23 1 0 185.269 16.3725 2 24 -1 0 23.9479 8.54353 3 -24 -1 0 37.0985 11.4583 2 24 -1 0 30.4056 8.17518 2 24 1 0 25.1153 8.40086 3 -24 1 0 27.9992 11.7140 2 24 1 0 26.7405 7.47884 2 25 -1 0 139.463 16.5206 3 -25 -1 0 189.302 24.9034 2 25 -1 0 139.023 16.0431 2 25 1 0 148.879 15.7116 2 25 1 0 144.676 16.0597 3 26 -1 0 31.3667 10.7922 3 26 1 0 51.9652 10.3690 3 26 1 0 40.7436 9.66662 2 0 -2 0 9999.99 485.909 4 0 -2 0 9996.14 486.463 3 0 2 0 9950.43 485.792 4 1 -2 0 13.1327 2.40042 3 -1 -2 0 10.6919 1.40625 5 1 -2 0 17.9764 2.27521 4 -1 -2 0 13.7232 2.16793 4 1 2 0 12.1835 2.02950 4 -2 -2 0 122.614 6.80941 5 -2 -2 0 123.091 7.88993 4 2 -2 0 126.588 8.46444 3 2 -2 0 119.253 6.79466 2 2 -2 0 124.358 7.87831 4 2 -2 0 116.507 6.74594 2 -2 2 0 119.371 8.30148 3 -2 2 0 125.380 8.43575 4 2 2 0 122.601 6.86172 5 3 -2 0 225.219 12.4052 2 3 -2 0 233.321 13.8635 3 -3 -2 0 222.458 11.7459 2 3 -2 0 230.536 13.2828 4 3 -2 0 224.065 12.3806 2 -3 -2 0 240.347 11.8393 2 -3 -2 0 229.454 12.0842 5 3 2 0 231.143 12.2063 5 -3 2 0 222.743 11.6557 2 -3 2 0 220.182 13.7803 3 -3 2 0 233.765 11.7558 2 -4 -2 0 1.04134 0.72459 2 -4 -2 0 0.71256 0.84251 3 4 -2 0 1.05568 1.03394 2 4 -2 0 1.00631 1.19521 4 -4 -2 0 0.69665 0.71507 5 4 -2 0 -0.4422 0.95220 2 4 -2 0 0.98761 1.31563 3 -4 -2 0 0.87382 0.84968 2 4 2 0 0.00358 0.72533 5 -4 2 0 -0.3325 0.94102 4 -4 2 0 0.69666 0.90207 2 -4 2 0 1.14346 0.85433 2 5 -2 0 6.81884 1.80057 2 5 -2 0 5.75056 1.91443 2 -5 -2 0 8.58254 1.48803 5 -5 -2 0 6.83940 1.68985 2 -5 -2 0 6.58839 1.68812 3 5 -2 0 5.79424 2.12556 4 -5 2 0 6.50997 1.62450 2 5 2 0 7.09121 1.37961 5 -5 2 0 8.24321 1.62723 2 5 2 0 7.12980 1.45779 2 -5 2 0 6.01741 1.97008 4 -6 -2 0 142.820 8.83030 2 6 -2 0 140.635 9.98260 3 -6 -2 0 132.076 8.94994 3 -6 -2 0 134.268 8.13508 2 6 -2 0 155.654 9.87738 4 6 -2 0 137.225 8.81336 2 -6 2 0 139.991 8.76124 2 6 2 0 132.420 8.39942 5 6 2 0 140.414 9.31322 3 -6 2 0 139.142 8.64399 2 6 2 0 140.319 7.90194 2 -7 -2 0 72.5868 5.78152 2 7 -2 0 67.3377 6.46334 3 7 -2 0 72.2009 6.55564 4 7 -2 0 77.0149 6.07901 2 -7 2 0 69.6829 6.25349 2 7 2 0 80.9349 6.68696 3 7 2 0 67.3109 4.93962 2 -7 2 0 66.1628 5.40276 2 7 2 0 75.1614 4.95292 2 7 2 0 72.7614 5.37749 5 8 -2 0 547.099 30.5075 3 -8 -2 0 556.973 33.1890 2 8 -2 0 538.856 30.4327 4 8 -2 0 528.920 29.1962 2 8 2 0 555.982 29.8852 3 8 2 0 568.422 28.4230 2 -8 2 0 523.511 29.2667 2 9 -2 0 311.669 18.8958 3 9 -2 0 303.942 19.0257 4 9 -2 0 316.877 17.8510 2 -9 -2 0 300.557 17.8329 2 9 2 0 309.166 18.2040 3 9 2 0 288.598 16.8513 2 -9 2 0 296.958 17.7036 2 9 2 0 270.903 16.9541 2 10 -2 0 435.501 26.3573 4 -10 -2 0 443.827 25.2411 2 10 -2 0 432.386 24.9037 2 10 -2 0 444.459 26.3372 3 -10 2 0 421.177 24.9516 2 10 2 0 459.203 24.0868 2 10 2 0 456.728 25.5894 3 11 -2 0 39.3349 5.70194 3 11 -2 0 40.3512 6.04676 4 -11 -2 0 40.0000 5.16122 2 11 -2 0 39.1287 4.97670 2 11 2 0 41.0147 4.31481 2 11 2 0 41.4910 5.15656 3 -11 2 0 43.4349 5.15040 2 12 -2 0 12.7389 4.72240 4 12 -2 0 6.58431 3.18751 3 -12 -2 0 13.0079 3.44198 2 12 -2 0 7.17623 3.08840 2 12 2 0 8.16586 3.02257 3 12 2 0 11.0497 2.66500 2 -12 2 0 9.97635 3.27016 2 13 -2 0 147.939 12.0238 2 -13 -2 0 167.843 12.9714 2 13 -2 0 175.052 15.0414 3 13 -2 0 161.511 14.1745 4 13 2 0 167.706 12.5238 3 -13 2 0 156.123 12.3971 2 13 2 0 147.074 10.9083 2 14 -2 0 284.218 18.7931 2 14 -2 0 251.008 18.9061 3 -14 -2 0 267.785 18.2483 2 14 2 0 274.532 18.3961 3 14 2 0 242.166 16.4362 2 15 -2 0 226.892 18.7027 4 15 -2 0 208.123 17.1091 3 -15 -2 0 230.453 16.4734 2 15 -2 0 213.492 15.9135 2 -15 2 0 220.358 16.1759 2 15 2 0 199.609 14.5036 2 15 2 0 222.920 17.2174 3 16 -2 0 615.960 38.0585 2 16 -2 0 664.836 42.1978 4 16 -2 0 623.919 40.0630 3 -16 2 0 742.492 39.8105 2 16 2 0 705.501 39.4049 3 16 2 0 629.903 37.1311 2 -17 -2 0 95.1346 10.7164 2 17 -2 0 94.4061 10.4051 2 17 -2 0 84.8701 11.5686 4 17 -2 0 79.6377 10.8305 3 -17 2 0 119.719 12.2758 2 17 2 0 80.8980 8.53758 2 17 2 0 75.7076 9.43804 3 -18 -2 0 4.57580 4.36142 2 18 -2 0 9.97897 4.98176 4 18 -2 0 8.59853 4.82777 3 18 -2 0 6.10843 3.82536 2 -18 2 0 0.54691 4.06247 2 18 2 0 4.02284 3.18199 3 18 2 0 0.78002 3.61352 2 19 -2 0 29.0216 7.29541 3 19 -2 0 24.5745 8.62761 4 19 -2 0 23.3078 6.54107 2 -19 -2 0 27.2681 7.37864 2 19 2 0 17.8711 5.71658 3 -19 2 0 30.9803 7.55807 2 19 2 0 23.1990 5.24629 2 20 -2 0 235.070 19.1162 2 20 -2 0 235.233 24.7405 4 -20 2 0 304.762 24.2571 2 20 2 0 260.304 19.9477 3 20 2 0 229.354 17.9987 2 21 -2 0 325.395 24.9638 2 21 -2 0 302.438 26.7242 3 -21 -2 0 293.361 28.4025 2 21 -2 0 352.480 29.7746 4 21 2 0 353.962 24.3173 2 -21 2 0 436.033 32.2880 2 21 2 0 396.562 26.4133 3 22 -2 0 228.697 20.7685 3 -22 -2 0 287.747 26.0407 2 22 -2 0 199.973 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