#------------------------------------------------------------------------------
#$Date: 2024-12-06 18:33:55 +0200 (Fri, 06 Dec 2024) $
#$Revision: 296379 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/27/1572718.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_1572718
loop_
_publ_author_name
'Larsen, Emil Mickey Hilligsøe'
'Brock-Nannestad, Theis'
'Skibsted, Jørgen'
'Reinholdt, Anders'
'Bendix, Jesper'
_publ_section_title
;
A homoleptic AgIII complex stabilized by succinimidate
ligands.
;
_journal_issue 43
_journal_name_full 'Chemical science'
_journal_page_first 18067
_journal_page_last 18075
_journal_paper_doi 10.1039/d4sc04843a
_journal_volume 15
_journal_year 2024
_chemical_formula_moiety '2(C16 H16 Ag N4 O8 Rb), 4(H4 O2)'
_chemical_formula_sum 'C32 H48 Ag2 N8 O24 Rb2'
_chemical_formula_weight 1315.46
_space_group_crystal_system tetragonal
_space_group_IT_number 87
_space_group_name_Hall '-I 4'
_space_group_name_H-M_alt 'I 4/m'
_atom_sites_solution_hydrogens mixed
_atom_sites_solution_primary dual
_audit_creation_date 2020-08-10
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2024-06-26 deposited with the CCDC. 2024-09-17 downloaded from the CCDC.
;
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_formula_units_Z 1
_cell_length_a 11.3963(9)
_cell_length_b 11.3963(9)
_cell_length_c 8.5069(6)
_cell_measurement_reflns_used 8673
_cell_measurement_temperature 100(2)
_cell_measurement_theta_max 34.78
_cell_measurement_theta_min 2.53
_cell_volume 1104.84(15)
_computing_cell_refinement 'SAINT V8.40A (?, 2016)'
_computing_data_reduction 'SAINT V8.40A (?, 2016)'
_computing_molecular_graphics 'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material 'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement 'ShelXL (Sheldrick, 2015)'
_computing_structure_solution 'XT (Sheldrick, 2015)'
_diffrn_ambient_temperature 100(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type 'Bruker APEX-II CCD'
_diffrn_measurement_method '\f and \w scans'
_diffrn_radiation_type MoK\a
_diffrn_radiation_wavelength 0.71073
_diffrn_reflns_av_R_equivalents 0.0571
_diffrn_reflns_av_unetI/netI 0.0275
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max 16
_diffrn_reflns_limit_h_min -16
_diffrn_reflns_limit_k_max 16
_diffrn_reflns_limit_k_min -16
_diffrn_reflns_limit_l_max 12
_diffrn_reflns_limit_l_min -11
_diffrn_reflns_number 10557
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full 25.242
_diffrn_reflns_theta_max 30.480
_diffrn_reflns_theta_min 2.527
_diffrn_standards_number 0
_exptl_absorpt_coefficient_mu 3.173
_exptl_absorpt_correction_T_max 0.7469
_exptl_absorpt_correction_T_min 0.6301
_exptl_absorpt_correction_type multi-scan
_exptl_absorpt_process_details
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1127 before and 0.0797 after correction. The Ratio of minimum to maximum transmission is 0.8436. The \l/2 correction factor is Not present.'
_exptl_crystal_colour 'clear yellow'
_exptl_crystal_colour_lustre clear
_exptl_crystal_colour_primary yellow
_exptl_crystal_density_diffrn 1.977
_exptl_crystal_description plank
_exptl_crystal_F_000 656
_exptl_crystal_preparation 'From water'
_exptl_crystal_size_max 0.147
_exptl_crystal_size_mid 0.0992
_exptl_crystal_size_min 0.089
_refine_diff_density_max 0.449
_refine_diff_density_min -0.805
_refine_diff_density_rms 0.093
_refine_ls_extinction_coef 0.0007(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method SHELXL
_refine_ls_goodness_of_fit_ref 1.125
_refine_ls_hydrogen_treatment constr
_refine_ls_matrix_type full
_refine_ls_number_parameters 48
_refine_ls_number_reflns 896
_refine_ls_number_restraints 0
_refine_ls_restrained_S_all 1.125
_refine_ls_R_factor_all 0.0305
_refine_ls_R_factor_gt 0.0214
_refine_ls_shift/su_max 0.000
_refine_ls_shift/su_mean 0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0100P)^2^+2.4018P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme calc
_refine_ls_wR_factor_gt 0.0438
_refine_ls_wR_factor_ref 0.0459
_reflns_Friedel_coverage 0.000
_reflns_number_gt 779
_reflns_number_total 896
_reflns_threshold_expression 'I > 2\s(I)'
_iucr_refine_instructions_details
;
TITL mo_d8v4542_0m_a.res in I4/m
REM Old TITL mo_D8V4542_0m in I4/m #87
REM SHELXT solution in I4/m
REM R1 0.040, Rweak 0.003, Alpha 0.033, Orientation as input
REM Formula found by SHELXT: Rb Ag C16 N4 O12
CELL 0.71073 11.3963 11.3963 8.5069 90 90 90
ZERR 1 0.0009 0.0009 0.0006 0 0 0
LATT 2
SYMM -X,-Y,+Z
SYMM -Y,+X,+Z
SYMM +Y,-X,+Z
SFAC C H Ag N O Rb
UNIT 32 48 2 8 24 2
L.S. 4 0 0
PLAN 20
SIZE 0.089 0.0992 0.147
TEMP -173(2)
BOND $H
list 4
fmap 2 53
acta
REM
REM
REM
WGHT 0.010000 2.401800
EXTI 0.000670
FVAR 0.35518
AG01 3 0.500000 0.500000 0.500000 10.12500 0.00421 0.00421 =
0.00446 0.00000 0.00000 0.00000
RB02 6 0.500000 0.500000 1.000000 10.12500 0.01352 0.01352 =
0.01094 0.00000 0.00000 0.00000
O003 5 0.688420 0.572383 0.766834 11.00000 0.01339 0.02302 =
0.00928 -0.00014 -0.00001 -0.00329
AFIX 6
O004 5 0.852428 0.643218 1.000000 10.50000 0.01695 0.02298 =
0.01595 0.00000 0.00000 -0.00660
H00C 2 0.801327 0.643025 0.927252 10.50000 -1.50000
H00D 2 0.821711 0.602937 1.073322 10.50000 -1.50000
AFIX 0
N005 4 0.664048 0.562140 0.500000 10.50000 0.00414 0.00922 =
0.00967 0.00000 0.00000 -0.00066
C006 1 0.726604 0.585618 0.633480 11.00000 0.00768 0.00796 =
0.01368 -0.00016 -0.00108 0.00048
C007 1 0.847513 0.629444 0.589883 11.00000 0.00807 0.01480 =
0.01311 0.00026 -0.00130 -0.00251
AFIX 23
H00A 2 0.909055 0.576555 0.631427 11.00000 -1.20000
H00B 2 0.860873 0.709484 0.631428 11.00000 -1.20000
AFIX 0
HKLF 4
REM mo_d8v4542_0m_a.res in I4/m
REM R1 = 0.0214 for 779 Fo > 4sig(Fo) and 0.0305 for all 896 data
REM 48 parameters refined using 0 restraints
END
WGHT 0.0100 2.4018
REM Highest difference peak 0.449, deepest hole -0.805, 1-sigma level 0.093
Q1 1 0.5547 0.4813 0.5000 10.50000 0.05 0.45
Q2 1 0.7163 0.5405 0.5000 10.50000 0.05 0.42
Q3 1 0.7951 0.5956 0.6188 11.00000 0.05 0.41
Q4 1 0.5000 0.5000 0.8734 10.25000 0.05 0.38
Q5 1 0.6885 0.5831 0.5709 11.00000 0.05 0.37
Q6 1 0.6763 0.6233 0.5000 10.50000 0.05 0.37
Q7 1 0.6206 0.5796 0.5000 10.50000 0.05 0.34
Q8 1 0.8553 0.6206 0.5000 10.50000 0.05 0.33
Q9 1 0.7349 0.5934 0.8282 11.00000 0.05 0.33
Q10 1 0.6513 0.7065 0.5000 10.50000 0.05 0.33
Q11 1 0.6555 0.5404 0.5473 11.00000 0.05 0.31
Q12 1 0.7575 0.5099 1.0000 10.50000 0.05 0.28
Q13 1 0.5058 0.4205 1.0368 11.00000 0.05 0.27
Q14 1 0.6030 0.5971 0.5409 11.00000 0.05 0.27
Q15 1 0.7742 0.4819 0.6945 11.00000 0.05 0.27
Q16 1 0.8959 0.6217 0.6447 11.00000 0.05 0.27
Q17 1 0.6351 0.5673 0.7199 11.00000 0.05 0.26
Q18 1 0.5619 0.5373 0.7161 11.00000 0.05 0.26
Q19 1 0.6376 0.5249 0.7799 11.00000 0.05 0.25
Q20 1 0.8980 0.6596 0.6352 11.00000 0.05 0.25
REM The information below was added by Olex2.
REM
REM R1 = 0.0214 for 779 Fo > 4sig(Fo) and 0.0305 for all 10557 data
REM n/a parameters refined using n/a restraints
REM Highest difference peak 0.45, deepest hole -0.80
REM Mean Shift 0, Max Shift 0.000.
REM +++ Tabular Listing of Refinement Information +++
REM R1_all = 0.0305
REM R1_gt = 0.0214
REM wR_ref = 0.0459
REM GOOF = 1.125
REM Shift_max = 0.000
REM Shift_mean = 0
REM Reflections_all = 10557
REM Reflections_gt = 779
REM Parameters = n/a
REM Hole = -0.80
REM Peak = 0.45
REM Flack = n/a
;
_cod_data_source_file d4sc04843a2.cif
_cod_data_source_block mo_d8v4542_0m
_cod_depositor_comments
'Adding full bibliography for 1572714--1572719.cif.'
_cod_original_cell_volume 1104.84(19)
_cod_database_code 1572718
_shelxl_version_number 2013-3
_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_max 0.765
_shelx_estimated_absorpt_t_min 0.653
_olex2_refinement_description
;
1. Fixed Uiso
At 1.2 times of:
All C(H,H) groups
At 1.5 times of:
All O(H,H) groups
2. Others
Fixed Sof: H00C(0.5) H00D(0.5)
3.a Free rotating group:
O004(H00C,H00D)
3.b Secondary CH2 refined with riding coordinates:
C007(H00A,H00B)
;
_olex2_exptl_crystal_mounting_method 'silicone grease on Kapton loop'
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'-y, x, z'
'y, -x, z'
'x+1/2, y+1/2, z+1/2'
'-x+1/2, -y+1/2, z+1/2'
'-y+1/2, x+1/2, z+1/2'
'y+1/2, -x+1/2, z+1/2'
'-x, -y, -z'
'x, y, -z'
'y, -x, -z'
'-y, x, -z'
'-x+1/2, -y+1/2, -z+1/2'
'x+1/2, y+1/2, -z+1/2'
'y+1/2, -x+1/2, -z+1/2'
'-y+1/2, x+1/2, -z+1/2'
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
Ag01 Ag 0.5000 0.5000 0.5000 0.00429(11) Uani 1 8 d S T P . .
Rb02 Rb 0.5000 0.5000 1.0000 0.01266(13) Uani 1 8 d S T P . .
O003 O 0.68842(11) 0.57238(12) 0.76683(16) 0.0152(3) Uani 1 1 d . . . . .
O004 O 0.85243(18) 0.6432(2) 1.0000 0.0186(4) Uani 1 2 d S T P . .
H00C H 0.8013 0.6430 0.9273 0.028 Uiso 0.5 1 d G . . . .
H00D H 0.8217 0.6029 1.0733 0.028 Uiso 0.5 1 d G . . . .
N005 N 0.66405(18) 0.56214(19) 0.5000 0.0077(4) Uani 1 2 d S T P . .
C006 C 0.72660(15) 0.58562(15) 0.6335(2) 0.0098(3) Uani 1 1 d . . . . .
C007 C 0.84751(16) 0.62944(17) 0.5899(2) 0.0120(4) Uani 1 1 d . . . . .
H00A H 0.9091 0.5766 0.6314 0.014 Uiso 1 1 calc R . . . .
H00B H 0.8609 0.7095 0.6314 0.014 Uiso 1 1 calc R . . . .
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
Ag01 0.00421(13) 0.00421(13) 0.00446(19) 0.000 0.000 0.000
Rb02 0.01352(18) 0.01352(18) 0.0109(3) 0.000 0.000 0.000
O003 0.0134(6) 0.0230(7) 0.0093(7) -0.0001(5) 0.0000(5) -0.0033(5)
O004 0.0169(11) 0.0230(11) 0.0160(11) 0.000 0.000 -0.0066(9)
N005 0.0041(9) 0.0092(10) 0.0097(10) 0.000 0.000 -0.0007(8)
C006 0.0077(8) 0.0080(8) 0.0137(9) -0.0002(7) -0.0011(7) 0.0005(6)
C007 0.0081(8) 0.0148(9) 0.0131(9) 0.0003(7) -0.0013(7) -0.0025(7)
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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rb Rb -0.9393 2.9676 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Rb02 Ag01 Rb02 180.0 . 1_554 ?
N005 Ag01 Rb02 90.0 9_666 . ?
N005 Ag01 Rb02 90.0 9_666 1_554 ?
N005 Ag01 Rb02 90.0 3_655 1_554 ?
N005 Ag01 Rb02 90.0 . 1_554 ?
N005 Ag01 Rb02 90.0 11_566 1_554 ?
N005 Ag01 Rb02 90.0 3_655 . ?
N005 Ag01 Rb02 90.0 . . ?
N005 Ag01 Rb02 90.0 11_566 . ?
N005 Ag01 N005 90.0 11_566 . ?
N005 Ag01 N005 180.0 9_666 . ?
N005 Ag01 N005 180.0 11_566 3_655 ?
N005 Ag01 N005 90.0 3_655 . ?
N005 Ag01 N005 90.0 9_666 3_655 ?
N005 Ag01 N005 90.0 9_666 11_566 ?
Ag01 Rb02 Ag01 180.0 . 1_556 ?
O003 Rb02 Ag01 130.77(3) 4_565 1_556 ?
O003 Rb02 Ag01 49.23(3) 10_557 1_556 ?
O003 Rb02 Ag01 130.77(3) 9_667 . ?
O003 Rb02 Ag01 49.23(3) 3_655 . ?
O003 Rb02 Ag01 49.23(3) 9_667 1_556 ?
O003 Rb02 Ag01 49.23(3) 12_657 1_556 ?
O003 Rb02 Ag01 49.23(3) . . ?
O003 Rb02 Ag01 130.77(3) 11_567 . ?
O003 Rb02 Ag01 130.77(3) 10_557 . ?
O003 Rb02 Ag01 130.77(3) . 1_556 ?
O003 Rb02 Ag01 49.23(3) 2_665 . ?
O003 Rb02 Ag01 130.77(3) 2_665 1_556 ?
O003 Rb02 Ag01 130.77(3) 12_657 . ?
O003 Rb02 Ag01 130.77(3) 3_655 1_556 ?
O003 Rb02 Ag01 49.23(3) 4_565 . ?
O003 Rb02 Ag01 49.23(3) 11_567 1_556 ?
O003 Rb02 O003 115.24(3) 2_665 11_567 ?
O003 Rb02 O003 180.0 12_657 4_565 ?
O003 Rb02 O003 115.24(3) 2_665 12_657 ?
O003 Rb02 O003 98.46(5) 12_657 11_567 ?
O003 Rb02 O003 98.46(5) . 2_665 ?
O003 Rb02 O003 81.54(5) 4_565 11_567 ?
O003 Rb02 O003 115.24(3) 10_557 4_565 ?
O003 Rb02 O003 64.76(3) 9_667 11_567 ?
O003 Rb02 O003 98.46(5) 10_557 9_667 ?
O003 Rb02 O003 115.24(3) 10_557 3_655 ?
O003 Rb02 O003 115.24(3) . 11_567 ?
O003 Rb02 O003 64.76(3) 2_665 3_655 ?
O003 Rb02 O003 64.76(3) . 4_565 ?
O003 Rb02 O003 81.54(5) 12_657 3_655 ?
O003 Rb02 O003 64.76(3) 2_665 4_565 ?
O003 Rb02 O003 98.46(5) 4_565 3_655 ?
O003 Rb02 O003 180.0 . 9_667 ?
O003 Rb02 O003 115.24(3) 9_667 3_655 ?
O003 Rb02 O003 81.54(5) 2_665 9_667 ?
O003 Rb02 O003 180.0 11_567 3_655 ?
O003 Rb02 O003 180.0 10_557 2_665 ?
O003 Rb02 O003 115.24(3) . 12_657 ?
O003 Rb02 O003 64.76(3) 10_557 11_567 ?
O003 Rb02 O003 64.76(3) 10_557 12_657 ?
O003 Rb02 O003 64.76(3) 12_657 9_667 ?
O003 Rb02 O003 81.54(5) . 10_557 ?
O003 Rb02 O003 115.24(3) 4_565 9_667 ?
O003 Rb02 O003 64.76(3) . 3_655 ?
C006 O003 Rb02 152.85(12) . . ?
H00C O004 H00D 104.5 . . ?
C006 N005 Ag01 123.85(11) . . ?
C006 N005 Ag01 123.84(11) 10_556 . ?
C006 N005 C006 112.3(2) . 10_556 ?
O003 C006 N005 124.06(17) . . ?
O003 C006 C007 126.29(17) . . ?
N005 C006 C007 109.64(16) . . ?
C006 C007 C007 104.20(10) . 10_556 ?
C006 C007 H00A 110.9 . . ?
C006 C007 H00B 110.9 . . ?
C007 C007 H00A 110.9 10_556 . ?
C007 C007 H00B 110.9 10_556 . ?
H00A C007 H00B 108.9 . . ?
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
Ag01 Rb02 4.2534(3) 1_554 ?
Ag01 Rb02 4.2534(3) . ?
Ag01 N005 1.999(2) 9_666 ?
Ag01 N005 1.999(2) . ?
Ag01 N005 1.999(2) 11_566 ?
Ag01 N005 1.999(2) 3_655 ?
Rb02 Ag01 4.2534(3) 1_556 ?
Rb02 O003 3.0374(14) 10_557 ?
Rb02 O003 3.0374(14) 11_567 ?
Rb02 O003 3.0374(14) 4_565 ?
Rb02 O003 3.0374(14) 2_665 ?
Rb02 O003 3.0374(14) 3_655 ?
Rb02 O003 3.0374(14) 12_657 ?
Rb02 O003 3.0374(14) . ?
Rb02 O003 3.0374(14) 9_667 ?
O003 C006 1.224(2) . ?
O004 H00C 0.8498 . ?
O004 H00D 0.8499 . ?
N005 C006 1.367(2) . ?
N005 C006 1.367(2) 10_556 ?
C006 C007 1.512(2) . ?
C007 C007 1.529(4) 10_556 ?
C007 H00A 0.9900 . ?
C007 H00B 0.9900 . ?
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_meas
_refln_F_squared_sigma
1 -1 0 3174.28 104.79
1 1 0 3139.09 104.49
1 -1 0 2870.71 103.89
1 -1 0 3065.79 104.09
1 -1 0 3062.89 104.29
-1 1 0 3042.2 104.59
-1 1 0 2985.1 103.89
2 0 0 1145.69 41
0 2 0 1159.78 40.1
0 2 0 1083.99 41.8
2 0 0 1117.59 41.4
0 -2 0 1143.59 40.2
0 -2 0 1106.09 42
-2 0 0 1192.98 41
-2 0 0 1169.68 41.6
2 -2 0 381.36 17.9
2 -2 0 405.76 18.2
2 -2 0 416.56 19.3
2 -2 0 408.16 19.5
2 2 0 447.36 19
-2 -2 0 409.96 17.7
-2 -2 0 435.56 19.4
-2 2 0 411.46 19.6
-2 2 0 405.46 17.8
-2 2 0 422.16 18.5
1 -3 0 9999 335.47
3 1 0 9544.04 333.37
-3 -1 0 9878.71 334.17
-3 -1 0 9871.31 333.47
3 -1 0 22 6.8
3 -1 0 19.9 7.4
-3 1 0 15.7 6.2
3 -1 0 21.6 5.8
-3 1 0 18 7.2
3 -3 0 30.2 8.8
-3 3 0 27.9 7.6
3 3 0 17 6
-3 3 0 26.9 8.7
-3 -3 0 18.3 7.3
3 -3 0 19.2 6.4
3 -3 0 23 7.9
-3 -3 0 15.4 5.7
3 -3 0 34.8 8
-3 3 0 28.9 6.9
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3 -9 -2 272.27 28.1
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3 -9 -2 285.37 27.9
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3 -9 2 311.37 35.3
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-3 9 2 244.78 28.1
3 -9 2 288.57 32.5
-9 -3 2 280.17 28.1
-3 9 2 247.08 31.7
9 3 2 260.27 26.3
-3 9 2 286.47 20.9
3 -9 2 267.77 25.2
1 -9 -2 1012.1 42.8
-1 9 -2 973.6 45.5
-1 9 -2 1034.3 58.39
-9 -1 -2 1039.2 48.2
-9 -1 -2 1042.5 49.8
1 -9 -2 972.7 50.39
9 1 -2 998.7 49.5
-1 9 -2 899.21 52.09
-1 9 -2 1074.09 46
-1 9 2 969.9 51.99
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9 1 2 1048.1 48.8
1 -9 2 1046.3 54.49
-9 -1 2 1056.79 51.99
1 -9 2 987.8 46.5
-1 9 2 1079.79 54.69
-1 9 2 1059.49 42.1
-9 -1 2 1021.8 52.99
1 9 -2 800.82 51.99
-1 -9 -2 758.52 42.9
-9 1 -2 819.12 41.9
-9 1 -2 805.02 42.4
1 9 -2 780.12 42.1
1 9 -2 827.12 45.4
-9 1 -2 761.52 40.4
9 -1 -2 805.02 43.6
-1 -9 -2 799.02 34.3
-9 1 2 740.93 42.1
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-1 -9 2 682.03 45.4
9 -1 2 825.92 45.7
-1 -9 2 807.12 39
1 9 2 810.52 43.5
9 -1 2 823.42 42.9
-3 -9 -2 1149.29 46.5
3 9 -2 1099.89 64.09
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3 9 -2 1163.38 57.19
9 -3 -2 1147.39 55.99
9 -3 -2 1227.68 42.6
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9 -3 2 1167.88 56.59
9 -3 2 1189.68 56.09
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3 9 2 1192.38 55.39
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9 -3 2 1189.18 56.99
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5 9 -2 1068.79 64.39
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5 9 2 1153.78 54.39
9 -5 2 988.7 56.89
9 -5 2 1118.69 56.39
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7 9 -2 465.55 46.9
-7 -9 -2 440.26 36
9 -7 -2 419.26 41.2
9 -7 -2 407.36 39.9
9 -7 2 497.35 40.4
9 -7 2 432.36 43.8
9 -7 2 483.05 30.6
-7 -9 2 415.76 40.5
7 9 2 428.16 38
9 -7 2 477.85 40.9
9 9 -2 680.73 57.69
9 -9 -2 605.94 54.19
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9 -9 -2 621.44 49.4
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9 -9 2 605.24 49.6
9 -9 2 605.04 60.09
9 -9 2 647.54 50.99
8 -10 -2 495.85 49.7
-10 -8 -2 376.06 37.7
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10 8 -2 484.85 49.4
8 -10 -2 423.36 41.9
8 -10 2 432.26 49.3
-10 -8 2 309.87 43.4
8 -10 2 330.77 52.69
8 -10 2 404.86 46.9
-6 10 -2 725.23 53.89
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6 -10 -2 782.12 48
6 -10 -2 821.12 50.99
-10 -6 -2 774.32 46.7
6 -10 2 746.93 60.09
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6 -10 2 748.13 46.6
6 -10 2 832.02 51.99
6 -10 2 807.42 51.59
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4 -10 -2 1025.1 55.19
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4 -10 -2 906.41 44.6
4 -10 -2 957.7 49
4 -10 2 968.3 56.79
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4 -10 2 997.2 49.8
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2 -10 -2 551.04 30.1
10 2 -2 606.04 38.8
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2 -10 2 519.15 41.2
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2 -10 2 611.14 35.6
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10 2 2 565.94 37.4
0 -10 -2 157.98 16.7
0 10 -2 153.38 28.8
0 -10 -2 164.88 26.7
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10 0 -2 159.58 22.8
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0 10 -2 177.98 24
0 10 2 188.38 32.7
0 -10 2 158.78 28.3
10 0 2 148.09 21.6
10 0 2 140.69 26.1
0 10 2 167.68 29.3
0 -10 2 167.28 22.2
2 10 -2 805.92 54.79
-2 -10 -2 692.53 44.8
10 -2 -2 740.43 33.7
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10 -2 -2 707.93 42.7
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10 -2 2 774.52 44.8
2 10 2 748.93 44.6
-2 -10 2 636.74 46.3
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10 -2 2 765.32 46.4
10 -4 -2 1320.97 62.29
4 10 -2 1361.86 74.49
10 -4 -2 1270.87 66.79
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4 10 -2 1239.08 64.69
10 -4 2 1439.26 64.99
10 -4 2 1195.88 65.89
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10 -4 2 1278.77 64.49
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4 10 2 1323.77 63.39
10 -6 -2 397.96 40.6
-6 -10 -2 309.27 29.4
10 -6 -2 355.26 24.7
10 -6 -2 421.26 40
-6 -10 -2 311.07 32.8
6 10 -2 289.87 42.8
-6 -10 -2 366.66 23.5
10 -6 2 406.06 40.5
-6 -10 2 395.36 29.4
10 -6 2 292.97 31.8
10 -6 2 349.67 43.3
10 -6 2 361.16 40.6
-6 -10 2 296.67 37.6
8 10 -2 756.72 61.09
-8 -10 -2 589.54 44.9
-8 -10 -2 669.53 34.8
10 -8 -2 651.43 48
10 -8 -2 667.53 55.89
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10 -8 2 636.94 51.29
10 -8 2 708.33 51.99
-8 -10 2 582.94 50.49
10 -8 2 589.94 35.2
10 -8 2 582.44 58.39
10 10 -2 644.04 62.59
10 -10 -2 648.84 62.69
-10 -10 -2 552.84 48.4
10 -10 -2 680.83 55.89
10 -10 2 735.93 63.29
-10 -10 2 668.43 57.59
10 -10 2 653.93 57.09
-9 11 -2 291.27 50.99
9 -11 -2 404.76 47.1
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11 9 -2 398.56 54.99
9 -11 -2 338.17 50.09
9 -11 2 251.07 41.9
9 -11 2 335.97 54.89
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7 -11 -2 989.3 56.99
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7 -11 -2 913.21 59.39
-11 -7 -2 844.02 52.59
11 7 -2 945.21 64.29
7 -11 2 935.61 59.69
7 -11 2 920.71 59.69
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7 -11 2 745.13 51.79
5 -11 -2 559.34 47.2
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5 -11 -2 636.34 43.5
-11 -5 -2 576.64 41.4
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5 -11 2 567.24 46.7
-11 -5 2 558.74 46.5
5 -11 2 614.94 41.6
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3 -11 -2 622.44 43.5
3 -11 -2 573.74 41.9
-11 -3 -2 649.04 41.3
3 -11 -2 590.44 34.5
-3 11 2 604.34 35.6
3 -11 2 642.84 47.2
11 3 2 637.34 42.4
-11 -3 2 634.54 45.1
3 -11 2 613.04 39.6
-3 11 2 653.23 45.7
1 -11 -2 920.91 53.49
1 -11 -2 1014 44.8
-1 11 -2 1017.8 63.79
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11 1 -2 990 54.79
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11 1 2 891.21 59.59
1 -11 2 896.71 57.39
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1 -11 2 1064.29 50.09
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11 1 2 974.5 52.29
1 11 -2 355.46 43
1 11 -2 340.17 32.9
-1 -11 -2 369.26 34.1
11 -1 -2 395.66 35.1
11 -1 -2 330.97 27.6
-1 -11 -2 338.97 23.1
-1 -11 2 378.16 29.2
11 -1 2 284.87 41.4
1 11 2 431.76 43.5
11 -1 2 363.96 35.6
3 11 -2 283.17 42
-3 -11 -2 308.17 21.5
11 -3 -2 293.57 19.5
11 -3 -2 303.67 33.7
3 11 -2 317.07 35.5
11 -3 2 209.58 31.7
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11 -3 2 371.06 37.6
11 -3 2 289.97 37.4
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11 -5 -2 493.35 44.6
11 -5 -2 500.65 47.5
5 11 -2 452.75 50.69
5 11 -2 428.86 43.2
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11 -5 -2 390.46 31.3
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11 -5 2 449.16 43.6
11 -5 2 296.97 47.9
11 -5 2 442.06 44.6
11 -7 -2 753.22 52.19
11 -7 -2 624.94 29.7
11 -7 -2 730.63 59.29
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7 11 -2 702.83 61.89
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11 -7 2 802.52 54.59
11 -7 2 752.22 57.19
11 -7 2 586.84 42.8
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11 -9 -2 578.14 51.09
11 -9 -2 433.66 53.79
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11 -9 2 647.74 57.39
11 -11 -2 191.58 40
11 11 -2 274.77 52.19
11 -11 -2 159.28 44.9
-11 -11 -2 192.78 36.1
11 -11 2 242.48 46
11 -11 2 188.98 44
-11 -11 2 232.98 32.3
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10 -12 -2 174.18 39.5
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12 10 -2 223.28 48.2
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10 -12 -2 138.79 47.2
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10 -12 2 181.88 47.5
10 -12 2 182.98 43.1
12 8 -2 287.07 46.3
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8 -12 -2 340.07 41.9
8 -12 -2 341.67 52.99
-8 12 2 196.18 32.9
8 -12 2 217.58 39.9
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8 -12 2 189.18 40.3
6 -12 -2 565.64 51.19
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6 -12 -2 477.85 43.9
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6 -12 2 401.96 49.99
6 -12 2 504.45 52.59
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6 -12 2 431.56 42.4
4 -12 -2 664.63 45.2
4 -12 -2 632.04 38.1
4 -12 -2 634.74 49.6
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-4 12 -2 623.54 56.79
4 -12 2 670.93 51.89
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4 -12 2 626.84 43.9
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0 -12 -2 487.15 30
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0 -12 2 550.04 36
0 -12 2 521.25 49.5
12 0 2 537.35 43.2
12 -2 -2 655.83 34.8
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12 -2 -2 726.43 47.8
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12 -2 2 722.83 53.49
12 -2 2 631.44 45.5
12 -4 -2 393.26 44.6
4 12 -2 419.26 42.9
4 12 -2 438.46 52.49
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12 -4 2 324.27 44.1
-4 -12 2 400.76 31.8
12 -4 2 454.45 45.2
6 12 -2 251.57 38.2
6 12 -2 197.58 40.3
12 -6 -2 177.58 26.8
-6 -12 -2 182.18 30
12 -6 -2 198.18 40.2
-6 -12 -2 166.08 20.7
12 -6 -2 132.69 33
12 -6 2 175.18 35
12 -6 2 150.68 35.7
12 -6 2 107.79 33.2
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12 -6 2 154.48 33.5
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12 -8 -2 497.25 56.59
12 -8 -2 509.15 56.49
8 12 -2 480.75 62.09
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12 -8 2 562.74 58.59
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12 -8 2 405.56 57.49
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12 -10 -2 541.95 58.69
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12 -10 -2 427.46 64.29
12 -10 2 532.05 60.79
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9 -13 -2 203.38 47.5
9 -13 -2 87.19 36.8
-13 -9 2 109.69 33.6
9 -13 2 116.99 40.9
9 -13 2 213.38 45.8
13 7 -2 152.98 37.6
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-13 -7 -2 159.18 29.3
7 -13 -2 97.09 30.9
7 -13 -2 146.39 39.6
7 -13 2 124.29 37.6
7 -13 2 159.68 37.7
7 -13 2 114.89 29
-13 -7 2 181.38 36.8
-7 13 2 95.29 30.2
5 -13 -2 328.37 41.5
-5 13 -2 356.06 58.39
-13 -5 -2 322.97 39.6
5 -13 -2 389.76 49.2
5 -13 2 390.06 40.2
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5 -13 2 431.86 53.29
3 -13 -2 701.03 53.89
3 -13 -2 605.94 38.4
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3 -13 -2 695.13 48.2
-3 13 2 651.23 56.69
13 3 2 716.43 52.19
3 -13 2 723.33 45.8
3 -13 2 675.83 55.29
-13 -3 2 714.53 54.39
1 -13 -2 397.36 41.2
-1 13 -2 468.95 54.09
13 1 -2 453.25 44.6
1 -13 -2 418.76 30
-13 -1 -2 488.55 41.1
-1 13 -2 462.85 34.9
-1 13 2 441.76 25.8
1 -13 2 408.86 36.1
-1 13 2 395.46 51.29
-13 -1 2 422.56 46.1
13 1 2 423.36 43.8
1 -13 2 406.06 49.3
-1 -13 -2 612.64 47.5
13 -1 -2 674.33 41.3
13 -1 -2 654.03 49.7
1 13 -2 706.43 60.89
1 13 -2 638.74 44.9
-1 -13 -2 607.44 34.5
-1 -13 2 633.04 40.9
1 13 2 541.75 57.09
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13 -1 2 704.63 51.69
3 13 -2 802.12 55.59
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3 13 -2 810.52 67.99
13 -3 -2 837.92 59.09
3 13 2 899.11 69.89
13 -3 2 880.31 59.69
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13 -5 -2 268.27 38.2
-5 -13 -2 230.78 22.9
5 13 -2 270.07 40.4
13 -5 -2 200.68 34.1
5 13 -2 244.08 47.8
13 -5 2 284.37 49.5
-5 -13 2 219.18 29.8
13 -5 2 343.17 51.09
13 -7 -2 291.07 41.1
7 13 -2 321.17 45.2
7 13 -2 266.77 49.8
-7 -13 -2 303.77 40.4
-7 -13 -2 264.47 26.4
13 -7 -2 299.67 48.3
13 -7 2 230.48 40.6
-7 -13 2 319.07 44.7
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13 -7 2 362.26 57.79
13 -9 -2 289.17 45.4
-9 -13 -2 292.87 30.6
9 13 -2 487.75 71.39
-9 -13 -2 283.17 45.4
13 -9 -2 227.08 50.59
9 13 -2 315.17 50.59
-9 -13 2 302.47 36.4
13 -9 2 258.17 50.69
13 -9 2 327.27 48.9
-9 -13 2 338.07 49.2
14 6 -2 273.17 49.5
6 -14 -2 204.88 42.3
-6 14 -2 126.39 44
-14 -6 -2 238.08 37.3
-6 14 2 133.09 38.8
6 -14 2 188.88 44.1
6 -14 2 126.59 41.1
6 -14 2 164.58 32.5
4 -14 -2 89.89 34.2
-14 -4 -2 103.59 27.9
-4 14 -2 131.39 40.1
4 -14 -2 48.1 28.2
4 -14 -2 77.69 20.5
-4 14 2 113.49 34.5
4 -14 2 133.59 37.6
4 -14 2 83.99 25.6
-14 -4 2 141.49 37.3
-2 14 -2 396.46 60.19
14 2 -2 394.36 45.2
2 -14 -2 324.17 47.1
-14 -2 -2 369.76 42.7
2 -14 -2 343.57 31.3
2 -14 2 374.76 39
14 2 2 382.16 49.5
-14 -2 2 432.56 51.09
2 -14 2 320.87 46.4
-2 14 2 395.86 54.49
0 -14 -2 598.24 52.99
14 0 -2 562.34 57.19
0 -14 -2 525.05 34.7
0 14 -2 629.04 64.39
0 14 -2 608.44 43.9
-14 0 -2 529.15 48.4
0 -14 2 579.74 60.19
0 14 2 584.84 39.5
0 14 2 548.75 60.89
0 -14 2 688.13 44.3
14 0 2 561.94 49.5
-14 0 2 547.45 55.09
2 14 -2 586.34 63.69
14 -2 -2 506.25 52.69
2 14 -2 480.45 48.3
-2 -14 -2 582.14 33.2
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-2 -14 2 530.35 39.9
2 14 2 514.15 62.19
14 -2 2 583.94 49.9
4 14 -2 396.06 46
14 -4 -2 368.06 43.9
-4 -14 -2 317.67 27.6
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4 14 -2 329.47 59.19
14 -4 -2 266.57 40
4 14 2 285.67 49.4
14 -4 2 382.16 55.19
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-6 -14 -2 547.85 34.2
6 14 -2 527.95 66.49
14 -6 -2 592.84 40.3
6 14 -2 498.55 61.59
14 -6 -2 542.05 62.99
14 -6 2 566.24 59.99
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6 14 2 624.24 76.09
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14 -6 2 558.54 64.49
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5 -15 -2 234.88 44.7
5 -15 -2 344.07 51.59
15 5 -2 378.86 53.89
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5 -15 2 364.36 51.29
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5 -15 2 425.56 48.9
5 -15 2 374.16 62.19
3 -15 -2 246.08 41.8
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3 -15 -2 346.67 46.7
-3 15 -2 169.78 45.6
3 -15 -2 203.38 31.9
3 -15 2 206.98 43.9
-15 -3 2 259.27 44.4
15 3 2 216.88 38.5
-3 15 2 153.28 40
3 -15 2 186.68 33.7
-1 15 -2 139.39 25.7
1 -15 -2 85.99 21
15 1 -2 73.19 34.4
1 -15 -2 140.49 38.9
-15 -1 -2 71.99 29
-1 15 -2 56.49 39.8
1 -15 2 104.39 27
-1 15 2 80.89 36.7
1 -15 2 84.39 40.8
15 1 2 113.69 35.1
-15 -1 2 75.79 35.6
1 15 -2 384.56 63.79
1 15 -2 407.36 47.5
-1 -15 -2 335.27 30.9
15 -1 -2 410.66 56.59
-1 -15 -2 305.87 48.3
-15 1 -2 353.56 48.5
15 -1 2 370.86 53.99
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1 -11 -8 207.78 35
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1 -11 8 217.68 41.2
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1 -11 8 184.48 31.5
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11 -1 -8 592.34 57.89
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1 0 9 20.2 13.5
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1 -2 9 9.3 13.2
1 -2 9 30.9 15.1
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1 -2 9 22.2 8.2
1 2 -9 29.8 24.7
1 2 -9 48.6 28
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2 -1 9 36.7 11.9
2 -1 9 17.7 14.9
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1 4 -9 0.2 28.6
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4 -3 9 18.8 18.4
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4 -5 9 24.9 21.3
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2 -5 9 -0.9 17.5
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5 -2 -9 48.8 26.4
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5 -4 9 14 15.9
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1 -6 9 4.9 19
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4 -7 9 45.4 26
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0 8 -10 639.24 71.69
0 8 -10 419.26 60.39
8 0 -10 548.15 61.19
-8 0 10 485.55 49.9
-8 0 10 547.35 39.5
0 -8 10 421.26 54.39
0 -8 10 544.35 48.2
8 -2 -10 207.78 38.6
2 8 -10 248.58 51.59
2 8 -10 267.07 48.8
-8 2 10 273.57 36.9
8 -2 10 235.08 42.4
-2 -8 10 325.77 41.8
4 8 -10 253.97 47.1
4 8 -10 465.85 69.69
-4 -8 10 407.86 53.99
-4 -8 10 353.36 42.6
8 -4 10 372.86 52.09
-8 4 10 361.46 48.1
-1 9 -10 157.38 50.49
9 1 -10 284.17 46.8
-9 -1 10 286.27 37.2
1 -9 10 322.17 45.3
-9 -1 10 331.47 50.59
1 -9 10 217.78 35.4
1 9 -10 124.79 47
9 -1 -10 172.98 43.8
1 9 -10 153.78 47.2
-1 -9 10 187.58 34.5
-1 -9 10 243.88 47.3
-9 1 10 236.88 39.4
1 0 11 85.09 19.5
0 -1 11 83.29 21.4
-1 0 11 79.59 19.4
1 -2 11 -4.3 21.7
-2 -1 11 26.1 19.4
2 -1 11 15 20.3
-1 -2 11 5.9 19.7
-2 1 11 13.3 16
3 2 -11 68.29 41.2
3 2 -11 -4.7 34.3
2 -3 11 10.6 23.2
-3 -2 11 20.6 20
0 3 -11 25.1 39.1
0 -3 11 66.19 22.6
-3 0 11 17.3 17.5
2 3 -11 -3.4 41.5
2 3 -11 42.2 39.4
-2 -3 11 -20.2 21
3 -2 11 23.6 23.3
3 -2 11 -7.6 32.3
4 3 -11 37.9 42.8
4 3 -11 133.59 41.7
3 -4 11 84.79 26.5
-4 -3 11 13.4 22.5
-4 -3 11 40.1 27.1
-1 4 -11 83.09 47
4 1 -11 1.7 39.5
-4 -1 11 22.1 19.9
1 -4 11 7.5 23.9
-4 -1 11 54.79 24.6
1 4 -11 101.79 43.3
1 4 -11 -24 38.6
-4 1 11 -7.7 32.9
-1 -4 11 -21.3 21.5
-1 -4 11 -8.9 30.9
-4 1 11 -0.9 17.4
3 4 -11 38.1 40.3
3 4 -11 66.29 41.3
4 -3 11 -39.9 24.4
4 -3 11 11.6 24.6
-3 -4 11 23.2 22.9
5 4 -11 127.69 43.8
-5 -4 11 79.69 33.4
4 -5 11 91.89 32.8
-5 -4 11 60.49 24.6
4 -5 11 21.6 28.6
5 2 -11 151.58 44.6
5 2 -11 166.18 41.1
-2 5 -11 225.78 50.19
2 -5 11 220.88 33.2
-5 -2 11 185.48 31.4
-5 -2 11 196.28 27.4
0 5 -11 80.69 45
5 0 -11 -40 40.7
-5 0 11 30.3 25.4
0 -5 11 39.8 25.2
-5 0 11 39.8 20.1
2 5 -11 -54.09 43.7
2 5 -11 57.49 42.4
-2 -5 11 -10.5 23.5
4 5 -11 152.88 45.4
4 5 -11 -12.3 42.7
-4 -5 11 70.69 31.6
-4 -5 11 41.5 26.8
5 -4 11 44.3 29.3
5 -4 11 65.89 29.5
6 3 -11 -29.4 44.8
6 3 -11 37.1 39.8
-3 6 -11 32.6 50.49
-6 -3 11 32.2 23.9
3 -6 11 25.7 30.3
-6 -3 11 8.5 30.2
-1 6 -11 123.99 50.39
6 1 -11 66.49 40.9
-6 -1 11 105.79 24.9
-6 -1 11 64.59 30.1
1 -6 11 139.99 30.7
1 6 -11 50.49 45.7
6 -1 -11 157.78 45.6
1 6 -11 61.69 45.4
-6 1 11 105.09 22.7
-1 -6 11 54.69 27.2
-1 -6 11 40 31.9
3 6 -11 161.08 50.39
3 6 -11 20.4 44.9
-3 -6 11 50.19 27.6
0 -2 12 230.48 36.5