#------------------------------------------------------------------------------ #$Date: 2021-02-23 01:16:28 +0200 (Tue, 23 Feb 2021) $ #$Revision: 262136 $ #$URL: file:///home/coder/svn-repositories/cod/cif/4/00/38/4003869.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_4003869 loop_ _publ_author_name 'Fateev, Sergey A.' 'Petrov, Andrey A.' 'Marchenko, Ekaterina I.' 'Zubavichus, Yan V.' 'Khrustalev, Victor N.' 'Petrov, Andrey V.' 'Aksenov, Sergey M.' 'Goodilin, Eugene A.' 'Tarasov, Alexey B.' _publ_section_title ; FA2PbBr4: Synthesis, Structure, and Unusual Optical Properties of Two Polymorphs of Formamidinium-Based Layered (110) Hybrid Perovskite ; _journal_name_full 'Chemistry of Materials' _journal_paper_doi 10.1021/acs.chemmater.1c00382 _journal_year 2021 _chemical_formula_sum 'C4 Br8 N8 Pb2' _chemical_formula_weight 1213.71 _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _symmetry_cell_setting triclinic _symmetry_Int_Tables_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 65.92(3) _cell_angle_beta 73.01(3) _cell_angle_gamma 83.76(3) _cell_formula_units_Z 2 _cell_length_a 8.5642(17) _cell_length_b 11.884(2) _cell_length_c 14.312(3) _cell_measurement_reflns_used 500 _cell_measurement_temperature 100(2) _cell_measurement_theta_max 30.2 _cell_measurement_theta_min 3.2 _cell_volume 1271.7(6) _diffrn_ambient_temperature 100(2) _diffrn_measured_fraction_theta_full 0.99 _diffrn_measured_fraction_theta_max 0.99 _diffrn_measurement_device 'Rayonix SX165 CCD' _diffrn_measurement_method '/f scan' _diffrn_radiation_probe x-ray _diffrn_radiation_type synchrotron _diffrn_radiation_wavelength 0.80246 _diffrn_reflns_av_R_equivalents 0.1369 _diffrn_reflns_av_unetI/netI 0.1319 _diffrn_reflns_limit_h_max 10 _diffrn_reflns_limit_h_min -10 _diffrn_reflns_limit_k_max 15 _diffrn_reflns_limit_k_min -15 _diffrn_reflns_limit_l_max 18 _diffrn_reflns_limit_l_min -18 _diffrn_reflns_number 24310 _diffrn_reflns_theta_full 30.87 _diffrn_reflns_theta_max 30.87 _diffrn_reflns_theta_min 3.16 _exptl_absorpt_coefficient_mu 32.973 _exptl_absorpt_correction_T_max 0.06 _exptl_absorpt_correction_T_min 0.06 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details 'Scala (Evans, 2006)' _exptl_crystal_colour black _exptl_crystal_density_diffrn 3.1695 _exptl_crystal_description 'prism ' _exptl_crystal_F_000 1048 _refine_diff_density_max 20.87 _refine_diff_density_min -8.37 _refine_ls_extinction_coef 4100(600) _refine_ls_extinction_method 'B-C type 1 Gaussian isotropic (Becker & Coppens, 1974)' _refine_ls_goodness_of_fit_gt 2.77 _refine_ls_goodness_of_fit_ref 2.50 _refine_ls_hydrogen_treatment constr _refine_ls_number_constraints 0 _refine_ls_number_parameters 140 _refine_ls_number_reflns 5529 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.1677 _refine_ls_R_factor_gt 0.1620 _refine_ls_shift/su_max 0.0460 _refine_ls_shift/su_mean 0.0080 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details w=1/(\s^2^(I)+0.0016I^2^) _refine_ls_weighting_scheme sigma _refine_ls_wR_factor_gt 0.3524 _refine_ls_wR_factor_ref 0.3545 _reflns_number_gt 4446 _reflns_number_total 5529 _reflns_threshold_expression I>3\s(I) _cod_data_source_file cm1c00382_si_002.cif _cod_data_source_block FAPbBr _cod_depositor_comments ; The following automatic conversions were performed: data item '_diffrn_radiation_probe' value 'X-ray' was changed to 'x-ray' in accordance with the /home/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic dictionary named 'cif_core.dic' version 2.4.2 last updated on 2011-04-26. Automatic conversion script Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas ; _cod_database_code 4003869 loop_ _space_group_symop_id _space_group_symop_operation_xyz 1 x,y,z 2 -x,-y,-z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_adp_type _atom_site_U_iso_or_equiv _atom_site_site_symmetry_multiplicity _atom_site_occupancy _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_assembly _atom_site_disorder_group Pb1 Pb 0.67789(13) 0.69571(9) 0.15812(9) Uani 0.0218(5) 2 1 d . . . Pb2 Pb 0.33943(13) 0.81747(9) -0.18289(9) Uani 0.0213(5) 2 1 d . . . Br1 Br 1.0110(3) 0.7608(2) -0.0105(2) Uani 0.0270(12) 2 1 d . . . Br2 Br 0.7127(4) 0.9206(2) 0.2009(2) Uani 0.0277(11) 2 1 d . . . Br3 Br 0.3607(3) 0.6575(3) 0.3143(2) Uani 0.0272(11) 2 1 d . . . Br4 Br 0.6483(3) 0.4488(2) 0.1566(2) Uani 0.0271(11) 2 1 d . . . Br5 Br 0.8563(3) 0.5655(3) 0.3247(2) Uani 0.0284(12) 2 1 d . . . Br6 Br 0.5023(3) 0.7869(3) -0.0097(2) Uani 0.0272(11) 2 1 d . . . Br7 Br 0.6542(3) 0.8706(3) -0.3442(2) Uani 0.0275(11) 2 1 d . . . Br8 Br 0.1639(3) 0.8826(3) -0.3435(2) Uani 0.0276(11) 2 1 d . . . N1 N 0.757(3) 0.486(2) 0.827(2) Uiso 0.038(6) 2 1 d . . . N2 N 0.934(3) 0.592(2) 0.862(2) Uiso 0.037(6) 2 1 d . . . C1 C 0.781(3) 0.566(2) 0.862(2) Uiso 0.025(5) 2 1 d . . . N3 N 0.827(3) -0.014(2) 0.7823(19) Uiso 0.029(5) 2 1 d . . . N4 N 0.848(3) 0.086(2) 0.890(2) Uiso 0.032(5) 2 1 d . . . C2 C 0.754(4) 0.045(3) 0.846(2) Uiso 0.030(6) 2 1 d . . . N5 N 0.550(3) 0.178(2) 0.5408(19) Uiso 0.028(5) 2 1 d . . . N6 N 0.448(3) 0.379(2) 0.4756(19) Uiso 0.029(5) 2 1 d . . . C3 C 0.531(3) 0.288(2) 0.462(2) Uiso 0.022(5) 2 1 d . . . N7 N 0.001(3) 0.281(2) 0.444(2) Uiso 0.041(6) 2 1 d . . . N8 N 0.115(3) 0.193(2) 0.585(2) Uiso 0.031(5) 2 1 d . . . C4 C 0.035(4) 0.283(3) 0.529(2) Uiso 0.034(6) 2 1 d . . . loop_ _atom_site_aniso_label _atom_site_aniso_type_symbol _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 Pb1 Pb 0.0185(6) 0.0186(6) 0.0357(7) -0.0006(4) -0.0101(4) -0.0160(4) Pb2 Pb 0.0181(6) 0.0179(5) 0.0354(7) -0.0007(4) -0.0102(4) -0.0158(4) Br1 Br 0.0193(14) 0.0287(14) 0.0394(17) -0.0049(12) -0.0058(12) -0.0200(12) Br2 Br 0.0311(15) 0.0181(12) 0.0423(16) 0.0008(11) -0.0121(12) -0.0189(11) Br3 Br 0.0224(14) 0.0268(13) 0.0366(16) -0.0002(11) -0.0078(11) -0.0167(11) Br4 Br 0.0236(14) 0.0201(12) 0.0479(17) -0.0001(11) -0.0133(12) -0.0210(11) Br5 Br 0.0248(14) 0.0294(14) 0.0404(17) 0.0057(12) -0.0153(12) -0.0201(12) Br6 Br 0.0231(14) 0.0277(13) 0.0374(16) -0.0005(11) -0.0144(11) -0.0149(11) Br7 Br 0.0211(14) 0.0284(14) 0.0397(17) -0.0015(11) -0.0081(11) -0.0198(12) Br8 Br 0.0232(14) 0.0296(14) 0.0404(17) 0.0028(12) -0.0137(12) -0.0213(12) loop_ _atom_type_symbol _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C 0.0050 0.0020 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1' H 0.0000 0.0000 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1' Br -0.9621 2.9511 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1' N 0.0090 0.0040 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1' Pb -7.4040 10.6371 'International Tables Vol C tables 4.2.6.8 and 6.1.1.1' loop_ _diffrn_standard_refln_index_h _diffrn_standard_refln_index_k _diffrn_standard_refln_index_l ? ? ? 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_2 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag Br1 Pb1 Br2 . . . 89.05(9) ? Br1 Pb1 Br3 . . . 174.85(10) ? Br1 Pb1 Br4 . . . 95.18(9) ? Br1 Pb1 Br5 . . . 88.50(9) ? Br1 Pb1 Br6 . . . 91.33(9) ? Br2 Pb1 Br3 . . . 86.27(10) ? Br2 Pb1 Br4 . . . 169.50(10) ? Br2 Pb1 Br5 . . . 84.54(10) ? Br2 Pb1 Br6 . . . 104.44(10) ? Br3 Pb1 Br4 . . . 89.79(9) ? Br3 Pb1 Br5 . . . 93.18(9) ? Br3 Pb1 Br6 . . . 87.77(9) ? Br4 Pb1 Br5 . . . 85.96(10) ? Br4 Pb1 Br6 . . . 85.10(10) ? Br5 Pb1 Br6 . . . 171.02(11) ? Br1 Pb2 Br2 1_455 . 2_675 85.67(9) ? Br1 Pb2 Br4 1_455 . 2_665 88.77(9) ? Br1 Pb2 Br6 1_455 . . 87.77(9) ? Br1 Pb2 Br7 1_455 . . 179.11(11) ? Br1 Pb2 Br8 1_455 . . 89.19(9) ? Br2 Pb2 Br4 2_675 . 2_665 173.76(9) ? Br2 Pb2 Br6 2_675 . . 84.68(10) ? Br2 Pb2 Br7 2_675 . . 94.30(9) ? Br2 Pb2 Br8 2_675 . . 86.46(10) ? Br4 Pb2 Br6 2_665 . . 97.95(10) ? Br4 Pb2 Br7 2_665 . . 91.30(9) ? Br4 Pb2 Br8 2_665 . . 90.63(10) ? Br6 Pb2 Br7 . . . 91.34(10) ? Br6 Pb2 Br8 . . . 170.83(10) ? Br7 Pb2 Br8 . . . 91.70(10) ? Pb1 Br1 Pb2 . . 1_655 177.30(14) ? Pb1 Br1 N2 . . 1_554 93.4(4) ? Pb1 Br1 N4 . . 2_766 93.8(4) ? Pb2 Br1 N2 1_655 . 1_554 83.9(4) ? Pb2 Br1 N4 1_655 . 2_766 88.9(4) ? N2 Br1 N4 1_554 . 2_766 170.8(6) ? Pb1 Br2 Pb2 . . 2_675 156.63(13) ? Pb1 Br2 N5 . . 2_666 97.7(5) ? Pb1 Br2 N8 . . 2_666 104.3(5) ? Pb2 Br2 N5 2_675 . 2_666 88.9(4) ? Pb2 Br2 N8 2_675 . 2_666 98.5(5) ? N5 Br2 N8 2_666 . 2_666 61.7(6) ? Pb1 Br3 N1 . . 2_666 86.2(4) ? Pb1 Br3 N6 . . . 94.6(4) ? N1 Br3 N6 2_666 . . 87.8(7) ? Pb1 Br4 Pb2 . . 2_665 169.03(13) ? Pb1 Br4 N1 . . 2_666 86.5(5) ? Pb1 Br4 N2 . . 2_766 88.4(5) ? Pb2 Br4 N1 2_665 . 2_666 101.7(5) ? Pb2 Br4 N2 2_665 . 2_766 83.4(5) ? N1 Br4 N2 2_666 . 2_766 174.9(7) ? Pb1 Br5 N1 . . 2_766 102.5(5) ? Pb1 Br5 N6 . . 2_666 93.6(4) ? Pb1 Br5 N7 . . 1_655 138.9(7) ? N1 Br5 N6 2_766 . 2_666 161.3(8) ? N1 Br5 N7 2_766 . 1_655 67.4(6) ? N6 Br5 N7 2_666 . 1_655 106.1(6) ? Pb1 Br6 Pb2 . . . 165.86(13) ? Pb1 Br6 N4 . . 2_666 101.3(5) ? Pb2 Br6 N4 . . 2_666 88.3(5) ? Pb2 Br7 N3 . . 1_564 94.6(4) ? Pb2 Br7 N5 . . 1_564 90.9(4) ? Pb2 Br7 N7 . . 2_665 140.8(4) ? N3 Br7 N5 1_564 . 1_564 81.4(7) ? N3 Br7 N7 1_564 . 2_665 98.2(7) ? N5 Br7 N7 1_564 . 2_665 127.6(5) ? Pb2 Br8 N3 . . 1_464 97.5(5) ? Pb2 Br8 N5 . . 2_665 101.3(5) ? Pb2 Br8 N7 . . 2_565 134.7(4) ? Pb2 Br8 N8 . . 1_564 102.6(6) ? N3 Br8 N5 1_464 . 2_665 160.8(6) ? N3 Br8 N7 1_464 . 2_565 101.0(7) ? N3 Br8 N8 1_464 . 1_564 60.9(5) ? N5 Br8 N7 2_665 . 2_565 68.2(7) ? N5 Br8 N8 2_665 . 1_564 110.5(5) ? N7 Br8 N8 2_565 . 1_564 122.5(7) ? Br3 N1 Br4 2_666 . 2_666 73.6(7) ? Br3 N1 Br5 2_666 . 2_766 79.7(7) ? Br3 N1 C1 2_666 . . 163(2) ? Br4 N1 Br5 2_666 . 2_766 148.1(11) ? Br4 N1 C1 2_666 . . 95.5(18) ? Br5 N1 C1 2_766 . . 106.1(18) ? Br1 N2 Br4 1_556 . 2_766 75.9(7) ? Br1 N2 C1 1_556 . . 125(2) ? Br4 N2 C1 2_766 . . 157(2) ? N1 C1 N2 . . . 122(3) ? Br7 N3 Br8 1_546 . 1_646 81.7(7) ? Br7 N3 C2 1_546 . . 128(2) ? Br8 N3 C2 1_646 . . 150(2) ? Br1 N4 Br6 2_766 . 2_666 75.2(6) ? Br1 N4 C2 2_766 . . 164.0(19) ? Br6 N4 C2 2_666 . . 89.4(17) ? N3 C2 N4 . . . 119(3) ? Br2 N5 Br7 2_666 . 1_546 77.1(4) ? Br2 N5 Br8 2_666 . 2_665 150.9(7) ? Br2 N5 C3 2_666 . . 122.3(17) ? Br7 N5 Br8 1_546 . 2_665 74.0(5) ? Br7 N5 C3 1_546 . . 158(2) ? Br8 N5 C3 2_665 . . 85.5(15) ? Br3 N6 Br5 . . 2_666 85.5(6) ? Br3 N6 C3 . . . 134.7(18) ? Br5 N6 C3 2_666 . . 138.3(15) ? N5 C3 N6 . . . 126(3) ? Br5 N7 Br7 1_455 . 2_665 129.8(7) ? Br5 N7 Br8 1_455 . 2_565 100.2(9) ? Br5 N7 C4 1_455 . . 105(2) ? Br7 N7 Br8 2_665 . 2_565 77.8(7) ? Br7 N7 C4 2_665 . . 101.2(19) ? Br8 N7 C4 2_565 . . 146.9(18) ? Br2 N8 Br8 2_666 . 1_546 71.7(5) ? Br2 N8 C4 2_666 . . 146(3) ? Br8 N8 C4 1_546 . . 139(3) ? N7 C4 N8 . . . 121(3) ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_1 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Pb1 Br1 . . 3.081(3) ? Pb1 Br2 . . 3.037(4) ? Pb1 Br3 . . 2.911(3) ? Pb1 Br4 . . 2.982(4) ? Pb1 Br5 . . 3.003(4) ? Pb1 Br6 . . 2.973(4) ? Pb2 Br1 . 1_455 3.074(3) ? Pb2 Br2 . 2_675 3.010(3) ? Pb2 Br4 . 2_665 3.024(3) ? Pb2 Br6 . . 3.065(4) ? Pb2 Br7 . . 2.922(3) ? Pb2 Br8 . . 2.908(4) ? Br1 N2 . 1_554 3.43(4) ? Br1 N4 . 2_766 3.47(3) ? Br2 N5 . 2_666 3.50(2) ? Br2 N8 . 2_666 3.50(3) ? Br3 N1 . 2_666 3.51(4) ? Br3 N6 . . 3.33(2) ? Br4 N1 . 2_666 3.43(3) ? Br4 N2 . 2_766 3.51(3) ? Br5 N1 . 2_766 3.53(3) ? Br5 N6 . 2_666 3.49(3) ? Br5 N7 . 1_655 3.39(3) ? Br6 N4 . 2_666 3.51(3) ? Br7 N3 . 1_564 3.38(3) ? Br7 N5 . 1_564 3.48(2) ? Br7 N7 . 2_665 3.53(3) ? Br8 N3 . 1_464 3.33(2) ? Br8 N5 . 2_665 3.42(3) ? Br8 N7 . 2_565 3.45(4) ? Br8 N8 . 1_564 3.42(2) ? N1 C1 . . 1.31(5) ? N2 C1 . . 1.38(4) ? N3 C2 . . 1.35(4) ? N4 C2 . . 1.38(5) ? N5 C3 . . 1.37(3) ? N6 C3 . . 1.28(4) ? N7 C4 . . 1.35(5) ? N8 C4 . . 1.31(4) ? loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma _refln_observed_status 2 0 0 22903.80 18986.60 1768.98 o 3 0 0 86099.60 98786.00 9204.99 o 4 0 0 19704.40 17563.80 1631.87 o 5 0 0 13303.30 14952.10 2532.59 o 6 0 0 116095.00 178686.00 19582.80 o 7 0 0 3953.02 7628.90 726.77 o 8 0 0 50.46 41.49 102.63 < 9 0 0 6764.05 6077.27 596.46 o 10 0 0 3860.03 2926.81 353.77 o -10 1 0 1118.62 964.69 181.56 o -9 1 0 7653.71 8336.41 858.42 o -8 1 0 10.69 63.32 109.18 < -7 1 0 402.60 786.75 113.64 o -6 1 0 7303.22 9033.16 851.93 o -5 1 0 719.11 807.52 126.93 o -4 1 0 11858.70 11401.80 1063.35 o -3 1 0 6747.94 6043.28 789.63 o -2 1 0 253.44 249.42 39.38 o -1 1 0 0.97 43.67 56.77 < 1 1 0 202.32 208.00 32.84 o 2 1 0 3598.77 3756.05 345.74 o 3 1 0 2411.71 2176.16 201.25 o 4 1 0 11.03 87.34 61.14 < 5 1 0 3934.27 5172.08 484.05 o 6 1 0 13310.80 18793.20 1765.53 o 7 1 0 110.46 176.91 102.65 < 8 1 0 1370.12 1560.89 177.32 o 9 1 0 2298.86 2104.50 256.49 o 10 1 0 208.06 264.29 148.53 < -10 2 0 6019.05 6354.60 1270.04 o -9 2 0 2687.91 2228.71 322.46 o -8 2 0 112.93 2625.12 371.27 o -7 2 0 1687.17 24633.20 2750.17 o -6 2 0 8924.41 11188.10 1529.10 o -5 2 0 15944.60 12996.10 1496.91 o -4 2 0 771.84 865.00 122.63 o -3 2 0 38789.40 41454.40 9971.13 o -2 2 0 41524.70 50349.40 12056.70 o -1 2 0 5.16 8570.64 1115.82 o 0 2 0 45046.90 45794.80 5995.72 o 1 2 0 41941.00 42093.00 3890.67 o 2 2 0 126.42 417.40 59.00 o 3 2 0 31260.10 29844.70 2777.25 o 4 2 0 3419.05 3334.92 311.82 o 5 2 0 224.04 742.89 91.77 o 6 2 0 40455.60 97489.40 9139.63 o 7 2 0 21119.40 22237.70 2087.36 o 8 2 0 407.96 472.00 113.63 o 9 2 0 9249.01 8719.43 825.14 o 10 2 0 1076.82 551.21 139.99 o -10 3 0 2613.85 2787.02 712.65 o -9 3 0 197.65 286.13 229.34 < -8 3 0 231.83 2761.12 690.28 o -7 3 0 949.13 1301.75 350.05 o -6 3 0 9506.30 12407.00 2995.10 o -5 3 0 1584.60 2031.10 522.03 o -4 3 0 3775.78 3800.76 920.32 o -3 3 0 1586.18 1833.63 452.91 o -2 3 0 10.27 427.99 135.38 o -1 3 0 1693.95 1910.43 172.27 o 0 3 0 15111.40 13791.70 1474.64 o 1 3 0 169.20 222.97 45.91 o 2 3 0 1398.35 1020.85 99.00 o 3 3 0 912.81 1001.78 107.41 o 4 3 0 643.14 1488.08 148.81 o 5 3 0 2333.46 2351.81 221.99 o 6 3 0 2827.07 3521.58 340.73 o 7 3 0 4093.47 4324.65 407.36 o 8 3 0 4703.31 5050.12 477.92 o 9 3 0 1319.90 1573.46 179.45 o 10 3 0 1413.96 978.26 151.01 o -10 4 0 12010.80 12993.90 3162.79 o -9 4 0 383.61 9054.25 2202.39 o -8 4 0 3461.74 13574.20 3258.42 o -7 4 0 18367.10 24372.70 5861.12 o -6 4 0 275.40 589.92 229.41 < -5 4 0 7059.53 7521.85 1810.94 o -4 4 0 128018.00 192355.00 46362.20 o -3 4 0 3096.82 49476.20 11797.40 o -2 4 0 29400.90 30494.30 5113.75 o -1 4 0 57775.90 68700.00 6448.72 o 0 4 0 1950.90 2021.47 187.58 o 1 4 0 21479.60 18520.40 1626.09 o 2 4 0 156636.00 208230.00 19252.60 o 3 4 0 3915.82 3427.59 316.84 o 4 4 0 9338.45 9349.44 847.29 o 5 4 0 8949.30 15015.80 1401.44 o 6 4 0 61.64 179.07 109.19 < 7 4 0 9827.19 9517.00 888.25 o 8 4 0 11223.90 11166.30 1035.78 o 9 4 0 2347.48 2045.22 223.59 o -9 5 0 159.85 445.55 244.62 < -8 5 0 7530.67 9239.25 2239.01 o -7 5 0 2513.48 4280.68 1050.97 o -6 5 0 1712.38 2185.03 550.09 o -5 5 0 708.11 874.93 258.11 o -4 5 0 101.58 218.41 135.42 < -3 5 0 6120.11 6500.83 1568.40 o -2 5 0 28263.60 29101.30 3148.31 o -1 5 0 4208.09 3919.32 355.49 o 0 5 0 1868.01 1690.44 154.08 o 1 5 0 7081.13 5711.22 519.20 o 2 5 0 10043.70 9260.18 797.55 o 3 5 0 5872.16 9293.63 852.36 o 4 5 0 1422.09 11654.10 1072.02 o 5 5 0 5343.60 6917.02 643.70 o 6 5 0 717.13 793.83 126.84 o 7 5 0 2783.71 2581.47 252.44 o 8 5 0 2463.36 2247.75 228.06 o 9 5 0 24.33 63.32 128.83 < -9 6 0 3977.36 4663.53 1153.80 o -8 6 0 327.73 3585.14 884.81 o -7 6 0 26818.80 38650.90 9316.18 o -6 6 0 2813.87 4115.38 1007.98 o -5 6 0 2618.70 3696.82 904.98 o -4 6 0 55992.70 71511.30 17207.80 o -3 6 0 15645.30 19662.70 6697.29 < -2 6 0 4863.70 8440.37 787.27 o -1 6 0 65359.20 74357.50 6885.15 o 0 6 0 982.25 876.43 89.83 o 1 6 0 467.63 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741.47 708.32 205.50 o 4 4 17 123.93 240.23 161.61 < 5 4 17 1301.15 1072.19 247.26 o 6 4 17 160.25 120.12 168.17 < 0 5 17 333.60 524.32 139.82 o 1 5 17 14.37 -24.02 165.95 < 2 5 17 1574.33 1970.26 315.24 o 3 5 17 3401.51 3153.17 445.75 o 4 5 17 309.86 2514.49 391.05 o 5 5 17 8163.12 6992.13 929.33 o 6 5 17 22.63 -2.18 168.13 < 0 6 17 11.21 198.70 172.50 < 1 6 17 29.11 82.98 163.77 < 2 6 17 4097.05 3855.80 499.01 o 3 6 17 1410.47 1212.49 229.80 o 4 6 17 45.77 78.61 183.43 < 5 6 17 2581.60 1701.58 282.87 o 6 6 17 270.91 141.99 161.65 < 0 7 17 2386.32 2095.52 306.88 o 1 7 17 161.98 148.52 190.01 < 2 7 17 25.85 43.67 192.16 < 3 7 17 75.24 91.72 152.86 < 4 7 17 1355.35 1365.55 223.21 o 5 7 17 795.04 662.46 148.67 o 6 7 17 2522.91 1521.56 221.44 o 0 8 17 16.07 54.59 170.32 < 1 8 17 2107.27 1478.94 241.01 o 2 8 17 300.83 681.59 163.84 o 3 8 17 1232.48 1163.98 190.35 o 4 8 17 5921.86 5264.87 436.53 o 5 8 17 601.53 365.00 159.55 < 6 8 17 190.57 203.13 144.15 < 0 9 17 1396.21 1234.27 196.96 o 1 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