#------------------------------------------------------------------------------
#$Date: 2024-12-06 18:33:55 +0200 (Fri, 06 Dec 2024) $
#$Revision: 296379 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/27/1572719.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_1572719
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 'C2 H2 Ag0.13 K0.13 N0.5 O, H O0.5'
_chemical_formula_sum 'C2 H3 Ag0.12 K0.12 N0.5 O1.5'
_chemical_formula_weight 76.42
_chemical_name_systematic 'potassium tetrasuccinimidatoargentate(III)'
_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 2024-06-26
_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 16
_cell_length_a 11.554(4)
_cell_length_b 11.554
_cell_length_c 8.420(3)
_cell_measurement_reflns_used 9973
_cell_measurement_temperature 100(2)
_cell_measurement_theta_max 31.55
_cell_measurement_theta_min 2.49
_cell_volume 1124.0(6)
_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 'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature 100(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 1.001
_diffrn_measurement_device_type 'Bruker APEX-III CCD'
_diffrn_measurement_method '\f and \w scans'
_diffrn_radiation_type MoK\a
_diffrn_radiation_wavelength 0.71073
_diffrn_reflns_av_R_equivalents 0.0291
_diffrn_reflns_av_unetI/netI 0.0124
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 1.001
_diffrn_reflns_limit_h_max 16
_diffrn_reflns_limit_h_min -14
_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 11071
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 1.001
_diffrn_reflns_theta_full 25.242
_diffrn_reflns_theta_max 31.005
_diffrn_reflns_theta_min 2.493
_diffrn_standards_number 0
_exptl_absorpt_coefficient_mu 1.152
_exptl_absorpt_correction_T_max 0.7462
_exptl_absorpt_correction_T_min 0.6766
_exptl_absorpt_correction_type multi-scan
_exptl_absorpt_process_details
'SADABS-2014/5 (Bruker,2014/5) was used for absorption correction. wR2(int) was 0.0847 before and 0.0420 after correction. The Ratio of minimum to maximum transmission is 0.9067. The \l/2 correction factor is Not present.'
_exptl_crystal_colour 'clear light yellow'
_exptl_crystal_colour_lustre clear
_exptl_crystal_colour_modifier light
_exptl_crystal_colour_primary yellow
_exptl_crystal_density_diffrn 1.806
_exptl_crystal_description plank
_exptl_crystal_F_000 620
_exptl_crystal_recrystallization_method
'Crystallized from basic aqueous solution'
_exptl_crystal_size_max 0.28
_exptl_crystal_size_mid 0.15
_exptl_crystal_size_min 0.15
_refine_diff_density_max 0.313
_refine_diff_density_min -0.473
_refine_diff_density_rms 0.051
_refine_ls_extinction_coef 0.0077(6)
_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 1.209
_refine_ls_hydrogen_treatment constr
_refine_ls_matrix_type full
_refine_ls_number_parameters 48
_refine_ls_number_reflns 961
_refine_ls_number_restraints 0
_refine_ls_restrained_S_all 1.209
_refine_ls_R_factor_all 0.0143
_refine_ls_R_factor_gt 0.0143
_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^)+(0.0176P)^2^+0.6121P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme calc
_refine_ls_wR_factor_gt 0.0398
_refine_ls_wR_factor_ref 0.0398
_reflns_Friedel_coverage 0.000
_reflns_number_gt 960
_reflns_number_total 961
_reflns_threshold_expression 'I > 2\s(I)'
_iucr_refine_instructions_details
;
TITL mo_D8V1828_0m-1_a.res in I4/m
REM Old TITL ?
REM SHELXT solution in I4/m
REM R1 0.053, Rweak 0.077, Alpha 0.044, Orientation as input
REM Formula found by SHELXT: C16 N8 O8 K Ag
CELL 0.71073 11.5544 11.5544 8.4201 90 90 90
ZERR 16 0.0037 0 0.0027 0 0 0
LATT 2
SYMM -X,-Y,+Z
SYMM -Y,+X,+Z
SYMM +Y,-X,+Z
SFAC C H Ag K N O
UNIT 32 48 2 2 8 24
L.S. 99
PLAN 20
SIZE 0.28 0.15 0.15
TEMP -173(2)
BOND $H
LIST 6
fmap 2
acta
REM
REM
REM
WGHT 0.017600 0.612100
EXTI 0.007678
FVAR 0.44646
AG01 3 0.500000 0.500000 0.500000 10.12500 0.01505 0.01505 =
0.01457 0.00000 0.00000 0.00000
K002 4 0.500000 0.500000 1.000000 10.12500 0.04416 0.04416 =
0.03840 0.00000 0.00000 0.00000
N003 5 0.560478 0.661815 0.500000 10.50000 0.02233 0.01697 =
0.02843 0.00000 0.00000 -0.00261
O004 6 0.569584 0.685842 0.769585 11.00000 0.06856 0.03748 =
0.03081 -0.00078 -0.00195 -0.01291
AFIX 6
O5 6 0.641098 0.852193 1.000000 10.50000 0.07112 0.04871 =
0.04647 0.00000 0.00000 -0.01985
H5 2 0.622735 0.811224 0.919958 11.00000 -1.50000
AFIX 0
C006 1 0.582876 0.722811 0.635332 11.00000 0.02939 0.02276 =
0.03230 -0.00327 -0.00166 -0.00299
C007 1 0.626177 0.841795 0.590527 11.00000 0.04166 0.02220 =
0.04314 -0.00430 -0.00277 -0.00903
AFIX 23
H00A 2 0.705154 0.854957 0.632393 11.00000 -1.20000
H00B 2 0.574134 0.902639 0.632395 11.00000 -1.20000
AFIX 0
HKLF 4
REM mo_D8V1828_0m-1_a.res in I4/m
REM R1 = 0.0143 for 960 Fo > 4sig(Fo) and 0.0143 for all 961 data
REM 48 parameters refined using 0 restraints
END
WGHT 0.0174 0.6220
REM Highest difference peak 0.313, deepest hole -0.473, 1-sigma level 0.051
Q1 1 0.5699 0.6909 0.5641 11.00000 0.05 0.31
Q2 1 0.6323 0.8479 0.5000 10.50000 0.05 0.31
Q3 1 0.6020 0.7755 0.6122 11.00000 0.05 0.28
Q4 1 0.5411 0.6271 0.5000 10.50000 0.05 0.28
Q5 1 0.6171 0.6655 0.7431 11.00000 0.05 0.22
Q6 1 0.5713 0.7287 0.7354 11.00000 0.05 0.18
Q7 1 0.5371 0.6944 0.7407 11.00000 0.05 0.18
Q8 1 0.5765 0.7113 0.8244 11.00000 0.05 0.17
Q9 1 0.5226 0.5687 0.6413 11.00000 0.05 0.15
Q10 1 0.5414 0.5957 0.4016 11.00000 0.05 0.15
Q11 1 0.6437 0.8809 0.6656 11.00000 0.05 0.14
Q12 1 0.6459 0.9308 1.0000 10.50000 0.05 0.13
Q13 1 0.5000 0.5000 1.1564 10.25000 0.05 0.12
Q14 1 0.6129 0.7375 1.0000 10.50000 0.05 0.11
Q15 1 0.5469 0.7223 0.9060 11.00000 0.05 0.11
Q16 1 0.4561 0.4065 1.0000 10.50000 0.05 0.11
Q17 1 0.5714 0.7164 0.9312 11.00000 0.05 0.11
Q18 1 0.5200 0.7117 0.8948 11.00000 0.05 0.10
Q19 1 0.6871 0.8203 1.0000 10.50000 0.05 0.10
Q20 1 0.6109 0.7148 0.9023 11.00000 0.05 0.09
REM The information below was added by Olex2.
REM
REM R1 = 0.0143 for 960 Fo > 4sig(Fo) and 0.0143 for all 11071 data
REM n/a parameters refined using n/a restraints
REM Highest difference peak 0.31, deepest hole -0.47
REM Mean Shift 0, Max Shift 0.000.
REM +++ Tabular Listing of Refinement Information +++
REM R1_all = 0.0143
REM R1_gt = 0.0143
REM wR_ref = 0.0398
REM GOOF = 1.209
REM Shift_max = 0.000
REM Shift_mean = 0
REM Reflections_all = 11071
REM Reflections_gt = 960
REM Parameters = n/a
REM Hole = -0.47
REM Peak = 0.31
REM Flack = n/a
;
_cod_data_source_file d4sc04843a2.cif
_cod_data_source_block mo_d8v1828_0m-1_a
_cod_depositor_comments
'Adding full bibliography for 1572714--1572719.cif.'
_cod_original_cell_volume 1124.1(8)
_cod_original_formula_sum 'C2 H3 Ag0.12 K0.12 N0.50 O1.50'
_cod_database_code 1572719
_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 0.846
_shelx_estimated_absorpt_t_min 0.739
_olex2_refinement_description
;
1. Fixed Uiso
At 1.2 times of:
All C(H,H) groups
At 1.5 times of:
All O(H) groups
2.a Free rotating group:
O5(H5)
2.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 0.01489(7) Uani 1 8 d S T P . .
K002 K 0.5000 0.5000 1.0000 0.04224(19) Uani 1 8 d S T P . .
N003 N 0.56048(11) 0.66181(10) 0.5000 0.0226(2) Uani 1 2 d S T P . .
O004 O 0.56958(11) 0.68584(9) 0.76958(12) 0.0456(3) Uani 1 1 d . . . . .
O5 O 0.64110(18) 0.85219(16) 1.0000 0.0554(4) Uani 1 2 d S T P . .
H5 H 0.6227 0.8112 0.9200 0.083 Uiso 1 1 d G . . . .
C006 C 0.58288(10) 0.72281(9) 0.63533(15) 0.0281(2) Uani 1 1 d . . . . .
C007 C 0.62618(12) 0.84180(10) 0.59053(17) 0.0357(3) Uani 1 1 d . . . . .
H00A H 0.7052 0.8550 0.6324 0.043 Uiso 1 1 calc R . . . .
H00B H 0.5741 0.9026 0.6324 0.043 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 0.01505(8) 0.01505(8) 0.01457(10) 0.000 0.000 0.000
K002 0.0442(3) 0.0442(3) 0.0384(4) 0.000 0.000 0.000
N003 0.0223(5) 0.0170(5) 0.0284(6) 0.000 0.000 -0.0026(4)
O004 0.0686(7) 0.0375(5) 0.0308(5) -0.0008(4) -0.0019(5) -0.0129(5)
O5 0.0711(11) 0.0487(9) 0.0465(9) 0.000 0.000 -0.0199(8)
C006 0.0294(5) 0.0228(4) 0.0323(6) -0.0033(4) -0.0017(4) -0.0030(4)
C007 0.0417(6) 0.0222(5) 0.0431(7) -0.0043(5) -0.0028(5) -0.0090(4)
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'
K K 0.2009 0.2494 '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'
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
N003 Ag01 N003 180.0 . 9_666 ?
N003 Ag01 N003 90.000(12) 9_666 3_655 ?
N003 Ag01 N003 90.001(12) . 3_655 ?
N003 Ag01 N003 89.999(12) . 11_566 ?
N003 Ag01 N003 90.000(12) 9_666 11_566 ?
N003 Ag01 N003 180.0 11_566 3_655 ?
O004 K002 O004 65.34(2) 12_657 9_667 ?
O004 K002 O004 180.0 12_657 4_565 ?
O004 K002 O004 80.47(5) 11_567 4_565 ?
O004 K002 O004 114.66(3) 11_567 . ?
O004 K002 O004 80.47(4) 2_665 9_667 ?
O004 K002 O004 180.0 9_667 . ?
O004 K002 O004 80.47(4) 10_557 . ?
O004 K002 O004 180.0 10_557 2_665 ?
O004 K002 O004 114.66(2) 12_657 . ?
O004 K002 O004 65.34(2) 10_557 11_567 ?
O004 K002 O004 65.34(3) 2_665 4_565 ?
O004 K002 O004 114.66(2) 2_665 11_567 ?
O004 K002 O004 99.53(5) 3_655 4_565 ?
O004 K002 O004 114.66(2) 10_557 3_655 ?
O004 K002 O004 99.53(4) 10_557 9_667 ?
O004 K002 O004 65.34(2) 2_665 3_655 ?
O004 K002 O004 114.66(3) 3_655 9_667 ?
O004 K002 O004 180.0 11_567 3_655 ?
O004 K002 O004 114.66(2) 4_565 9_667 ?
O004 K002 O004 65.34(3) 10_557 12_657 ?
O004 K002 O004 99.53(4) 2_665 . ?
O004 K002 O004 114.66(3) 2_665 12_657 ?
O004 K002 O004 65.34(3) 3_655 . ?
O004 K002 O004 99.53(5) 11_567 12_657 ?
O004 K002 O004 65.34(2) 4_565 . ?
O004 K002 O004 80.47(5) 3_655 12_657 ?
O004 K002 O004 114.66(3) 10_557 4_565 ?
O004 K002 O004 65.34(3) 11_567 9_667 ?
C006 N003 Ag01 123.38(6) . . ?
C006 N003 Ag01 123.38(6) 10_556 . ?
C006 N003 C006 113.24(13) 10_556 . ?
C006 O004 K002 152.11(8) . . ?
N003 C006 C007 108.92(11) . . ?
O004 C006 N003 124.74(10) . . ?
O004 C006 C007 126.34(11) . . ?
C006 C007 C007 104.46(7) . 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 N003 1.9960(12) . ?
Ag01 N003 1.9960(13) 11_566 ?
Ag01 N003 1.9960(12) 9_666 ?
Ag01 N003 1.9960(13) 3_655 ?
K002 O004 3.0035(12) 12_657 ?
K002 O004 3.0035(12) 11_567 ?
K002 O004 3.0035(12) 3_655 ?
K002 O004 3.0036(11) . ?
K002 O004 3.0035(11) 9_667 ?
K002 O004 3.0035(11) 10_557 ?
K002 O004 3.0035(11) 2_665 ?
K002 O004 3.0035(12) 4_565 ?
N003 C006 1.3646(13) 10_556 ?
N003 C006 1.3646(13) . ?
O004 C006 1.2182(16) . ?
O5 H5 0.8505 . ?
C006 C007 1.5109(16) . ?
C007 C007 1.525(3) 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 2676.13 72.99
1 -1 0 2752.02 73.39
1 1 0 3041.8 73.59
-1 1 0 2686.93 72.99
-1 1 0 2764.62 73.29
-1 1 0 2498.35 73.39
-1 -1 0 3128.09 73.69
0 2 0 917.71 23.3
2 0 0 946.41 23.4
0 -2 0 889.81 22.9
0 -2 0 868.21 22.5
0 2 0 911.81 23.2
-2 0 0 848.62 22.4
0 -2 0 800.12 22.4
0 -2 0 811.02 22.4
0 2 0 823.52 22.4
0 2 0 832.42 22.4
2 0 0 814.82 22.5
2 -2 0 125.89 3.9
2 -2 0 126.29 3.6
2 2 0 130.79 3.8
-2 2 0 126.19 3.6
2 -2 0 127.49 3.7
-2 2 0 127.49 3.9
-2 2 0 120.89 3.8
-2 -2 0 124.29 3.9
-2 -2 0 124.69 3.8
1 -3 0 114.69 3.5
-3 -1 0 118.39 3.6
-1 3 0 115.69 3.5
-1 3 0 113.69 3.4
1 -3 0 114.49 3.3
-3 -1 0 108.29 3.5
-1 3 0 111.59 3.3
-1 3 0 112.69 3.5
1 -3 0 111.19 3.2
1 -3 0 112.69 3.5
3 1 0 110.89 3.6
3 1 0 118.09 3.6
-3 1 0 9547.84 245.18
1 3 0 9063.69 244.38
1 3 0 9588.84 243.88
3 -1 0 8705.13 242.78
-1 -3 0 9999 245.18
-1 -3 0 9950.5 243.28
-1 -3 0 8618.44 243.58
-3 -3 0 101.99 3.6
-3 -3 0 114.99 3.5
3 -3 0 100.79 3.2
3 -3 0 97.29 3.3
3 3 0 97.19 3.5
-3 3 0 101.19 3.5
-3 3 0 107.49 3.5
-2 4 0 552.44 15.1
2 -4 0 549.54 15
4 2 0 560.14 15.3
-2 4 0 559.94 15
2 -4 0 553.74 14.8
2 -4 0 550.24 14.7
4 2 0 556.94 15.3
-4 -2 0 567.34 15.3
-4 -2 0 571.04 15.3
-2 4 0 556.74 15.2
-2 4 0 555.14 14.8
2 -4 0 545.35 15.2
4 0 0 22.1 1.1
0 -4 0 22.4 1.2
0 -4 0 21.6 0.9
0 4 0 27.8 1.3
0 -4 0 21 1.2
0 4 0 20.9 1.1
-4 0 0 22.7 1.1
0 4 0 23.8 1.3
0 4 0 21.9 1.2
4 -2 0 7749.22 215.38
-2 -4 0 8788.52 218.58
2 4 0 8209.38 216.18
-4 2 0 8072.29 217.08
2 4 0 8552.94 218.48
4 -2 0 8424.66 215.58
-2 -4 0 8382.06 215.78
4 -2 0 7779.62 216.28
4 4 0 2692.53 72.39
4 -4 0 2853.21 73.99
-4 -4 0 2628.64 72.49
-4 -4 0 2993.5 73.59
4 4 0 2642.94 72.59
-4 4 0 2899.31 73.99
4 -4 0 2580.04 72.39
4 -4 0 2814.32 72.89
-4 4 0 2660.13 72.39
4 -4 0 2902.91 73.59
-4 4 0 2840.72 74.19
-3 5 0 1991 51.99
5 3 0 1885.21 51.99
3 -5 0 2051.09 51.89
-3 5 0 1952.8 51.79
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0 -8 10 150.78 9.2
8 0 10 156.78 7.5
0 8 10 153.78 9.4
2 8 -10 119.69 8.1
2 8 -10 122.99 10.2
2 8 10 104.29 8.5
-2 -8 10 116.59 8.4
8 -2 10 108.99 7.1
4 8 -10 64.19 7
4 8 -10 75.29 8.4
4 8 10 72.79 8.2
-4 -8 10 62.89 7.5
8 -4 10 71.59 6.9
-3 9 -10 143.49 9.3
-3 9 -10 161.98 12
9 3 -10 152.48 10.2
9 3 10 126.99 10.1
3 -9 10 158.78 9.9
-3 9 10 135.89 9.5
-1 9 -10 59.19 8
-1 9 -10 58.19 7.2
-1 9 10 49.3 6
1 -9 10 65.49 7.6
9 1 10 73.99 8.3
1 9 -10 94.89 10.6
1 9 -10 90.69 8
-1 -9 10 101.89 8.3
9 -1 10 96.19 6.8
1 9 10 97.49 8.3
3 9 -10 64.59 7.6
3 9 -10 73.79 8.2
3 9 10 63.39 8.5
9 -3 10 63.69 7
-3 -9 10 54.39 7.7
-1 0 11 149.59 7.2
0 1 11 142.49 7.1
1 0 11 142.19 6.8
0 1 11 127.49 6.5
-1 0 11 161.68 9.7
0 -1 11 125.69 7.4
0 -1 11 141.39 7.1
1 0 11 117.79 7.8
-1 2 11 72.59 5
2 1 11 66.89 4.8
-2 -1 11 59.19 5.7
1 -2 11 61.39 5.6
2 -1 11 88.19 5.9
1 2 11 90.29 6.6
-1 -2 11 78.69 6.3
-2 1 11 91.69 5.8
-1 -2 11 93.39 6.4
1 2 11 94.39 5.2
3 2 11 44.3 3.9
2 -3 11 38.9 4.5
-3 -2 11 51.49 5.8
-2 3 11 48.3 4.5
0 -3 11 68.29 5.9
0 3 11 61.69 4.4
3 0 11 58.09 4.8
-3 0 11 65.79 5.7
2 3 -11 54.89 6.7
-3 2 11 43.8 4.9
3 -2 11 49.5 5.3
2 3 11 46.3 3.5
-2 -3 11 50.79 5.8
4 3 -11 30.9 4.8
-4 -3 11 28.7 4.5
-3 4 11 31.4 3.5
3 -4 11 35.4 4.6
-1 4 11 26.6 2.9
-4 -1 11 28.5 4.1
1 -4 11 25.1 3.9
4 1 11 33.7 4.1
1 4 -11 75.59 7.7
-4 1 11 68.99 5.8
4 -1 11 68.69 5.4
-1 -4 11 70.69 6.7
3 4 -11 84.89 8.4
4 -3 11 91.79 6.5
-4 3 11 97.79 6.1
-3 -4 11 91.29 7.4
5 4 -11 85.99 9.1
4 -5 11 95.19 7.3
-5 -4 11 87.09 7.9
5 2 -11 12.5 3.6
2 -5 11 15.8 3.9
-5 -2 11 13 3.6
0 5 -11 69.99 8.4
0 -5 11 76.09 6.9
-5 0 11 69.19 6.5
5 0 11 71.19 5.5
2 5 -11 179.48 10.8
-2 -5 11 181.18 9.7
-5 2 11 180.18 8.6
5 -2 11 171.88 8.6
4 5 -11 131.69 10.6
-5 4 11 128.59 7.2
-4 -5 11 133.19 9.1
5 -4 11 138.69 8.2
6 3 -11 72.49 8.2
-6 -3 11 81.79 7.8
3 -6 11 81.59 7.8
-1 6 -11 100.29 9.6
6 1 11 113.39 9
-6 -1 11 87.09 7.5
1 -6 11 106.49 8.1
1 6 -11 142.99 10.8
6 -1 11 147.19 7.8
-1 -6 11 127.79 8.8
-6 1 11 159.58 8.5
3 6 -11 84.99 10.1
3 6 -11 99.59 7.5
-6 3 11 80.09 6.9
-3 -6 11 92.59 8.1
6 -3 11 92.59 7.3
0 7 -11 69.89 7.6
0 7 -11 61.19 7.5
0 -7 11 57.59 7.5
-7 0 11 56.49 7.3
7 0 11 73.09 6.8
0 0 12 182.68 8.7
-1 -1 12 93.09 7.2
-1 1 12 94.79 6.6
1 1 12 102.49 6.6
1 -1 12 105.69 7.2
2 0 12 90.19 6.8
0 -2 12 112.79 7.7
-2 0 12 111.59 7.5
-2 -2 12 116.29 8.1
-2 2 12 106.69 7.2
2 -2 12 122.99 8