data_hansblockite _audit_creation_method SHELXL-2008 _chemical_name_systematic ; ? ; _chemical_name_common 'hansblockite' _chemical_melting_point ? _chemical_formula_moiety 'Bi0.70 Cu0.70 Hg0.30 Pb0.30 Se2' _chemical_formula_sum 'Bi0.70 Cu0.70 Hg0.30 Pb0.30 Se2' _chemical_formula_weight 471.02 loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'Cu' 'Cu' 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Hg' 'Hg' -2.3894 9.2266 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Bi' 'Bi' -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Pb' 'Pb' -3.3944 10.1111 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Se' 'Se' -0.0929 2.2259 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_H-M_alt 'P 21/c' _space_group_name_Hall '-P 2ybc' _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. ; loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' _cell_length_a 6.8530(10) _cell_length_b 7.6350(10) _cell_length_c 7.2640(10) _cell_angle_alpha 90 _cell_angle_beta 97.680(10) _cell_angle_gamma 90 _cell_volume 376.66(9) _cell_formula_units_Z 4 _cell_measurement_temperature 293(2) _cell_measurement_reflns_used 184 _cell_measurement_theta_min 4.9 _cell_measurement_theta_max 15.8 _exptl_crystal_description block _exptl_crystal_colour black _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _exptl_crystal_density_diffrn 8.306 _exptl_crystal_F_000 780 _exptl_transmission_factor_min ? _exptl_transmission_factor_max ? _exptl_crystal_size_max 0.055 _exptl_crystal_size_mid 0.040 _exptl_crystal_size_min 0.035 _exptl_absorpt_coefficient_mu 81.278 _shelx_estimated_absorpt_T_min ? _shelx_estimated_absorpt_T_max ? _exptl_absorpt_correction_type 'gaussian' _exptl_absorpt_correction_T_min 0.214 _exptl_absorpt_correction_T_max 0.581 _exptl_absorpt_process_details 'ABSPACK (Oxford Diffraction, 2006)' _exptl_special_details ; ? ; _diffrn_ambient_temperature 293(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_source 'fine-focus tube' _diffrn_measurement_device_type 'Oxford Xcalibur 3' _diffrn_measurement_method '\w scans' _diffrn_detector_area_resol_mean ? _diffrn_reflns_number 6599 _diffrn_reflns_av_unetI/netI 0.5807 _diffrn_reflns_av_R_equivalents 0.0308 _diffrn_reflns_limit_h_min -11 _diffrn_reflns_limit_h_max 11 _diffrn_reflns_limit_k_min -12 _diffrn_reflns_limit_k_max 12 _diffrn_reflns_limit_l_min -11 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_theta_min 5.666 _diffrn_reflns_theta_max 34.993 _diffrn_reflns_theta_full 25.242 _diffrn_measured_fraction_theta_max 0.995 _diffrn_measured_fraction_theta_full 0.983 _diffrn_reflns_Laue_measured_fraction_max 0.995 _diffrn_reflns_Laue_measured_fraction_full 0.983 _diffrn_reflns_point_group_measured_fraction_max 0.995 _diffrn_reflns_point_group_measured_fraction_full 0.983 _reflns_number_total 1627 _reflns_number_gt 713 _reflns_threshold_expression 'I > 2\s(I)' _reflns_Friedel_coverage 0.000 _reflns_Friedel_fraction_max . _reflns_Friedel_fraction_full . _reflns_special_details ; Data were apparently pre-merged, so _diffrn_reflns_number etc. will have to be added later. Reflections were merged by SHELXL according to the crystal class for the calculation of statistics and refinement. _reflns_Friedel_fraction is defined as the number of unique Friedel pairs measured divided by the number that would be possible theoretically, ignoring centric projections and systematic absences. ; _computing_data_collection 'CrysAlis (Oxford Diffraction 2006)' _computing_cell_refinement 'CrysAlis (Oxford Diffraction 2006)' _computing_data_reduction 'CrysAlis (Oxford Diffraction 2006)' _computing_structure_solution 'SHELXS-97 (Sheldrick, 2008)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 2008)' _computing_molecular_graphics 'Diamond (Brandenburg, 2001)' _computing_publication_material 'SHELXL-97 (Sheldrick, 2008)' _refine_special_details ; ? ; _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme calc _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0873P)^2^] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens none _refine_ls_hydrogen_treatment undef _refine_ls_extinction_method none _refine_ls_extinction_coef . _refine_ls_number_reflns 1627 _refine_ls_number_parameters 39 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0345 _refine_ls_R_factor_gt 0.0314 _refine_ls_wR_factor_ref 0.0777 _refine_ls_wR_factor_gt 0.0774 _refine_ls_goodness_of_fit_ref 0.934 _refine_ls_restrained_S_all 0.934 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Cu Cu 0.0709(2) 0.66301(18) 0.05305(17) 0.0154(4) Uani 0.708(10) 1 d . . P . . Hg Hg 0.0709(2) 0.66301(18) 0.05305(17) 0.0154(4) Uani 0.292(10) 1 d . . P . . Bi Bi 0.30870(11) 0.05019(9) 0.20049(9) 0.0192(2) Uani 0.992(10) 1 d . . P . . Se1 Se 0.0951(3) 0.3895(3) 0.2764(3) 0.0228(5) Uani 1 1 d . . . . . Se2 Se 0.5869(3) 0.2728(3) 0.0010(3) 0.0215(5) Uani 1 1 d . . . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Cu 0.0153(7) 0.0137(6) 0.0172(6) 0.0005(4) 0.0021(4) -0.0001(5) Hg 0.0153(7) 0.0137(6) 0.0172(6) 0.0005(4) 0.0021(4) -0.0001(5) Bi 0.0193(3) 0.0181(3) 0.0204(3) 0.0000(2) 0.0029(2) 0.0000(3) Se1 0.0226(10) 0.0211(9) 0.0248(10) 0.0003(7) 0.0040(7) -0.0006(8) Se2 0.0207(10) 0.0208(9) 0.0230(8) -0.0002(7) 0.0029(7) 0.0005(8) _geom_special_details ; All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. ; loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 _geom_bond_publ_flag Cu Se2 2.478(3) 3_665 ? Cu Se1 2.489(2) 2 ? Cu Se1 2.541(3) 3_565 ? Cu Se1 2.636(2) . ? Cu Hg 2.745(3) 3_565 ? Cu Cu 2.745(3) 3_565 ? Bi Se2 3.003(2) 3_655 ? Bi Se2 3.019(2) 4_566 ? Bi Se2 3.047(2) 2_645 ? Bi Se1 3.052(2) 2_545 ? Bi Se2 3.060(2) . ? Bi Se1 3.062(2) . ? Bi Se1 3.262(2) 4_565 ? Bi Hg 3.4583(15) 2_545 ? Bi Hg 3.4748(16) 1_545 ? Se1 Hg 2.489(2) 2_545 ? Se1 Cu 2.489(2) 2_545 ? Se1 Hg 2.541(3) 3_565 ? Se1 Cu 2.541(3) 3_565 ? Se1 Bi 3.052(2) 2 ? Se1 Bi 3.262(2) 4_566 ? Se2 Hg 2.478(3) 3_665 ? Se2 Cu 2.478(3) 3_665 ? Se2 Bi 3.003(2) 3_655 ? Se2 Bi 3.019(2) 4_565 ? Se2 Bi 3.047(2) 2_655 ? loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle_publ_flag Se2 Cu Se1 116.53(9) 3_665 2 ? Se2 Cu Se1 101.32(9) 3_665 3_565 ? Se1 Cu Se1 113.66(10) 2 3_565 ? Se2 Cu Se1 105.73(9) 3_665 . ? Se1 Cu Se1 103.85(5) 2 . ? Se1 Cu Se1 115.99(7) 3_565 . ? Se2 Cu Hg 116.23(9) 3_665 3_565 ? Se1 Cu Hg 126.97(9) 2 3_565 ? Se1 Cu Hg 59.68(7) 3_565 3_565 ? Se1 Cu Hg 56.31(7) . 3_565 ? Se2 Cu Cu 116.23(9) 3_665 3_565 ? Se1 Cu Cu 126.97(9) 2 3_565 ? Se1 Cu Cu 59.68(7) 3_565 3_565 ? Se1 Cu Cu 56.31(7) . 3_565 ? Hg Cu Cu 0.00(8) 3_565 3_565 ? Se2 Bi Se2 123.47(5) 3_655 4_566 ? Se2 Bi Se2 74.18(3) 3_655 2_645 ? Se2 Bi Se2 74.39(7) 4_566 2_645 ? Se2 Bi Se1 88.49(6) 3_655 2_545 ? Se2 Bi Se1 129.04(6) 4_566 2_545 ? Se2 Bi Se1 79.05(6) 2_645 2_545 ? Se2 Bi Se2 91.22(6) 3_655 . ? Se2 Bi Se2 73.77(4) 4_566 . ? Se2 Bi Se2 128.41(4) 2_645 . ? Se1 Bi Se2 151.19(6) 2_545 . ? Se2 Bi Se1 159.00(7) 3_655 . ? Se2 Bi Se1 76.22(6) 4_566 . ? Se2 Bi Se1 122.16(6) 2_645 . ? Se1 Bi Se1 82.61(3) 2_545 . ? Se2 Bi Se1 87.61(6) . . ? Se2 Bi Se1 76.21(6) 3_655 4_565 ? Se2 Bi Se1 141.27(6) 4_566 4_565 ? Se2 Bi Se1 143.45(6) 2_645 4_565 ? Se1 Bi Se1 79.22(6) 2_545 4_565 ? Se2 Bi Se1 72.76(6) . 4_565 ? Se1 Bi Se1 83.44(6) . 4_565 ? Se2 Bi Hg 134.56(5) 3_655 2_545 ? Se2 Bi Hg 87.72(5) 4_566 2_545 ? Se2 Bi Hg 85.76(5) 2_645 2_545 ? Se1 Bi Hg 47.26(4) 2_545 2_545 ? Se2 Bi Hg 131.78(5) . 2_545 ? Se1 Bi Hg 44.37(4) . 2_545 ? Se1 Bi Hg 100.38(5) 4_565 2_545 ? Se2 Bi Hg 44.24(5) 3_655 1_545 ? Se2 Bi Hg 145.94(5) 4_566 1_545 ? Se2 Bi Hg 71.58(5) 2_645 1_545 ? Se1 Bi Hg 44.25(5) 2_545 1_545 ? Se2 Bi Hg 128.52(5) . 1_545 ? Se1 Bi Hg 124.03(5) . 1_545 ? Se1 Bi Hg 72.32(5) 4_565 1_545 ? Hg Bi Hg 90.99(3) 2_545 1_545 ? Hg Se1 Cu 0.00(7) 2_545 2_545 ? Hg Se1 Hg 100.49(9) 2_545 3_565 ? Cu Se1 Hg 100.49(9) 2_545 3_565 ? Hg Se1 Cu 100.49(9) 2_545 3_565 ? Cu Se1 Cu 100.49(9) 2_545 3_565 ? Hg Se1 Cu 0.00(9) 3_565 3_565 ? Hg Se1 Cu 149.46(10) 2_545 . ? Cu Se1 Cu 149.46(10) 2_545 . ? Hg Se1 Cu 64.01(7) 3_565 . ? Cu Se1 Cu 64.01(7) 3_565 . ? Hg Se1 Bi 76.92(7) 2_545 2 ? Cu Se1 Bi 76.92(7) 2_545 2 ? Hg Se1 Bi 79.63(7) 3_565 2 ? Cu Se1 Bi 79.63(7) 3_565 2 ? Cu Se1 Bi 74.48(6) . 2 ? Hg Se1 Bi 76.29(6) 2_545 . ? Cu Se1 Bi 76.29(6) 2_545 . ? Hg Se1 Bi 82.04(7) 3_565 . ? Cu Se1 Bi 82.04(7) 3_565 . ? Cu Se1 Bi 123.49(8) . . ? Bi Se1 Bi 143.97(8) 2 . ? Hg Se1 Bi 78.77(7) 2_545 4_566 ? Cu Se1 Bi 78.77(7) 2_545 4_566 ? Hg Se1 Bi 179.03(9) 3_565 4_566 ? Cu Se1 Bi 179.03(9) 3_565 4_566 ? Cu Se1 Bi 116.93(8) . 4_566 ? Bi Se1 Bi 100.78(6) 2 4_566 ? Bi Se1 Bi 97.16(7) . 4_566 ? Hg Se2 Cu 0.00(6) 3_665 3_665 ? Hg Se2 Bi 78.05(7) 3_665 3_655 ? Cu Se2 Bi 78.05(7) 3_665 3_655 ? Hg Se2 Bi 108.46(8) 3_665 4_565 ? Cu Se2 Bi 108.46(8) 3_665 4_565 ? Bi Se2 Bi 100.59(6) 3_655 4_565 ? Hg Se2 Bi 80.68(7) 3_665 2_655 ? Cu Se2 Bi 80.68(7) 3_665 2_655 ? Bi Se2 Bi 150.36(9) 3_655 2_655 ? Bi Se2 Bi 105.61(7) 4_565 2_655 ? Hg Se2 Bi 147.96(9) 3_665 . ? Cu Se2 Bi 147.96(9) 3_665 . ? Bi Se2 Bi 88.78(6) 3_655 . ? Bi Se2 Bi 102.58(7) 4_565 . ? Bi Se2 Bi 98.68(6) 2_655 . ? _refine_diff_density_max 1.274 _refine_diff_density_min -1.333 _refine_diff_density_rms 0.112 # # h,k,l, Fc-squared, Fo-squared, sigma(Fo-squared), status flag # data_shelx _shelx_title ' PHASE B in P 21/c' _shelx_refln_list_code 4 _shelx_F_calc_maximum 332.92 _exptl_crystal_F_000 780.00 _reflns_d_resolution_high 0.6197 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' _cell_length_a 6.8530 _cell_length_b 7.6350 _cell_length_c 7.2640 _cell_angle_alpha 90.000 _cell_angle_beta 97.680 _cell_angle_gamma 90.000 _shelx_F_squared_multiplier 1.000 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 3 0 0 53320.35 50541.64 367.95 o 4 0 0 12092.83 11241.27 671.74 o 5 0 0 53746.91 51121.88 667.75 o 6 0 0 7824.59 7418.09 901.02 o 7 0 0 141.11 119.74 1048.26 o 8 0 0 24570.10 23584.45 263.28 o 9 0 0 20.50 24.69 383.77 o 10 0 0 5974.26 5809.71 323.16 o 2 1 0 88.47 150.49 545.05 o 3 1 0 30941.29 28883.26 3303.40 o 4 1 0 4702.43 4472.14 163.94 o 5 1 0 9824.08 9286.81 595.46 o 6 1 0 7897.67 7641.61 4645.40 o 7 1 0 1178.23 1109.31 849.73 o 8 1 0 840.18 804.49 1803.67 o 9 1 0 343.11 306.89 593.98 o 10 1 0 459.94 426.64 1508.31 o 2 2 0 52182.95 19711.76 6497.26 o 3 2 0 19588.62 33147.26 59500.42 o 4 2 0 3319.86 3165.92 1062.90 o 5 2 0 29585.27 27947.21 349.77 o 6 2 0 19918.11 18926.49 1192.69 o 7 2 0 1895.10 1947.66 538.54 o 8 2 0 1808.82 1700.34 268.61 o 9 2 0 985.14 949.07 466.40 o 10 2 0 1346.61 1315.83 513.12 o 2 3 0 17472.47 16144.04 410.97 o 3 3 0 3564.31 3297.64 103568.75 o 4 3 0 16840.88 26510.89 5258.60 o 5 3 0 90.08 88.70 2637.87 o 6 3 0 10067.57 9564.29 10019.45 o 7 3 0 630.57 588.81 1292.33 o 8 3 0 273.09 259.15 105.85 o 9 3 0 8856.03 8470.05 1416.95 o 10 3 0 1217.78 1129.57 1378.66 o 2 4 0 6983.81 6540.28 265.21 o 3 4 0 3171.89 2983.79 2677.20 o 4 4 0 798.63 740.18 924.08 o 5 4 0 5865.40 5323.94 1518.51 o 6 4 0 3178.19 3002.86 37397.81 o 7 4 0 8066.35 7493.93 3093.78 o 8 4 0 119.59 107.32 74.06 o 9 4 0 6.01 4.88 2482.80 o 10 4 0 211.28 205.04 1295.88 o 1 5 0 31745.25 29676.96 440.38 o 2 5 0 700.63 708.40 69.18 o 3 5 0 3661.38 3407.47 69.48 o 4 5 0 59875.65 84733.32 2491.52 o 5 5 0 3.67 0.89 7648.71 o 6 5 0 3848.38 3703.28 9104.98 o 7 5 0 11040.65 10366.11 352.43 o 8 5 0 155.06 114.12 105.11 o 9 5 0 4684.25 4374.43 5797.73 o 10 5 0 70.75 36.51 311.77 o 0 6 0 1310.44 1097.64 728.80 o 1 6 0 11700.25 10605.45 812.47 o 2 6 0 3759.63 3674.90 844.40 o 3 6 0 368.91 16593.44 67633.12 o 4 6 0 275.70 253.23 3622.57 o 5 6 0 60.66 40.06 196.76 o 6 6 0 841.50 875.60 939.75 o 7 6 0 4686.79 4307.61 212.14 o 8 6 0 91.27 91.95 124.62 o 9 6 0 765.53 691.99 1953.86 o 1 7 0 4372.73 3892.95 1153.37 o 2 7 0 34979.47 61224.85 753.04 o 3 7 0 13611.69 12990.83 54704.53 o 4 7 0 62.04 26.17 3867.96 o 5 7 0 2907.65 2774.02 720.08 o 6 7 0 3612.55 3345.09 6065.01 o 7 7 0 3882.83 3592.71 870.42 o 8 7 0 2440.07 2214.19 1381.32 o 9 7 0 397.08 375.34 811.44 o 0 8 0 5147.86 5142.40 294.62 o 1 8 0 692.11 660.36 2385.38 o 2 8 0 5608.72 4898.19 6226.88 o 3 8 0 7899.74 7145.05 16061.40 o 4 8 0 899.35 770.19 1053.58 o 5 8 0 4686.54 4247.00 251.90 o 6 8 0 2572.87 2200.15 4685.76 o 7 8 0 258.77 271.12 329.22 o 8 8 0 2731.29 2562.92 1378.51 o 1 9 0 314.67 332.91 232.24 o 2 9 0 452.39 420.87 111.76 o 3 9 0 1023.14 746.10 1928.59 o 4 9 0 434.80 391.75 1107.54 o 5 9 0 277.61 183.31 1788.44 o 6 9 0 380.26 332.91 11355.98 o 7 9 0 297.45 257.52 3488.93 o 0 10 0 10015.22 23176.89 554.07 o 1 10 0 483.29 396.63 1187.96 o 2 10 0 2122.92 2025.27 1430.99 o 3 10 0 6224.32 5560.61 9058.41 o 4 10 0 135.64 148.57 538.69 o 5 10 0 3500.76 3162.96 1204.52 o 6 10 0 503.10 547.86 3953.56 o 1 11 0 60.18 29.42 2045.08 o 2 11 0 3878.34 3401.56 3606.45 o 3 11 0 3790.93 2955.41 20548.62 o 4 11 0 629.29 525.53 1540.98 o 0 12 0 547.64 608.02 216.87 o 1 12 0 1719.06 1488.35 1180.72 o 2 12 0 2365.12 1887.93 402.54 o -11 1 1 370.50 371.64 422.79 o -10 1 1 3785.90 3593.44 991.64 o -9 1 1 874.72 856.82 682.83 o -8 1 1 1997.75 1945.88 623.55 o -7 1 1 27321.03 25950.62 4614.95 o -6 1 1 1090.86 1029.34 184.79 o -5 1 1 10180.41 9682.99 306.45 o -4 1 1 20065.07 19178.09 559.39 o -3 1 1 20450.65 19232.64 2215.38 o 2 1 1 21722.84 20435.38 195.14 o 3 1 1 48528.75 46100.84 820.01 o 4 1 1 10929.34 10444.02 873.82 o 5 1 1 610.01 516.96 371.35 o 6 1 1 22617.07 21776.94 2273.18 o 7 1 1 5330.70 5106.04 4736.76 o 8 1 1 2057.21 2004.28 441.72 o 9 1 1 4640.20 4504.22 449.70 o 10 1 1 348.79 317.24 1078.27 o -10 2 1 902.10 828.88 2793.98 o -9 2 1 1373.99 1310.81 5097.32 o -8 2 1 3428.61 3359.43 3497.35 o -7 2 1 977.94 926.74 952.02 o -6 2 1 4338.78 4034.27 1821.41 o -5 2 1 11683.90 11317.99 680.02 o -4 2 1 3204.80 2897.31 724.51 o -3 2 1 378.13 317.09 5344.04 o 2 2 1 3929.19 4036.49 468.92 o 3 2 1 63654.13 60296.93 6628.83 o 4 2 1 27214.21 25550.44 1774.70 o 5 2 1 250.07 229.43 10427.17 o 6 2 1 5814.68 5547.31 176.36 o 7 2 1 1591.13 1538.76 2779.94 o 8 2 1 5872.20 5565.05 1038.21 o 9 2 1 4094.62 3966.42 1007.31 o 10 2 1 97.46 67.41 4502.60 o -10 3 1 87.98 83.67 2001.17 o -9 3 1 7566.49 7230.79 3432.16 o -8 3 1 5862.56 5605.41 3454.78 o -7 3 1 35.91 23.95 530.27 o -6 3 1 15301.77 14730.79 7804.23 o -5 3 1 2186.65 1920.60 285.31 o -4 3 1 16013.03 15067.99 4523.15 o -3 3 1 7115.32 6605.18 2831.68 o -2 3 1 2202.61 2003.83 191.00 o 1 3 1 12544.97 12398.62 124.32 o 2 3 1 4948.84 4741.64 243.48 o 3 3 1 1539.66 1477.11 1679.64 o 4 3 1 32095.01 30513.53 139.40 o 5 3 1 2458.70 2308.95 6883.25 o 6 3 1 50.65 40.21 790.74 o 7 3 1 4464.87 4195.41 3728.41 o 8 3 1 2531.34 2495.96 977.01 o 9 3 1 978.13 953.21 1062.45 o 10 3 1 1.55 1.77 445.12 o -10 4 1 225.80 247.47 156.85 o -9 4 1 8.91 7.10 2825.47 o -8 4 1 4678.25 4410.79 210.36 o -7 4 1 1337.87 1244.28 471.28 o -6 4 1 24064.90 22681.07 6204.26 o -5 4 1 651.78 527.46 5083.57 o -4 4 1 634.35 565.89 372.38 o -3 4 1 82550.78 78876.16 4810.08 o -2 4 1 10383.95 10018.27 242.44 o 1 4 1 15540.79 14607.20 47.60 o 2 4 1 51480.89 47563.91 105.11 o 3 4 1 253.54 148.57 2589.53 o 4 4 1 1919.34 1929.47 2501.87 o 5 4 1 25552.95 24638.78 143.10 o 6 4 1 1469.07 1323.52 632.27 o 7 4 1 10578.70 10091.59 251.61 o 8 4 1 3449.60 3398.90 2316.34 o 9 4 1 719.48 663.46 1072.50 o 10 4 1 3911.81 3638.09 281.32 o -10 5 1 51.40 52.78 760.44 o -9 5 1 0.24 1.03 2939.30 o -8 5 1 0.62 2.22 197.20 o -7 5 1 440.46 432.40 347.25 o -6 5 1 1142.17 1184.26 5092.44 o -5 5 1 33.96 45.98 1615.78 o -4 5 1 3363.05 3187.36 1252.12 o -3 5 1 1367.69 1219.89 1407.49 o -2 5 1 4.98 4.58 671.29 o 1 5 1 1192.70 1016.03 534.55 o 2 5 1 9165.02 8807.69 965.03 o 3 5 1 2871.40 2647.93 320.05 o 4 5 1 103.68 130.24 749.35 o 5 5 1 21.90 28.97 71.55 o 6 5 1 4628.84 4951.26 3756.06 o 7 5 1 902.25 894.81 541.50 o 8 5 1 1558.01 1624.80 6267.83 o 9 5 1 371.26 369.43 377.11 o -9 6 1 1990.25 2064.89 406.24 o -8 6 1 7472.34 7603.18 445.12 o -7 6 1 444.10 475.42 169.71 o -6 6 1 2673.25 2619.10 3497.95 o -5 6 1 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