#------------------------------------------------------------------------------
#$Date: 2020-06-04 04:21:01 +0300 (Thu, 04 Jun 2020) $
#$Revision: 252621 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/80/1558007.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_1558007
loop_
_publ_author_name
'Ma, Lie-Feng'
'Chen, Meng-Jia'
'Liang, Dong-E'
'Shi, Lin-Mei'
'Ying, You-Min'
'Shan, Wei-Guang'
'Li, Guo-Qiang'
'Zhan, Zha-Jun'
_publ_section_title
;
Streptomyces albogriseolus SY67903 Produces Eunicellin
Diterpenoids Structurally Similar to Terpenes of the Gorgonian
Muricella sibogae, the Bacterial Source.
;
_journal_issue 5
_journal_name_full 'Journal of natural products'
_journal_page_first 1641
_journal_page_last 1645
_journal_paper_doi 10.1021/acs.jnatprod.0c00147
_journal_volume 83
_journal_year 2020
_chemical_absolute_configuration ad
_chemical_formula_moiety 'C21 H28 O5, C H4 O'
_chemical_formula_sum 'C22 H32 O6'
_chemical_formula_weight 392.47
_space_group_crystal_system orthorhombic
_space_group_IT_number 19
_space_group_name_Hall 'P 2ac 2ab'
_space_group_name_H-M_alt 'P 21 21 21'
_atom_sites_solution_hydrogens mixed
_atom_sites_solution_primary dual
_audit_creation_date 2020-04-09
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_formula_units_Z 4
_cell_length_a 9.2448(4)
_cell_length_b 10.1376(4)
_cell_length_c 22.4575(9)
_cell_measurement_reflns_used 9726
_cell_measurement_temperature 170(2)
_cell_measurement_theta_max 72.24
_cell_measurement_theta_min 4.36
_cell_volume 2104.72(15)
_computing_cell_refinement 'SAINT V8.38A (?, 2016)'
_computing_data_reduction 'SAINT V8.38A (?, 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 'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature 170.0
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type 'Bruker APEX-II CCD'
_diffrn_measurement_method '\f and \w scans'
_diffrn_radiation_type CuK\a
_diffrn_radiation_wavelength 1.54178
_diffrn_reflns_av_R_equivalents 0.0343
_diffrn_reflns_av_unetI/netI 0.0191
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max 11
_diffrn_reflns_limit_h_min -11
_diffrn_reflns_limit_k_max 12
_diffrn_reflns_limit_k_min -12
_diffrn_reflns_limit_l_max 27
_diffrn_reflns_limit_l_min -27
_diffrn_reflns_number 35059
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full 67.679
_diffrn_reflns_theta_max 72.364
_diffrn_reflns_theta_min 3.937
_diffrn_standards_number 0
_exptl_absorpt_coefficient_mu 0.727
_exptl_absorpt_correction_T_max 0.7536
_exptl_absorpt_correction_T_min 0.6431
_exptl_absorpt_correction_type multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1482 before and 0.0711 after correction.
The Ratio of minimum to maximum transmission is 0.8534.
The \l/2 correction factor is Not present.
;
_exptl_crystal_colour colourless
_exptl_crystal_colour_primary colourless
_exptl_crystal_density_diffrn 1.239
_exptl_crystal_description block
_exptl_crystal_F_000 848
_exptl_crystal_size_max 0.42
_exptl_crystal_size_mid 0.35
_exptl_crystal_size_min 0.3
_refine_diff_density_max 0.223
_refine_diff_density_min -0.165
_refine_diff_density_rms 0.031
_refine_ls_abs_structure_details
;
Flack x determined using 1751 quotients [(I+)-(I-)]/[(I+)+(I-)]
(Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack 0.01(2)
_refine_ls_extinction_method none
_refine_ls_goodness_of_fit_ref 1.057
_refine_ls_hydrogen_treatment mixed
_refine_ls_matrix_type full
_refine_ls_number_parameters 262
_refine_ls_number_reflns 4153
_refine_ls_number_restraints 1
_refine_ls_restrained_S_all 1.057
_refine_ls_R_factor_all 0.0285
_refine_ls_R_factor_gt 0.0283
_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^)+(0.0463P)^2^+0.3536P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme calc
_refine_ls_wR_factor_gt 0.0794
_refine_ls_wR_factor_ref 0.0796
_reflns_Friedel_coverage 0.744
_reflns_Friedel_fraction_full 0.998
_reflns_Friedel_fraction_max 0.997
_reflns_number_gt 4136
_reflns_number_total 4153
_reflns_threshold_expression 'I > 2\s(I)'
_cod_data_source_file np0c00147_si_002.cif
_cod_data_source_block 191120_hm183_18_0m
_cod_depositor_comments
'Adding full bibliography for 1558007--1558008.cif.'
_cod_database_code 1558007
_shelx_shelxl_version_number 2016/6
_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 0.812
_shelx_estimated_absorpt_t_min 0.750
_olex2_refinement_description
;
1. Fixed Uiso
At 1.2 times of:
All C(H) groups, All C(H,H) groups
At 1.5 times of:
All C(H,H,H) groups, All O(H) groups
2. Restrained distances
O1-H1
0.84 with sigma of 0.02
3.a Ternary CH refined with riding coordinates:
C1(H1A), C8(H8), C10(H10)
3.b Secondary CH2 refined with riding coordinates:
C4(H4A,H4B), C5(H5A,H5B), C9(H9A,H9B), C12(H12A,H12B), C13(H13A,H13B)
3.c Aromatic/amide H refined with riding coordinates:
C2(H2A), C6(H6)
3.d X=CH2 refined with riding coordinates:
C17(H17A,H17B)
3.e Idealised Me refined as rotating group:
C19(H19A,H19B,H19C), C20(H20A,H20B,H20C), C21(H21A,H21B,H21C), C22(H22A,H22B,
H22C)
3.f Idealised tetrahedral OH refined as rotating group:
O2(H2), O6(H6A)
;
_shelx_res_file
;
TITL 191120_hm183_18_0m_a.res in P2(1)2(1)2(1)
191120_hm183_18_0m.res
created by SHELXL-2016/6 at 15:31:16 on 09-Apr-2020
REM Old TITL 191120_HM183_18_0m in P2(1)2(1)2(1)
REM SHELXT solution in P2(1)2(1)2(1)
REM R1 0.132, Rweak 0.029, Alpha 0.001, Orientation as input
REM Flack x = 0.128 ( 0.023 ) from Parsons' quotients
REM Formula found by SHELXT: C21 O7
CELL 1.54178 9.2448 10.1376 22.4575 90 90 90
ZERR 4 0.0004 0.0004 0.0009 0 0 0
LATT -1
SYMM 0.5-X,-Y,0.5+Z
SYMM -X,0.5+Y,0.5-Z
SYMM 0.5+X,0.5-Y,-Z
SFAC C H O
UNIT 88 128 24
DFIX 0.84 O1 H1
L.S. 20
PLAN 20
SIZE 0.3 0.35 0.42
TEMP -103.15
BOND $H
htab
list 4
fmap 2 53
acta
REM
REM
REM
WGHT 0.046300 0.353600
FVAR 0.58509
O1 3 0.226144 0.689135 0.743157 11.00000 0.04315 0.03887 =
0.02265 -0.00782 -0.00050 0.00626
O2 3 0.483847 0.604419 0.742581 11.00000 0.04309 0.07680 =
0.02452 0.00523 -0.00515 0.01727
AFIX 147
H2 2 0.405181 0.638210 0.753429 11.00000 -1.50000
AFIX 0
O3 3 0.615160 0.593254 0.661328 11.00000 0.02914 0.04074 =
0.03061 0.00199 -0.00510 0.00254
O4 3 0.498821 0.651422 0.403991 11.00000 0.04479 0.06211 =
0.03146 0.01212 0.00262 -0.02072
O5 3 0.286043 0.549862 0.396621 11.00000 0.03265 0.03908 =
0.02299 0.00204 -0.00251 -0.00184
C1 1 0.284238 0.424898 0.575646 11.00000 0.01917 0.01927 =
0.02233 -0.00177 -0.00080 -0.00134
AFIX 13
H1A 2 0.371081 0.456495 0.598037 11.00000 -1.20000
AFIX 0
C2 1 0.299714 0.469116 0.511835 11.00000 0.02011 0.01991 =
0.02221 -0.00378 -0.00093 0.00115
AFIX 43
H2A 2 0.227879 0.440241 0.484539 11.00000 -1.20000
AFIX 0
C3 1 0.405637 0.545426 0.490211 11.00000 0.02251 0.01909 =
0.02318 -0.00172 0.00272 0.00291
C4 1 0.534582 0.594436 0.525176 11.00000 0.02229 0.02549 =
0.02739 0.00196 -0.00002 -0.00226
AFIX 23
H4A 2 0.618580 0.600385 0.497965 11.00000 -1.20000
H4B 2 0.558322 0.528450 0.556169 11.00000 -1.20000
AFIX 0
C5 1 0.513346 0.729933 0.555575 11.00000 0.03784 0.02276 =
0.02668 0.00201 -0.00341 -0.00770
AFIX 23
H5A 2 0.601688 0.752583 0.578296 11.00000 -1.20000
H5B 2 0.499326 0.798317 0.524637 11.00000 -1.20000
AFIX 0
C6 1 0.385753 0.730415 0.596906 11.00000 0.03301 0.01566 =
0.02803 -0.00254 -0.00706 -0.00182
AFIX 43
H6 2 0.301248 0.772241 0.581978 11.00000 -1.20000
AFIX 0
C7 1 0.374215 0.680091 0.651974 11.00000 0.03132 0.01899 =
0.02430 -0.00378 -0.00386 0.00086
C8 1 0.225229 0.663866 0.679727 11.00000 0.03224 0.02795 =
0.02073 -0.00326 -0.00172 0.00539
AFIX 13
H8 2 0.157432 0.727539 0.660292 11.00000 -1.20000
AFIX 0
C9 1 0.167516 0.523368 0.670046 11.00000 0.02683 0.03015 =
0.02191 0.00119 0.00225 0.00122
AFIX 23
H9A 2 0.073466 0.513354 0.690635 11.00000 -1.20000
H9B 2 0.236028 0.458913 0.687405 11.00000 -1.20000
AFIX 0
C10 1 0.147996 0.494513 0.602679 11.00000 0.02084 0.02196 =
0.02237 0.00095 0.00124 0.00026
AFIX 13
H10 2 0.139671 0.582028 0.582421 11.00000 -1.20000
AFIX 0
C11 1 0.009101 0.420942 0.589830 11.00000 0.02146 0.03274 =
0.02522 0.00162 0.00322 -0.00328
C12 1 0.014006 0.274164 0.600356 11.00000 0.02559 0.03147 =
0.04399 0.00532 -0.00125 -0.00727
AFIX 23
H12A 2 -0.079376 0.233972 0.588676 11.00000 -1.20000
H12B 2 0.030137 0.256196 0.643175 11.00000 -1.20000
AFIX 0
C13 1 0.136647 0.213742 0.563614 11.00000 0.03172 0.02451 =
0.04337 -0.00329 -0.00454 -0.00611
AFIX 23
H13A 2 0.140102 0.117375 0.570610 11.00000 -1.20000
H13B 2 0.117811 0.228576 0.520738 11.00000 -1.20000
AFIX 0
C14 1 0.280028 0.274132 0.580192 11.00000 0.02778 0.01961 =
0.02521 -0.00171 0.00156 -0.00210
C15 1 0.403411 0.588198 0.426596 11.00000 0.02656 0.02217 =
0.02531 -0.00131 0.00365 0.00180
C16 1 0.501527 0.623092 0.684606 11.00000 0.03285 0.02703 =
0.02517 -0.00131 -0.00653 -0.00063
C17 1 -0.106906 0.481360 0.569394 11.00000 0.02421 0.04289 =
0.05016 0.00662 -0.00271 -0.00174
AFIX 93
H17A 2 -0.191788 0.432180 0.560698 11.00000 -1.20000
H17B 2 -0.105668 0.574104 0.563355 11.00000 -1.20000
AFIX 0
C18 1 0.396473 0.204193 0.596886 11.00000 0.03143 0.02172 =
0.02558 0.00082 0.00338 0.00034
C19 1 0.401120 0.055089 0.597935 11.00000 0.04257 0.02136 =
0.04792 0.00129 0.00327 0.00298
AFIX 137
H19A 2 0.306737 0.019989 0.585951 11.00000 -1.50000
H19B 2 0.424099 0.024839 0.638288 11.00000 -1.50000
H19C 2 0.475535 0.023822 0.570247 11.00000 -1.50000
AFIX 0
C20 1 0.538448 0.263199 0.615875 11.00000 0.02887 0.02736 =
0.03792 0.00566 -0.00284 0.00419
AFIX 137
H20A 2 0.582928 0.308709 0.582009 11.00000 -1.50000
H20B 2 0.603048 0.193010 0.629776 11.00000 -1.50000
H20C 2 0.521872 0.326321 0.648214 11.00000 -1.50000
AFIX 0
C21 1 0.278024 0.591218 0.335194 11.00000 0.04564 0.05080 =
0.02194 0.00136 -0.00200 0.00639
AFIX 137
H21A 2 0.350135 0.542993 0.311760 11.00000 -1.50000
H21B 2 0.297325 0.686093 0.332560 11.00000 -1.50000
H21C 2 0.181170 0.572642 0.319565 11.00000 -1.50000
AFIX 0
O6 3 0.194340 -0.050062 0.764349 11.00000 0.04912 0.04210 =
0.03776 -0.00915 -0.01146 -0.00267
AFIX 147
H6A 2 0.247635 -0.017310 0.790790 11.00000 -1.50000
AFIX 0
C22 1 0.158538 0.047983 0.722177 11.00000 0.03837 0.06827 =
0.03587 0.00691 -0.00108 -0.00760
AFIX 137
H22A 2 0.084593 0.106551 0.738872 11.00000 -1.50000
H22B 2 0.121070 0.006048 0.686010 11.00000 -1.50000
H22C 2 0.245106 0.099387 0.712385 11.00000 -1.50000
AFIX 0
H1 2 0.219204 0.771467 0.747650 11.00000 -1.20000
HKLF 4
REM 191120_hm183_18_0m_a.res in P2(1)2(1)2(1)
REM R1 = 0.0283 for 4136 Fo > 4sig(Fo) and 0.0285 for all 4153 data
REM 262 parameters refined using 1 restraints
END
WGHT 0.0463 0.3536
REM Instructions for potential hydrogen bonds
HTAB O2 O1
EQIV $1 x-1/2, -y+3/2, -z+1
HTAB C8 O4_$1
EQIV $2 -x+1, y-1/2, -z+3/2
HTAB O6 O3_$2
EQIV $3 x, y+1, z
HTAB O1 O6_$3
REM Highest difference peak 0.223, deepest hole -0.165, 1-sigma level 0.031
Q1 1 0.5484 0.3543 0.6109 11.00000 0.05 0.22
Q2 1 0.0764 0.4590 0.5957 11.00000 0.05 0.20
Q3 1 0.6211 0.2222 0.5930 11.00000 0.05 0.19
Q4 1 0.5533 0.2426 0.6586 11.00000 0.05 0.17
Q5 1 0.3906 0.1325 0.5991 11.00000 0.05 0.17
Q6 1 0.2155 0.4608 0.5900 11.00000 0.05 0.16
Q7 1 0.3517 0.2346 0.5771 11.00000 0.05 0.16
Q8 1 0.2769 0.3446 0.5810 11.00000 0.05 0.15
Q9 1 0.0753 0.2429 0.5845 11.00000 0.05 0.15
Q10 1 -0.0619 0.4632 0.6002 11.00000 0.05 0.15
Q11 1 0.2064 0.5923 0.6752 11.00000 0.05 0.15
Q12 1 0.3237 0.5443 0.5042 11.00000 0.05 0.15
Q13 1 0.4011 0.5645 0.4620 11.00000 0.05 0.15
Q14 1 0.1662 0.5032 0.6373 11.00000 0.05 0.14
Q15 1 0.2982 0.6829 0.6660 11.00000 0.05 0.14
Q16 1 0.3781 0.6680 0.6207 11.00000 0.05 0.14
Q17 1 0.3046 0.4522 0.5442 11.00000 0.05 0.13
Q18 1 0.2081 0.2397 0.5784 11.00000 0.05 0.13
Q19 1 0.2789 -0.0860 0.7511 11.00000 0.05 0.13
Q20 1 0.0106 0.3472 0.5974 11.00000 0.05 0.12
;
_shelx_res_checksum 87532
_shelx_hkl_file
;
1 0 0 1.60 0.80
1 0 0 0.90 0.10
2 0 0 51.69 1.90
-2 0 0 49.90 1.90
-2 0 0 59.89 6.00
2 0 0 51.19 1.80
2 0 0 53.89 1.90
2 0 0 50.79 1.80
2 0 0 51.19 1.80
2 0 0 49.10 2.00
3 0 0 2.70 0.20
-3 0 0 1.80 1.90
-4 0 0 374.56 24.90
4 0 0 366.46 12.30
-4 0 0 363.56 23.40
4 0 0 340.77 12.00
-5 0 0 5.50 7.00
5 0 0 1.60 0.40
6 0 0 106.59 4.10
-6 0 0 112.79 4.50
6 0 0 109.59 4.20
6 0 0 111.39 4.60
-7 0 0 1.10 0.50
7 0 0 0.30 0.30
7 0 0 1.50 0.70
7 0 0 0.00 0.30
7 0 0 -0.30 0.30
7 0 0 0.40 0.20
8 0 0 602.94 20.10
8 0 0 577.84 20.50
8 0 0 599.74 24.50
8 0 0 586.14 20.90
8 0 0 612.14 20.60
8 0 0 599.24 19.90
9 0 0 0.30 0.40
9 0 0 1.20 0.60
9 0 0 0.10 0.20
9 0 0 0.90 1.10
9 0 0 0.30 0.20
10 0 0 347.17 16.60
10 0 0 404.36 13.20
10 0 0 411.46 13.80
10 0 0 414.96 13.80
11 0 0 0.10 0.10
11 0 0 -0.20 0.20
11 0 0 0.20 0.20
11 0 0 0.30 0.60
0 1 0 0.60 0.50
0 -1 0 0.70 0.50
0 1 0 0.80 0.10
-1 -1 0 2132.19 71.49
1 -1 0 2131.99 79.09
-1 1 0 2147.59 78.39
2 1 0 156.08 5.30
2 -1 0 157.08 13.50
2 1 0 148.89 5.20
-2 1 0 153.78 12.80
-2 -1 0 167.48 7.70
-2 -1 0 145.89 5.20
2 -1 0 140.79 5.20
2 1 0 146.59 5.20
2 -1 0 154.88 5.30
2 1 0 168.08 5.20
-2 -1 0 156.68 8.30
2 1 0 154.88 5.20
-2 1 0 152.68 5.30
-3 -1 0 1830.42 67.79
-3 1 0 1885.01 77.49
-3 -1 0 1835.52 67.09
-4 -1 0 429.16 23.10
4 1 0 431.56 14.50
-4 1 0 409.06 30.20
4 -1 0 416.26 14.30
4 -1 0 424.66 14.30
-4 1 0 437.46 14.60
-4 1 0 435.26 35.90
4 1 0 431.56 14.50
4 1 0 415.66 14.30
4 -1 0 429.76 14.60
-4 -1 0 425.56 14.50
4 1 0 436.06 14.20
-4 -1 0 438.36 23.40
4 1 0 423.06 14.30
5 1 0 135.79 4.70
-5 -1 0 103.79 15.00
5 1 0 130.29 4.90
5 1 0 130.89 4.70
5 -1 0 132.39 5.00
-5 1 0 112.29 18.30
-5 1 0 127.09 4.90
5 -1 0 126.39 4.60
-5 -1 0 133.19 4.90
5 -1 0 126.09 4.60
6 1 0 134.49 5.10
6 1 0 139.59 5.40
-6 -1 0 141.89 5.30
-6 1 0 129.99 5.40
6 -1 0 133.89 5.00
6 1 0 135.79 5.10
6 -1 0 135.29 4.90
7 1 0 6.40 1.10
7 1 0 9.40 2.20
7 -1 0 9.20 0.80
7 -1 0 9.60 0.70
7 -1 0 9.10 0.90
7 1 0 8.80 0.70
7 1 0 6.80 0.80
7 -1 0 9.40 2.20
7 -1 0 9.10 0.90
-7 -1 0 11.10 1.80
-7 1 0 8.80 1.00
7 -1 0 9.70 0.60
7 1 0 8.30 0.90
7 1 0 9.30 0.90
7 1 0 8.60 0.60
8 -1 0 173.98 7.10
8 1 0 167.98 6.90
8 -1 0 178.48 6.60
8 1 0 165.48 9.80
8 -1 0 177.48 6.30
8 -1 0 179.68 6.80
8 -1 0 173.18 6.10
8 -1 0 181.68 10.00
-8 1 0 170.58 6.30
8 1 0 182.68 6.40
8 1 0 176.28 6.80
8 1 0 173.38 6.10
8 1 0 174.08 6.70
8 -1 0 178.38 6.10
9 -1 0 8.60 2.30
9 -1 0 5.10 1.00
9 -1 0 6.90 0.60
9 1 0 6.60 0.90
9 1 0 6.90 0.50
9 1 0 6.40 0.60
9 1 0 6.60 1.00
-9 1 0 6.80 0.70
9 -1 0 6.70 0.90
9 -1 0 7.10 0.70
9 1 0 5.30 1.90
10 1 0 0.00 0.90
10 -1 0 0.50 0.20
10 1 0 -0.10 0.30
10 -1 0 0.30 0.80
10 -1 0 -0.40 0.40
10 1 0 0.00 0.20
10 1 0 0.10 0.10
10 1 0 -0.20 0.40
10 -1 0 0.30 0.20
10 -1 0 0.50 0.40
11 1 0 1.20 0.30
11 1 0 0.80 0.20
11 -1 0 0.80 0.30
11 -1 0 0.90 0.30
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3 -2 8 391.66 36.50
3 2 -8 399.06 13.50
-3 2 8 411.46 41.90
3 2 -8 384.06 13.50
3 2 8 403.96 13.70
-3 2 -8 377.46 42.20
-3 2 -8 410.46 13.90
3 2 8 398.96 33.60
3 2 8 409.96 13.80
3 -2 -8 397.46 13.40
-4 2 8 293.47 10.20
-4 -2 -8 334.67 27.30
-4 2 8 258.77 37.50
4 2 -8 284.97 10.00
-4 -2 -8 306.07 11.70
4 2 -8 291.97 10.00
4 -2 8 285.07 9.70
4 2 -8 282.07 9.80
4 -2 8 280.17 10.10
4 2 8 274.67 9.70
4 2 8 285.77 10.10
4 2 8 289.77 10.30
4 -2 -8 292.07 9.90
4 2 8 260.47 17.60
5 2 -8 52.69 2.40
-5 -2 -8 51.79 2.70
5 -2 8 49.10 2.50
5 -2 8 51.99 2.20
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5 2 -8 52.69 2.40
5 -2 -8 50.39 2.20
5 -2 -8 50.99 2.20
-5 2 -8 53.79 2.70
5 -2 -8 50.19 2.20
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5 2 8 52.79 2.60
6 2 -8 39.60 2.10
6 2 -8 38.50 1.50
6 2 -8 40.70 2.00
6 -2 8 31.00 4.10
6 2 -8 41.70 1.70
6 -2 8 40.10 1.80
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6 2 -8 38.10 1.90
6 -2 8 39.90 2.20
6 -2 8 35.70 2.10
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6 -2 8 42.50 1.80
6 2 -8 40.60 1.50
6 2 -8 40.60 1.50
6 -2 8 39.60 1.80
6 2 8 37.70 2.10
6 -2 -8 35.60 1.60
6 -2 -8 39.50 1.90
6 2 8 30.80 2.10
6 2 8 37.10 2.20
6 2 8 38.50 2.30
6 -2 -8 38.60 1.90
6 2 8 36.20 1.70
6 -2 -8 35.80 1.80
6 -2 -8 37.30 1.60
6 2 8 31.60 4.10
6 -2 -8 36.90 1.90
6 -2 -8 39.60 1.90
7 -2 8 3.60 0.60
7 -2 8 3.10 0.70
7 2 -8 3.50 0.30
7 -2 8 3.90 0.90
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7 2 -8 3.70 0.50
7 -2 8 3.90 0.50
7 2 -8 4.60 1.50
7 2 -8 3.50 0.60
7 2 -8 3.30 0.40
7 2 -8 3.40 0.90
7 -2 8 2.50 1.60
7 2 -8 3.90 0.30
7 2 -8 4.10 0.90
7 -2 -8 4.10 0.50
7 -2 -8 4.60 0.60
7 -2 -8 3.80 0.50
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7 -2 -8 3.90 0.60
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7 2 8 2.00 1.40
7 -2 -8 2.80 0.40
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7 2 8 3.30 0.80
7 -2 -8 3.70 0.60
7 2 8 2.90 0.70
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8 -2 8 5.10 2.00
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8 -2 8 8.50 0.70
8 -2 8 7.40 0.60
8 -2 8 7.00 1.00
8 2 -8 8.90 0.50
8 2 -8 9.60 0.90
8 2 -8 8.60 0.70
8 2 -8 7.90 2.00
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8 -2 -8 8.40 0.90
8 -2 -8 9.10 0.90
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8 -2 -8 8.10 0.60
8 2 8 9.30 0.70
8 -2 -8 9.20 0.70
8 -2 -8 7.90 0.70
8 2 8 7.20 2.20
8 2 8 9.20 1.10
-8 2 -8 7.50 0.80
9 2 -8 47.00 1.70
9 2 -8 47.50 1.80
9 2 -8 43.40 3.80
9 -2 8 45.70 2.00
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9 2 -8 46.60 2.20
9 -2 8 36.30 4.00
9 -2 8 46.00 2.20
9 2 -8 44.70 1.90
9 -2 8 47.70 2.50
9 2 8 48.10 2.30
9 -2 -8 45.60 1.80
9 -2 -8 44.30 2.20
9 2 8 49.00 2.40
9 -2 -8 44.60 1.90
9 2 8 41.70 4.20
9 -2 -8 44.70 1.90
9 -2 -8 45.20 2.30
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9 -2 -8 50.09 4.20
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10 -2 8 13.40 2.00
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10 -2 8 14.10 1.40
10 2 -8 14.40 0.80
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10 2 -8 14.30 0.60
10 2 -8 11.60 1.00
10 -2 8 13.90 0.90
10 2 -8 15.00 2.60
10 -2 -8 14.00 0.90
10 -2 -8 13.30 0.70
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10 -2 -8 12.00 2.50
10 2 8 15.70 0.80
10 2 8 15.00 1.00
10 2 8 12.10 2.20
-10 2 -8 11.90 0.90
0 3 8 143.59 5.30
0 3 -8 140.09 5.00
0 3 -8 145.19 5.10
0 3 8 120.09 21.20
0 3 -8 162.48 23.70
0 3 8 147.59 5.20
0 -3 8 144.29 5.00
0 3 8 147.09 5.10
0 -3 8 160.28 22.20
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1 3 -8 52.89 2.20
1 3 -8 51.89 2.40
1 3 -8 51.99 2.10
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1 -3 8 72.49 15.60
1 -3 8 49.90 2.00
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1 3 8 51.99 2.20
1 3 8 54.49 2.10
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1 3 8 47.30 12.80
1 -3 -8 52.89 1.90
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2 -3 8 280.07 30.80
2 -3 8 271.07 9.60
2 3 -8 289.27 9.70
-2 3 8 284.97 10.00
2 3 -8 275.27 9.70
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2 3 -8 240.08 27.30
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2 3 -8 285.37 9.90
-2 3 -8 292.87 9.80
2 3 8 280.37 9.90
2 3 8 284.37 9.90
-2 3 -8 223.38 34.30
2 -3 -8 285.27 9.50
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2 3 8 286.67 9.70
3 -3 8 30.50 14.80
3 -3 8 13.40 0.80
3 3 -8 13.80 0.90
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3 3 -8 11.70 1.30
3 3 -8 14.50 0.90
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-3 3 -8 14.70 16.80
3 3 8 17.20 7.00
3 -3 -8 12.90 0.70
4 -3 8 86.39 3.70
4 3 -8 89.89 3.60
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4 3 -8 96.49 3.80
4 3 -8 93.29 3.80
4 -3 8 90.69 3.40
4 3 8 96.89 3.60
4 -3 -8 92.69 3.60
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4 -3 -8 94.99 3.50
4 3 8 93.79 3.90
4 -3 -8 90.79 3.60
4 3 8 96.39 3.80
5 -3 8 201.08 7.00
-5 -3 -8 199.98 7.70
5 -3 8 189.68 7.30
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5 3 -8 203.18 7.40
5 3 -8 198.58 7.40
5 -3 -8 197.78 7.10
5 3 8 192.18 7.40
5 -3 -8 201.98 7.20
5 -3 -8 195.88 7.10
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6 -3 8 19.20 1.40
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6 3 -8 18.90 1.40
6 3 -8 17.30 0.80
6 3 -8 17.00 0.90
6 3 -8 17.40 0.80
6 -3 8 18.90 1.10
6 -3 8 18.30 1.30
6 3 -8 17.20 0.80
6 -3 8 19.30 1.70
6 3 -8 17.60 1.30
6 -3 8 17.50 1.10
6 3 -8 16.10 1.20
6 -3 8 18.00 2.90
6 -3 8 17.50 1.00
6 -3 -8 17.00 1.10
6 -3 -8 16.30 1.00
6 -3 -8 15.80 1.10
6 -3 -8 16.60 1.10
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6 3 8 16.80 1.40
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6 -3 -8 16.70 0.90
6 -3 -8 18.90 1.10
6 3 8 16.00 1.30
6 3 8 17.20 1.40
7 -3 8 16.90 1.60
7 -3 8 17.00 1.20
7 -3 8 12.60 2.70
7 3 -8 16.50 0.80
7 3 -8 15.10 1.40
7 3 -8 17.30 1.30
7 3 -8 17.80 1.00
7 3 -8 19.10 0.90
7 -3 8 16.80 1.10
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7 3 -8 20.40 3.20
7 3 -8 13.20 1.40
7 -3 8 16.60 1.30
7 -3 -8 14.00 1.00
7 -3 -8 16.70 1.20
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7 -3 -8 13.50 1.20
7 -3 -8 16.50 1.30
7 -3 -8 16.00 0.90
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7 3 8 18.40 1.40
7 3 8 13.10 1.40
7 3 8 15.70 1.00
7 -3 -8 15.90 1.10
7 -3 -8 16.00 1.10
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7 3 8 15.90 0.90
8 -3 8 68.29 3.40
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8 3 -8 65.99 2.60
8 3 -8 67.99 3.00
8 -3 8 68.99 2.70
8 -3 8 62.59 2.90
8 3 -8 67.69 2.50
8 3 -8 66.59 2.30
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8 -3 8 65.39 2.70
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8 -3 -8 64.89 2.90
8 -3 -8 66.69 2.70
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8 3 8 66.39 3.10
8 -3 -8 67.19 2.90
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8 -3 -8 62.79 2.60
8 -3 -8 64.99 2.60
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8 3 8 67.39 2.60
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9 3 -8 33.10 1.30
9 -3 8 30.50 1.60
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9 -3 8 26.40 3.10
9 -3 8 33.10 2.00
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9 -3 -8 32.30 1.40
9 -3 -8 30.30 1.60
9 -3 -8 33.80 1.90
9 -3 -8 35.40 3.40
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9 3 8 31.50 1.50
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9 -3 -8 30.40 1.40
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9 3 8 32.50 1.80
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10 -3 8 0.20 0.30
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10 3 -8 0.30 0.30
10 3 -8 0.40 0.10
10 -3 -8 0.60 0.30
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10 -3 -8 0.40 0.60
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10 -3 -8 0.30 0.10
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0 -4 8 10.10 10.00
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0 4 -8 33.00 1.50
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1 4 -8 21.30 1.40
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1 -4 8 29.70 16.00
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1 4 8 20.60 1.30
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1 4 8 10.50 10.20
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2 -4 8 70.79 2.70
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2 -4 8 63.39 16.20
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2 -4 -8 71.39 2.70
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2 4 8 74.29 2.90
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3 -4 8 18.20 1.00
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3 4 -8 16.80 0.80
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3 4 -8 18.60 1.20
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3 4 8 19.20 1.10
3 -4 -8 18.20 0.90
3 -4 -8 17.40 1.00
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5 -4 8 148.19 5.20
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5 -4 -8 137.09 5.10
5 -4 -8 148.89 5.30
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7 -4 8 68.49 2.80
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3 -10 8 42.30 2.00
3 10 8 37.70 1.60
3 -10 -8 39.90 1.60
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3 10 8 37.50 1.50
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4 -10 8 25.90 1.40
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4 10 -8 25.30 1.00
4 10 -8 26.90 1.10
4 -10 8 27.80 1.20
4 10 -8 23.10 1.20
4 10 8 25.60 1.00
4 10 8 27.10 1.10
4 10 8 25.10 1.10
-4 10 -8 26.80 1.10
-4 10 -8 25.10 1.10
4 -10 -8 25.20 1.30
4 -10 -8 26.20 1.10
4 10 8 25.20 1.10
5 10 -8 27.50 1.10
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5 -10 8 30.50 1.10
5 10 -8 27.30 1.00
5 -10 8 26.20 1.50
5 10 -8 28.80 1.10
5 10 -8 27.50 1.00
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5 10 8 27.90 1.10
5 -10 -8 27.00 1.10
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5 -10 -8 28.40 1.30
5 10 8 27.60 1.10
5 -10 -8 21.90 1.60
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6 10 -8 6.80 0.30
6 -10 8 7.20 0.50
6 10 -8 6.80 0.40
6 10 -8 6.80 0.30
6 10 8 7.40 0.30
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0 -11 -8 15.10 0.70
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0 -11 8 17.00 0.90
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1 11 -8 1.30 0.20
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1 -11 8 0.70 0.20
1 11 -8 1.10 0.20
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1 -11 -8 1.10 0.20
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3 -11 8 16.20 0.70
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3 11 -8 15.70 0.70
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3 11 8 15.40 0.70
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3 -11 -8 16.20 0.70
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4 -11 8 28.10 1.00
4 11 -8 26.70 1.00
4 11 -8 26.90 1.00
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4 -11 -8 28.80 1.10
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4 11 8 26.80 1.00
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0 0 9 0.40 5.10
0 0 -9 -4.00 3.20
0 0 9 0.10 0.10
0 0 9 0.40 0.20
0 0 -9 0.00 0.10
-1 0 9 1519.05 82.29
-1 0 -9 1371.76 46.80
1 0 -9 1405.06 71.09
-1 0 -9 1321.47 73.59
1 0 -9 1410.06 46.90
1 0 9 1568.94 79.99
2 0 -9 557.14 18.40
-2 0 -9 564.34 43.40
2 0 -9 559.74 18.50
2 0 9 553.84 42.10
-2 0 9 614.64 49.00
2 0 -9 561.54 39.00
2 0 9 536.45 18.60
-2 0 9 526.55 18.50
2 0 9 554.04 18.70
3 0 -9 639.74 20.80
3 0 9 623.74 21.00
3 0 9 630.14 21.20
3 0 -9 623.24 20.80
3 0 9 608.64 43.10
3 0 9 635.84 20.50
3 0 -9 640.44 20.90
3 0 -9 525.05 54.49
-3 0 9 682.23 54.69
-3 0 -9 545.35 61.49
-3 0 -9 634.74 21.40
-4 0 -9 30.50 2.10
4 0 -9 35.40 2.00
4 0 9 35.00 1.90
-4 0 -9 13.60 12.10
-4 0 9 36.10 1.70
4 0 -9 36.40 1.60
4 0 9 36.70 12.50
4 0 9 35.60 1.40
4 0 9 37.80 1.80
-5 0 9 35.20 1.80
5 0 9 32.90 1.90
5 0 -9 36.00 1.70
5 0 9 33.70 1.90
5 0 -9 33.70 1.70
-5 0 -9 36.20 2.10
-6 0 9 4.30 0.60
6 0 9 5.60 0.80
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6 0 9 2.30 1.60
6 0 -9 3.60 0.60
6 0 -9 5.00 0.60
6 0 -9 4.30 0.40
6 0 9 5.30 0.80
6 0 9 4.10 0.80
6 0 -9 4.10 0.60
7 0 -9 287.47 10.00
7 0 9 274.77 10.50
7 0 9 292.47 9.80
7 0 -9 287.87 9.50
7 0 -9 286.37 9.70
7 0 9 286.47 10.40
7 0 9 231.18 13.50
7 0 -9 284.47 9.70
7 0 -9 279.27 9.60
-7 0 9 275.77 9.60
7 0 9 293.87 9.60
8 0 -9 70.59 2.60
8 0 -9 69.29 3.10
8 0 9 69.19 2.80
8 0 9 68.59 3.40
8 0 -9 70.39 2.60
8 0 -9 70.99 2.80
8 0 9 70.29 3.30
-8 0 9 67.79 2.60
8 0 -9 70.89 2.70
8 0 9 60.99 5.70
9 0 -9 1.40 0.30
9 0 -9 1.40 0.30
9 0 -9 1.30 0.40
9 0 9 0.90 0.30
9 0 -9 1.50 0.30
9 0 9 1.90 1.40
9 0 9 1.30 0.60
9 0 -9 1.30 1.10
9 0 9 1.40 0.50
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10 0 9 1.50 0.40
10 0 9 1.00 0.70
10 0 -9 1.50 0.90
10 0 9 1.40 1.20
10 0 -9 1.20 0.20
-10 0 -9 1.00 0.20
0 1 9 932.71 31.40
0 1 -9 918.51 31.10
0 -1 -9 999.00 53.89
0 1 -9 889.91 57.69
0 -1 9 908.71 31.10
0 -1 9 891.31 31.30
0 -1 9 1059.09 63.69
0 1 9 1027.70 63.09
-1 1 9 774.42 54.09
1 -1 9 701.43 23.50
1 1 -9 701.93 23.40
1 -1 9 781.62 52.39
-1 -1 -9 694.23 43.40
1 1 -9 696.53 47.50
1 -1 9 675.43 23.40
1 1 -9 712.63 23.40
-1 1 -9 709.93 23.30
1 -1 -9 740.03 44.70
-1 -1 9 628.64 23.50
-1 1 -9 694.73 49.90
1 1 9 811.42 51.49
1 1 9 674.43 23.60
1 1 9 685.63 23.60
-1 -1 9 730.23 53.69
1 -1 -9 716.33 23.30
2 -1 9 199.18 25.50
-2 1 9 211.68 7.70
-2 -1 -9 215.08 22.10
2 -1 9 216.68 7.70
2 1 -9 220.38 7.50
2 1 -9 228.28 23.70
2 -1 9 214.88 7.60
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2 1 -9 217.58 7.50
2 -1 -9 218.48 7.40
2 1 9 233.68 25.00
-2 1 -9 200.28 27.20
2 -1 -9 223.18 7.50
-2 1 -9 221.78 7.90
2 -1 -9 232.68 23.30
2 1 9 215.58 7.70
-2 -1 9 251.77 32.30
2 1 9 214.28 7.70
3 -1 9 35.10 1.80
3 1 -9 39.00 1.60
3 1 -9 39.60 1.80
3 -1 9 35.50 1.70
3 1 -9 38.50 1.60
-3 -1 -9 23.50 7.90
-3 1 9 36.00 1.70
3 -1 9 38.10 1.40
-3 1 9 34.20 12.60
-3 1 9 38.20 1.70
3 -1 9 43.10 14.00
3 1 9 29.60 9.20
-3 1 -9 36.20 1.90
3 1 9 36.00 1.80
3 -1 -9 34.70 9.40
3 -1 -9 37.00 1.50
3 -1 -9 36.20 1.60
-3 1 -9 27.00 15.00
-3 -1 9 34.70 1.50
3 1 9 36.40 1.70
4 -1 9 55.59 2.10
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4 1 -9 52.59 2.20
-4 -1 -9 56.89 2.70
4 -1 9 57.09 2.50
4 1 -9 50.89 2.00
4 -1 9 51.69 2.40
-4 -1 -9 60.49 12.60
4 1 -9 53.09 2.30
4 1 9 35.00 12.10
-4 1 -9 55.49 2.60
4 1 9 53.49 2.50
4 1 9 52.09 2.40
4 -1 -9 54.09 2.20
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5 1 -9 117.79 4.50
5 -1 9 118.09 4.80
5 -1 9 115.69 4.20
-5 -1 -9 114.69 5.00
5 1 -9 118.79 4.50
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5 1 9 114.89 4.70
5 -1 -9 115.89 4.40
5 1 9 112.39 4.80
5 -1 -9 122.79 4.40
5 -1 -9 115.79 4.40
-5 1 -9 120.89 5.00
6 1 -9 14.30 0.80
6 -1 9 14.10 1.20
6 -1 9 12.90 0.80
6 1 -9 12.50 1.00
6 -1 9 12.40 1.40
6 1 -9 12.70 0.70
6 -1 9 12.60 0.90
6 -1 9 11.60 2.50
6 -1 9 14.20 1.20
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6 1 -9 13.30 0.70
6 -1 -9 13.20 0.90
6 -1 -9 14.10 0.90
6 -1 -9 12.00 1.00
6 1 9 14.10 1.20
6 1 9 12.80 0.80
6 -1 -9 14.10 0.70
6 1 9 12.40 1.30
6 -1 -9 13.40 1.00
6 1 9 13.10 1.20
6 1 9 14.00 1.40
6 -1 -9 11.60 0.70
7 1 -9 16.70 0.80
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7 -1 9 16.80 0.90
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7 1 -9 16.10 1.20
7 1 -9 14.00 1.30
7 -1 9 15.10 1.30
7 -1 9 14.60 2.80
7 1 -9 19.50 2.70
7 1 -9 15.40 1.00
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7 -1 9 13.50 1.80
7 -1 9 15.50 1.00
7 1 -9 15.50 1.30
7 -1 9 15.40 0.90
7 -1 9 12.90 1.40
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7 1 9 16.10 0.90
7 1 9 15.30 1.40
7 -1 -9 17.20 1.00
7 -1 -9 12.90 1.20
7 1 9 13.30 1.40
7 -1 -9 15.10 1.10
7 -1 -9 15.20 1.10
7 -1 -9 16.90 1.30
7 -1 -9 15.00 0.90
7 -1 -9 15.00 0.90
-7 1 -9 16.80 1.20
7 -1 -9 16.20 0.80
-7 -1 9 15.40 0.90
7 1 9 15.50 0.90
7 1 9 11.90 2.80
7 1 9 14.40 1.30
8 -1 9 2.70 0.40
8 1 -9 2.20 1.30
8 -1 9 3.20 0.70
8 1 -9 2.40 0.60
8 1 -9 2.60 0.40
8 1 -9 3.60 0.50
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8 -1 9 3.00 0.80
8 1 -9 3.40 0.40
8 1 -9 3.30 0.40
8 -1 9 1.70 1.40
8 1 9 3.40 0.40
8 -1 -9 2.80 0.40
8 1 9 2.10 1.50
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8 1 9 2.10 0.60
8 -1 -9 3.00 0.40
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8 -1 -9 3.10 0.60
8 -1 -9 3.20 0.50
8 -1 -9 2.90 0.40
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9 -1 9 13.50 1.10
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9 -1 9 12.70 0.80
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9 -1 9 11.90 1.20
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9 -1 9 12.30 2.50
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9 -1 -9 13.30 0.70
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9 -1 -9 11.90 0.80
9 -1 -9 13.90 1.00
9 -1 -9 14.60 2.40
9 -1 -9 11.90 0.70
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10 -1 9 6.90 0.80
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10 1 -9 6.70 0.50
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10 -1 9 8.80 1.70
10 -1 9 8.30 0.70
10 -1 -9 8.00 0.70
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10 -1 -9 6.70 1.60
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10 -1 -9 8.40 0.50
10 1 9 6.40 1.70
10 -1 -9 7.80 0.50
0 -2 -9 1248.38 62.69
0 -2 9 1331.07 75.99
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0 2 9 1167.38 39.50
0 -2 9 1135.89 39.30
0 2 -9 1173.78 39.30
0 -2 -9 1220.98 39.00
1 -2 9 152.18 5.50
1 2 -9 150.18 5.60
1 2 -9 139.49 20.90
1 -2 9 153.08 23.60
1 2 -9 157.28 5.50
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-1 -2 -9 132.19 16.20
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1 -2 -9 167.18 19.70
1 2 9 144.39 21.80
1 2 9 164.38 5.70
1 -2 -9 158.68 5.30
1 2 9 159.98 5.70
-1 -2 9 212.88 26.40
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2 -2 9 201.28 26.20
2 2 -9 184.08 6.60
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2 2 -9 183.28 6.30
2 2 -9 181.58 6.40
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2 2 -9 132.59 22.80
2 -2 9 174.48 6.40
2 2 -9 170.88 6.20
2 -2 -9 176.28 6.10
2 2 9 183.18 6.60
-2 2 -9 140.59 26.20
2 2 9 180.18 6.50
-2 2 -9 186.08 6.60
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2 2 9 210.28 23.20
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3 -2 9 190.28 6.40
3 2 -9 190.68 6.80
3 -2 9 188.18 6.90
3 2 -9 193.78 6.70
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3 -2 9 206.88 27.80
3 2 -9 185.68 6.80
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3 -2 -9 179.98 7.10
3 -2 -9 184.18 6.50
3 2 9 189.88 7.60
-3 2 -9 213.98 34.10
-3 2 -9 194.18 7.10
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4 2 -9 275.07 9.60
4 2 -9 265.47 9.40
4 -2 9 278.27 9.30
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4 2 -9 283.17 9.60
4 -2 9 251.87 10.60
4 2 9 271.77 9.90
4 -2 -9 280.27 9.40
4 -2 -9 265.77 9.40
4 2 9 275.27 9.70
4 2 9 252.37 21.10
-4 2 -9 283.97 10.00
4 -2 -9 272.17 9.50
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5 -2 9 1.20 0.30
5 -2 9 1.20 0.40
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-5 -2 -9 2.10 0.60
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5 -2 -9 1.20 0.30
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5 -2 -9 2.10 0.40
6 2 -9 222.78 9.10
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6 2 -9 246.88 8.00
6 -2 9 213.68 9.50
6 -2 9 222.18 8.60
6 -2 9 190.38 11.60
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6 2 -9 229.58 7.70
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6 -2 -9 230.38 8.20
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6 -2 -9 222.18 7.90
6 -2 -9 235.78 8.30
6 -2 -9 228.08 7.80
6 -2 -9 225.98 8.10
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7 -2 9 18.00 1.10
7 -2 9 16.50 1.50
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7 -2 -9 17.40 0.90
7 -2 -9 17.80 0.90
7 -2 -9 17.90 1.10
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7 -2 -9 16.40 1.00
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7 -2 -9 17.80 1.20
7 -2 -9 17.60 1.20
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7 -2 -9 17.50 1.20
7 -2 -9 17.90 1.20
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8 -2 9 43.20 1.90
8 -2 9 43.60 1.80
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8 -2 9 34.30 4.20
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8 -2 9 38.80 2.20
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8 -2 9 41.30 2.50
8 2 -9 41.10 3.90
8 2 -9 43.00 1.70
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8 -2 -9 44.00 2.20
8 -2 -9 42.80 1.80
-8 -2 9 39.50 2.10
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8 2 9 43.10 1.80
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8 -2 -9 45.00 1.90
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8 -2 -9 43.30 1.80
8 -2 -9 45.10 2.10
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9 -2 9 22.00 1.30
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9 -2 9 21.90 1.10
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9 -2 9 17.20 2.70
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9 -2 9 22.30 1.60
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9 2 -9 22.20 1.00
9 -2 -9 21.40 1.00
9 -2 -9 20.60 1.00
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9 -2 -9 25.90 2.90
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9 -2 -9 19.80 1.00
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9 2 9 21.00 1.10
9 -2 -9 21.80 1.30
10 -2 9 5.10 0.50
10 -2 9 5.00 1.30
10 2 -9 5.20 1.40
10 2 -9 5.70 0.60
10 2 -9 6.00 0.40
10 2 -9 5.70 0.40
10 2 -9 5.70 0.40
10 -2 9 6.90 0.70
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10 -2 -9 5.70 0.60
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10 2 9 6.30 0.60
10 2 9 5.30 0.70
10 -2 -9 5.10 1.40
10 -2 -9 5.70 0.40
-10 2 -9 5.60 0.40
0 3 -9 146.89 25.00
0 3 9 168.48 6.10
0 -3 -9 165.68 5.70
0 3 9 200.58 26.90
0 3 -9 163.58 5.90
0 -3 9 164.58 5.80
0 3 9 175.78 5.90
0 3 -9 164.98 6.00
0 -3 9 213.08 28.60
0 3 9 173.68 6.20
-1 3 9 157.78 5.70
1 -3 9 160.68 25.50
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1 3 -9 158.88 5.60
1 3 -9 152.98 5.20
-1 3 9 155.98 5.80
-1 3 9 126.69 23.70
1 -3 9 153.88 5.50
1 3 -9 152.38 5.20
1 3 -9 133.79 33.50
-1 -3 -9 176.08 20.20
1 3 -9 156.28 5.60
1 3 -9 163.88 6.00
-1 -3 9 147.79 5.40
-1 3 -9 158.98 26.90
-1 -3 9 175.78 25.50
1 3 9 156.88 5.70
-1 3 -9 153.88 5.60
-1 3 -9 161.68 5.40
1 -3 -9 154.48 5.30
1 3 9 150.08 23.30
1 3 9 158.98 5.50
1 3 9 153.68 5.70
2 3 -9 465.35 15.70
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2 -3 9 462.05 15.70
-2 3 9 457.15 15.90
2 3 -9 448.86 15.70
-2 3 9 486.15 46.40
2 3 -9 461.25 15.90
2 -3 9 478.75 43.40
2 3 9 480.15 15.60
2 3 9 444.86 38.40
2 3 9 472.55 15.90
2 3 9 448.96 15.80
2 -3 -9 465.65 15.40
-2 3 -9 435.06 53.79
-2 3 -9 461.65 15.80
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3 -3 9 193.68 7.10
3 3 -9 212.98 7.30
-3 3 9 168.38 35.30
3 3 -9 202.28 7.20
-3 3 9 187.68 7.50
3 3 -9 204.68 7.20
-3 3 9 201.68 7.50
3 -3 9 204.58 36.20
-3 3 -9 172.28 35.40
3 3 9 209.08 25.80
-3 3 -9 178.78 6.90
3 3 9 205.88 7.30
3 3 9 210.48 7.50
-3 3 -9 198.88 7.40
3 3 9 209.38 7.10
3 -3 -9 203.28 6.90
4 3 -9 609.94 20.50
4 -3 9 585.14 20.00
4 3 -9 589.04 20.00
-4 3 9 624.64 20.70
4 3 -9 599.24 20.40
4 3 -9 579.24 20.20
4 -3 -9 610.44 20.20
4 3 9 613.64 20.50
4 -3 -9 588.04 20.10
-4 3 -9 591.24 20.70
4 -3 -9 598.14 20.20
4 3 9 618.14 20.70
5 3 -9 4.90 1.00
5 -3 9 3.10 0.60
5 -3 9 3.90 0.50
-5 3 9 2.80 0.60
-5 3 -9 3.80 0.70
5 -3 -9 4.20 0.50
5 -3 -9 3.90 0.50
5 3 9 6.20 1.10
6 3 -9 103.59 4.30
6 3 -9 98.39 3.50
6 -3 9 97.29 4.20
6 3 -9 99.59 3.60
6 -3 9 102.39 3.90
6 3 -9 105.19 4.10
6 3 -9 104.29 3.70
6 3 -9 103.69 3.50
6 -3 9 104.79 4.40
6 -3 9 98.89 4.60
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6 3 -9 102.39 4.30
6 -3 9 102.29 4.00
6 3 9 101.79 4.50
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6 3 9 99.99 4.30
6 3 9 98.79 3.70
6 -3 -9 105.39 4.10
6 -3 -9 96.39 3.70
6 -3 -9 96.59 3.90
6 -3 -9 103.59 4.00
6 -3 -9 99.39 3.90
6 3 9 99.59 4.30
6 3 9 85.59 6.70
6 3 9 102.59 4.40
6 -3 -9 101.49 4.00
7 3 -9 0.60 0.20
7 -3 9 0.60 2.00
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7 -3 9 1.00 0.70
7 -3 9 0.60 0.30
7 3 -9 0.80 0.40
7 3 -9 1.60 0.30
7 3 -9 1.30 0.30
7 3 -9 1.40 0.30
7 -3 9 1.30 0.40
7 -3 9 0.70 0.70
7 3 9 0.80 1.20
7 3 9 1.60 0.60
7 3 9 0.80 0.30
7 -3 -9 0.60 0.50
7 -3 -9 0.80 0.50
7 -3 -9 0.70 0.40
7 -3 -9 1.40 0.40
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7 -3 -9 0.60 0.30
7 3 9 1.70 0.50
8 -3 9 1.80 0.40
8 -3 9 2.20 0.70
8 3 -9 1.90 0.50
8 -3 9 1.80 0.40
8 3 -9 0.90 2.10
8 -3 9 2.00 1.70
8 3 -9 2.70 0.40
8 3 -9 1.80 0.40
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8 -3 9 1.40 0.70
8 3 -9 1.60 0.30
8 -3 -9 1.80 0.50
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8 -3 -9 1.70 0.40
8 -3 -9 2.00 0.30
8 -3 -9 1.50 0.40
8 -3 -9 1.90 0.50
8 3 9 2.60 1.60
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9 3 -9 26.20 1.10
9 3 -9 26.30 1.20
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9 -3 9 21.10 2.60
9 3 -9 25.00 1.10
9 3 -9 26.10 1.50
9 -3 9 29.00 1.80
9 -3 -9 23.50 1.30
9 -3 -9 25.70 1.20
9 -3 -9 24.70 1.40
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9 -3 -9 30.80 3.10
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9 -3 -9 29.10 2.00
9 3 9 24.70 3.10
9 3 9 26.20 1.50
9 3 9 25.30 1.50
10 -3 9 -0.40 0.50
10 -3 9 0.10 0.30
10 3 -9 0.30 0.10
10 3 -9 0.30 0.10
10 3 -9 0.40 0.30
10 3 -9 0.30 0.10
-10 3 9 0.10 0.20
10 -3 -9 0.00 0.60
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10 3 9 1.20 0.80
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10 -3 -9 0.50 0.20
10 3 9 0.10 0.30
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0 4 -9 14.20 1.10
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0 4 -9 -1.90 12.30
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1 -4 9 376.36 42.00
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1 4 -9 386.46 13.70
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1 4 -9 413.26 14.10
-1 4 9 399.76 14.00
-1 4 -9 392.66 13.60
-1 4 -9 406.66 14.20
1 4 9 400.56 13.90
1 4 9 441.56 13.90
1 -4 -9 388.96 13.40
1 4 9 394.96 13.90
1 4 9 423.46 43.00
-2 4 9 147.09 35.90
2 4 -9 162.38 6.20
-2 4 9 162.98 6.30
2 4 -9 160.68 6.00
2 4 -9 161.18 6.00
2 -4 9 155.48 42.40
-2 4 -9 156.78 5.70
2 -4 -9 169.38 5.70
2 -4 -9 162.88 5.80
2 4 9 193.98 27.70
-2 4 -9 142.59 36.10
2 4 9 166.08 6.20
-2 4 -9 165.98 6.00
-2 4 -9 162.98 6.40
2 4 9 166.18 5.90
2 4 9 172.28 6.20
-2 -4 9 158.68 5.70
3 4 -9 22.30 1.30
3 4 -9 21.40 1.30
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3 4 -9 22.30 1.30
3 -4 9 20.70 1.30
3 4 -9 19.70 1.20
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3 4 9 24.40 1.40
3 -4 -9 21.90 1.10
3 4 9 22.00 1.40
-3 4 -9 22.00 1.60
3 4 9 21.50 1.20
3 -4 -9 21.50 1.10
4 4 -9 37.20 1.90
-4 4 9 42.40 2.30
4 4 -9 40.30 2.00
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4 -4 9 39.40 1.70
4 4 -9 40.20 2.10
4 -4 9 35.30 2.40
4 4 -9 37.90 1.60
4 -4 -9 38.20 1.70
4 -4 -9 40.00 1.80
-4 4 -9 38.50 1.70
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4 4 9 39.80 1.90
-4 4 -9 41.30 2.20
4 4 9 39.90 2.10
4 4 9 43.30 2.30
-5 -4 -9 28.00 2.00
5 4 -9 31.40 1.60
5 -4 9 26.60 1.90
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5 4 -9 28.60 1.70
5 -4 9 28.30 1.40
5 4 -9 30.40 1.80
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5 4 9 27.30 1.70
5 -4 -9 28.80 1.50
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5 -4 -9 26.00 1.30
5 -4 -9 28.20 1.40
5 4 9 27.80 1.70
5 4 9 27.50 1.80
5 -4 -9 27.90 1.50
5 -4 -9 27.40 1.30
-5 4 -9 26.70 2.00
6 4 -9 5.30 0.40
6 4 -9 4.50 0.40
6 4 -9 3.60 0.70
6 -4 9 5.00 0.70
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6 4 -9 5.50 0.40
6 4 -9 4.40 1.00
6 4 -9 6.90 0.70
6 4 -9 5.30 0.50
6 -4 9 4.30 1.00
6 -4 -9 5.50 0.70
6 -4 -9 3.80 0.50
6 -4 -9 4.40 0.60
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6 -4 -9 5.80 0.70
6 -4 -9 4.70 0.50
6 4 9 4.70 1.20
6 4 9 6.70 0.90
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6 4 9 4.40 0.60
6 4 9 5.10 1.80
6 4 9 4.70 0.80
7 -4 9 10.90 0.90
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7 4 -9 10.60 0.60
7 -4 9 10.20 1.30
7 4 -9 10.60 0.60
7 4 -9 10.50 0.60
7 4 -9 11.10 1.00
7 -4 9 8.60 0.90
7 4 -9 10.50 0.80
7 -4 9 7.80 2.10
7 -4 -9 8.60 0.80
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7 -4 -9 10.20 0.70
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7 4 9 9.70 1.00
7 4 9 8.40 1.00
7 4 9 11.30 0.70
7 -4 -9 10.60 0.90
7 -4 -9 10.20 0.90
8 4 -9 35.40 1.80
8 -4 9 28.50 3.30
8 4 -9 37.10 1.90
8 -4 9 33.10 2.80
8 4 -9 33.30 1.30
8 -4 9 32.40 1.80
8 4 9 29.90 5.10
8 -4 -9 33.20 1.70
8 4 9 31.80 1.40
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8 -4 -9 30.50 1.70
8 4 9 35.10 1.90
8 -4 -9 34.00 1.80
8 4 9 34.20 2.20
9 4 -9 15.40 0.80
9 -4 9 13.30 2.00
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9 -4 9 15.90 1.20
9 4 -9 15.50 0.70
9 4 -9 16.00 0.90
9 -4 9 15.40 0.70
9 -4 -9 17.00 0.90
9 -4 -9 15.70 1.00
9 4 9 16.70 2.40
9 4 9 15.70 1.10
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9 -4 -9 18.40 2.30
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9 -4 -9 15.90 1.20
10 4 -9 4.50 0.40
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10 -4 9 3.80 0.70
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10 4 9 4.70 1.20
10 4 9 4.80 0.50
10 -4 -9 4.10 1.10
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0 5 -9 192.18 7.00
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0 5 9 196.58 7.10
0 5 -9 205.88 7.50
0 5 -9 182.48 6.70
1 5 -9 97.79 4.10
1 5 -9 94.59 3.80
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1 5 -9 91.89 3.40
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-1 5 -9 97.99 4.20
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1 5 9 94.69 3.70
1 5 9 96.19 3.90
1 5 9 95.49 4.00
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2 5 -9 122.49 4.90
2 5 -9 121.09 4.80
2 -5 -9 120.49 4.40
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2 -5 -9 122.59 4.50
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2 5 9 124.89 4.90
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2 5 9 123.29 4.70
3 5 -9 160.68 5.90
3 5 -9 153.68 5.30
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3 5 -9 145.49 5.80
3 5 -9 152.18 5.80
3 5 9 152.48 5.90
3 5 9 153.08 6.00
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3 -5 -9 149.29 5.40
3 5 9 148.69 5.60
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3 -5 -9 152.08 5.60
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4 5 -9 28.20 1.20
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4 -5 9 27.50 1.20
4 -5 9 29.30 1.60
4 5 -9 28.80 1.70
4 5 -9 30.20 1.30
4 -5 9 28.30 1.70
-4 5 9 26.30 1.30
4 5 -9 26.80 1.20
4 5 -9 29.20 1.20
-4 5 9 28.30 1.30
4 5 -9 30.70 1.80
4 5 9 28.80 1.80
4 5 9 29.20 1.60
4 -5 -9 28.60 1.30
-4 5 -9 25.70 1.60
-4 5 -9 29.30 1.80
4 5 9 30.10 1.80
4 5 9 27.40 1.30
4 -5 -9 27.60 1.50
4 -5 -9 32.40 1.90
4 5 9 27.60 1.40
4 5 9 27.30 1.70
4 5 9 26.20 3.00
5 5 -9 37.80 1.50
5 5 -9 40.70 2.20
-5 5 9 36.00 2.30
5 5 -9 37.80 1.50
5 -5 9 40.40 2.00
5 5 -9 39.50 1.50
5 -5 9 37.70 1.50
5 -5 9 38.70 1.70
-5 5 9 37.20 1.70
5 5 -9 38.40 2.20
5 5 -9 37.90 1.90
5 5 -9 39.00 1.60
5 -5 -9 36.90 1.90
5 -5 -9 37.80 1.90
5 5 9 34.30 1.90
5 5 9 35.30 2.20
-5 5 -9 36.00 2.20
5 5 9 36.30 2.00
-5 5 -9 37.80 1.90
-5 5 -9 38.50 1.70
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5 -5 -9 38.80 1.80
5 5 9 35.40 1.60
5 5 9 31.80 3.70
5 5 9 36.80 1.50
5 -5 -9 36.30 1.60
5 -5 -9 37.10 1.90
5 5 9 39.80 2.20
6 -5 9 169.98 6.50
6 5 -9 170.08 5.90
6 5 -9 171.68 6.10
6 5 -9 174.08 5.90
6 -5 9 159.88 7.10
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6 5 -9 172.68 5.90
6 5 -9 179.98 7.30
-6 5 9 167.48 6.20
6 5 9 175.68 6.10
-6 5 -9 175.58 6.50
6 -5 -9 181.88 6.40
6 5 9 175.98 6.60
6 5 9 163.68 9.30
6 -5 -9 172.78 6.00
6 -5 -9 172.28 6.40
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6 5 9 181.18 6.60
7 -5 9 68.29 3.60
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7 5 -9 71.99 2.60
7 5 -9 72.89 3.10
7 5 -9 74.79 2.80
7 5 -9 73.09 2.60
7 -5 9 71.59 3.10
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7 -5 -9 73.19 3.10
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7 5 9 72.39 3.10
7 -5 -9 70.89 3.00
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7 5 9 69.29 5.30
8 -5 9 17.60 1.50
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8 -5 9 16.90 1.10
8 5 -9 19.40 1.20
8 5 -9 18.60 0.80
8 5 -9 17.40 1.00
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8 5 9 19.70 2.60
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8 -5 -9 17.70 1.10
8 5 9 19.20 1.20
8 5 9 18.10 0.90
8 -5 -9 18.50 1.20
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9 -5 9 7.00 0.50
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9 -5 9 6.90 0.80
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9 5 -9 6.90 0.40
9 5 -9 7.00 0.40
9 5 9 7.20 1.40
9 -5 -9 6.00 1.40
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9 5 9 7.00 0.60
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9 -5 -9 6.70 0.50
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0 -6 -9 24.40 1.30
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1 6 -9 86.09 3.20
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1 6 -9 90.09 3.90
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1 -6 -9 84.99 3.40
1 6 9 85.09 3.80
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2 6 -9 148.29 5.10
2 6 -9 138.59 5.80
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2 -6 -9 148.09 5.20
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2 -6 -9 144.59 5.40
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2 -6 -9 149.59 5.20
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3 6 -9 166.68 6.60
3 6 -9 164.68 5.90
3 6 -9 167.48 6.10
3 6 -9 170.38 6.80
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3 6 -9 174.38 6.00
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3 -6 9 160.18 6.50
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3 6 9 178.68 6.80
3 -6 -9 170.98 6.40
3 6 9 170.98 6.00
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3 -6 -9 191.88 6.30
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3 -6 -9 176.68 6.20
3 -6 -9 166.98 7.40
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4 6 -9 100.29 3.50
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4 6 -9 100.89 3.60
4 -6 9 101.59 3.60
4 -6 9 104.09 4.20
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4 6 -9 102.79 3.60
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4 -6 9 110.39 3.90
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4 -6 -9 102.29 3.90
4 -6 -9 104.39 4.10
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4 -6 -9 98.29 4.10
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4 -6 -9 99.99 3.80
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5 -6 -9 64.99 2.90
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6 -6 9 159.48 6.40
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6 -6 9 156.08 6.00
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6 -6 -9 157.48 5.90
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6 -6 -9 155.68 6.00
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6 -6 -9 153.28 5.50
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7 -6 9 16.40 1.50
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7 -6 -9 16.10 1.10
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7 -6 -9 16.00 1.10
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8 -6 -9 4.90 0.70
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8 -6 -9 8.50 1.60
9 -6 9 25.00 1.10
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9 -6 -9 23.30 1.00
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0 -7 -9 5.00 0.50
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1 7 -9 124.09 5.10
1 7 -9 125.09 4.50
-1 -7 -9 129.49 4.70
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1 7 -9 129.29 4.60
1 -7 -9 135.49 4.90
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1 -7 -9 131.99 4.70
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2 -7 9 85.39 3.70
2 7 -9 87.69 3.10
2 7 -9 86.09 3.10
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2 7 -9 88.09 3.90
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2 -7 -9 86.29 3.40
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2 -7 -9 84.99 3.50
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2 7 9 86.49 3.90
-2 7 -9 90.89 3.30
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3 -3 -24 11.80 0.70
4 -3 24 4.40 0.40
-4 -3 -24 4.30 0.40
4 -3 24 4.60 0.40
-4 3 24 4.40 0.40
4 3 24 4.90 0.90
-4 -3 24 4.40 0.40
4 3 24 4.70 0.40
-4 3 -24 4.70 0.30
4 -3 -24 4.40 0.40
-4 3 -24 4.40 0.50
5 -3 24 6.30 0.50
5 -3 24 6.70 0.40
-5 3 24 6.80 0.50
5 3 -24 7.30 0.40
-5 -3 24 5.90 0.40
-5 3 -24 7.20 0.40
5 3 24 7.40 0.40
5 -3 -24 7.40 0.50
5 -3 -24 5.70 0.50
5 3 24 7.00 0.80
0 -4 -24 22.70 1.00
0 -4 -24 21.00 1.10
0 4 -24 23.60 1.10
0 4 -24 22.30 1.00
0 4 24 22.70 1.00
0 -4 24 21.00 1.00
0 -4 24 21.00 1.10
-1 4 24 9.70 0.70
-1 -4 -24 9.50 0.70
1 -4 24 7.50 0.70
1 -4 24 8.80 0.70
1 4 -24 8.60 0.60
1 4 24 9.60 0.50
-1 4 -24 8.90 0.50
-1 4 -24 8.60 0.50
-1 4 -24 8.80 0.60
-1 -4 24 9.90 0.60
1 4 24 9.10 0.50
-1 -4 24 8.20 0.60
-2 4 24 1.20 0.20
2 -4 24 0.90 0.30
2 4 -24 0.90 0.20
-2 -4 -24 1.10 0.20
-2 -4 24 1.10 0.20
-2 4 -24 0.90 0.20
2 -4 -24 1.00 0.20
2 4 24 1.10 0.20
2 -4 -24 1.00 0.30
-2 4 -24 0.70 0.20
2 4 24 1.20 0.30
-2 4 -24 1.60 0.20
2 4 24 1.30 0.20
-2 -4 24 1.00 0.20
2 -4 -24 1.10 0.30
3 -4 24 8.80 0.60
-3 -4 -24 9.00 0.50
-3 -4 -24 9.60 0.60
-3 4 24 9.30 0.50
3 4 -24 9.00 0.50
3 4 24 9.90 0.70
3 -4 -24 8.40 0.50
-3 4 -24 8.20 0.50
-3 -4 24 8.70 0.60
-3 4 -24 8.10 0.40
3 -4 -24 8.00 0.60
-3 4 -24 8.20 0.50
-4 -4 -24 15.60 0.90
-4 -4 -24 18.50 1.00
4 -4 24 19.00 0.90
4 -4 24 17.60 0.90
-4 4 24 21.10 0.90
4 -4 -24 17.90 0.90
-4 -4 24 19.20 0.80
4 4 24 20.30 0.80
-4 4 -24 19.90 0.80
0 5 24 0.10 0.10
0 5 -24 0.20 0.10
0 -5 -24 0.20 0.10
0 -5 24 0.40 0.20
0 -5 -24 0.10 0.20
0 -5 24 0.30 0.30
0 5 -24 0.10 0.10
0 5 24 0.10 0.10
1 5 -24 17.80 0.80
-1 5 24 18.40 0.80
1 -5 24 16.40 0.70
1 5 -24 18.40 0.80
1 -5 24 17.90 0.90
-1 -5 -24 19.00 1.00
-1 -5 -24 18.80 0.80
-1 5 -24 18.40 0.80
1 5 24 18.60 0.80
-1 -5 24 17.50 0.80
-1 -5 24 16.60 0.90
1 -5 -24 19.00 0.90
1 -5 -24 17.80 0.80
-1 5 -24 18.10 0.80
2 -5 24 2.70 0.40
2 5 -24 3.10 0.30
-2 -5 -24 3.10 0.30
-2 5 24 3.30 0.30
2 5 24 2.90 0.30
2 -5 -24 3.60 0.50
-2 5 -24 4.40 0.40
2 -5 -24 3.70 0.30
-2 -5 24 3.70 0.40
-2 5 -24 2.80 0.20
-2 5 -24 3.50 0.30
3 -5 24 22.30 1.30
-3 -5 -24 19.20 0.80
-3 5 24 20.40 0.90
-3 5 -24 22.00 0.90
-3 -5 24 18.80 0.90
3 -5 -24 18.20 0.80
-3 5 -24 21.10 0.80
-3 5 -24 17.10 0.80
0 6 -24 10.50 0.50
0 -6 -24 11.40 0.80
0 -6 -24 9.20 0.60
0 -6 24 8.50 0.50
0 6 24 8.30 0.50
-1 -6 -24 9.40 0.50
-1 -6 -24 7.90 0.60
1 6 -24 10.90 0.50
1 -6 24 8.20 0.60
-1 6 24 7.20 0.60
-1 6 24 9.50 0.40
-1 -6 24 9.20 0.50
-1 6 -24 9.30 0.40
1 -6 -24 11.20 0.70
-1 6 -24 7.50 0.50
1 6 24 8.50 0.40
1 -6 -24 8.70 0.60
0 0 25 0.00 0.20
0 0 -25 0.10 0.20
0 0 -25 0.00 0.20
-1 0 25 4.00 0.40
1 0 25 4.40 0.50
-1 0 -25 4.40 0.40
1 0 -25 3.70 0.40
1 0 25 4.10 0.40
-1 0 -25 4.40 0.60
1 0 -25 3.90 0.50
-2 0 25 4.00 0.50
-2 0 25 3.50 0.30
-2 0 -25 3.20 0.40
2 0 -25 2.70 0.40
2 0 -25 3.60 0.30
2 0 25 3.30 0.40
2 0 25 3.60 0.40
-2 0 -25 3.60 0.40
-3 0 -25 29.30 1.20
-3 0 25 27.10 1.10
3 0 -25 28.30 1.30
3 0 25 27.00 1.10
-3 0 25 28.10 1.10
3 0 25 27.30 1.20
4 0 25 22.80 1.00
4 0 -25 22.90 1.10
4 0 25 22.70 0.90
-4 0 25 23.70 1.00
-4 0 -25 24.60 1.00
-4 0 25 22.90 0.90
0 -1 -25 0.70 0.30
0 -1 -25 1.30 0.20
0 1 25 0.80 0.20
0 -1 25 1.00 0.30
0 1 -25 0.90 0.20
0 1 -25 0.50 0.20
1 -1 25 5.90 0.50
-1 -1 -25 5.10 0.40
-1 -1 -25 5.30 0.50
-1 1 25 6.00 0.50
1 1 -25 5.10 0.60
1 1 -25 5.80 0.50
1 -1 25 5.70 0.60
-1 1 -25 5.90 0.40
1 1 25 5.90 0.50
-1 -1 25 5.00 0.40
-1 1 -25 6.00 0.40
1 -1 -25 5.50 0.40
-1 -1 25 5.80 0.50
-1 1 -25 5.60 0.50
1 1 25 5.60 0.60
-2 -1 -25 21.00 0.90
-2 1 25 18.70 1.10
-2 -1 -25 20.20 1.00
2 -1 25 19.60 0.90
2 -1 25 19.60 1.00
2 1 -25 19.20 1.00
2 1 25 19.30 0.90
2 -1 -25 18.70 0.90
2 -1 -25 20.50 1.00
2 1 25 20.60 1.00
-2 -1 25 19.70 0.90
-2 1 -25 19.20 0.90
-2 -1 25 19.60 0.90
-3 -1 -25 9.80 0.50
-3 1 25 9.40 0.70
-3 1 25 9.90 0.50
3 -1 25 9.00 0.60
3 -1 25 9.50 0.60
-3 -1 25 9.30 0.50
-3 -1 25 8.40 0.50
3 -1 -25 8.70 0.50
3 1 25 9.00 0.50
3 1 25 9.10 0.60
3 -1 -25 8.30 0.60
-3 1 -25 9.10 0.50
-4 1 25 50.59 1.80
4 1 -25 50.59 1.90
4 -1 25 49.80 1.90
4 -1 25 47.40 1.80
-4 -1 -25 52.09 1.80
-4 1 25 51.59 1.80
4 -1 -25 51.19 2.00
4 1 25 51.89 1.90
-4 -1 25 51.59 1.80
-4 1 -25 52.29 1.80
-4 -1 25 41.80 1.90
0 2 -25 2.00 0.30
0 2 25 2.40 0.30
0 -2 -25 2.10 0.30
0 -2 -25 2.00 0.30
0 2 -25 1.80 0.30
0 2 -25 2.00 0.30
-1 -2 -25 11.10 0.60
1 2 -25 10.10 0.80
1 -2 25 10.40 0.80
-1 -2 -25 11.80 0.90
-1 2 25 10.60 0.60
1 -2 25 10.50 0.60
1 2 -25 10.50 0.50
-1 2 -25 10.60 0.60
1 2 25 11.10 0.60
-1 -2 25 10.50 0.60
-1 -2 25 10.70 0.70
-1 2 -25 10.00 0.60
1 -2 -25 10.20 0.70
1 -2 -25 9.70 0.60
1 -2 -25 11.40 0.70
2 -2 25 33.80 1.40
-2 -2 -25 34.40 1.50
2 2 -25 35.20 1.40
-2 2 25 35.70 1.40
2 2 25 37.60 1.30
-2 2 -25 33.40 1.40
2 -2 -25 35.60 1.50
-2 2 -25 39.70 1.60
2 2 25 35.10 1.40
-2 2 -25 37.40 1.40
-2 -2 25 34.70 1.40
-2 -2 25 32.70 1.40
2 -2 -25 34.20 1.40
-3 2 25 10.80 0.60
3 -2 25 10.00 0.60
-3 -2 -25 10.40 0.60
-3 -2 -25 10.60 0.60
3 2 -25 10.00 0.60
3 -2 25 10.00 0.60
-3 -2 25 11.20 0.60
3 -2 -25 10.90 0.60
3 2 25 10.10 0.60
-3 -2 25 10.60 0.60
3 -2 -25 10.90 0.70
-3 2 -25 10.30 0.60
-4 -2 -25 5.80 0.60
4 2 -25 6.20 0.40
-4 2 25 5.70 0.40
4 -2 25 5.50 0.40
-4 -2 -25 7.50 0.50
4 -2 25 5.30 0.40
4 2 25 5.50 0.50
4 -2 -25 6.60 0.60
-4 -2 25 5.90 0.40
-4 2 -25 6.30 0.40
0 3 25 9.90 0.60
0 3 -25 8.60 0.40
0 3 -25 7.80 0.60
0 -3 25 8.60 0.60
0 -3 -25 9.10 0.60
0 -3 25 7.40 0.60
0 -3 -25 7.50 0.60
0 3 -25 8.10 0.50
1 -3 25 1.60 0.30
1 -3 25 1.50 0.40
-1 -3 -25 1.30 0.20
-1 3 25 1.10 0.20
-1 -3 -25 1.60 0.30
1 3 -25 1.30 0.20
-1 -3 25 1.40 0.30
-1 3 -25 1.00 0.20
1 -3 -25 1.30 0.20
1 3 25 1.30 0.20
-1 -3 25 1.10 0.20
-1 3 -25 1.30 0.20
-1 3 -25 0.90 0.20
1 -3 -25 1.40 0.30
1 3 25 1.30 0.20
-2 -3 -25 7.70 0.60
-2 -3 -25 7.50 0.50
-2 3 25 7.50 0.40
2 -3 25 6.90 0.60
2 3 -25 7.60 0.50
2 -3 25 7.00 0.50
-2 3 -25 6.90 0.40
2 -3 -25 7.50 0.50
2 3 25 7.50 0.40
2 3 25 7.90 0.40
2 -3 -25 7.70 0.60
-2 3 -25 7.50 0.40
-2 -3 25 6.90 0.50
-2 -3 25 6.90 0.50
-2 3 -25 7.00 0.40
-3 -3 -25 10.70 0.60
3 -3 25 10.20 0.60
-3 -3 -25 10.80 0.60
-3 3 25 10.90 0.50
3 3 -25 10.90 0.60
3 -3 25 11.00 0.60
-3 3 -25 10.70 0.50
3 -3 -25 9.00 0.60
3 3 25 11.00 0.50
-3 3 -25 10.40 0.60
-3 -3 25 10.60 0.60
3 -3 -25 10.50 0.50
4 -3 25 28.50 1.10
-4 3 25 31.10 1.10
4 3 -25 24.70 1.20
-4 -3 -25 31.50 1.10
4 -3 25 29.60 1.20
4 3 -25 28.60 1.20
4 3 25 30.60 1.10
-4 -3 25 26.20 1.10
-4 3 -25 30.40 1.10
4 -3 -25 29.10 1.20
0 -4 -25 0.00 0.10
0 4 25 0.00 0.10
0 -4 -25 0.20 0.20
0 4 25 0.00 0.10
0 -4 25 0.20 0.10
0 4 -25 0.10 0.10
0 -4 25 0.00 0.20
0 4 -25 0.10 0.10
1 4 -25 14.10 0.60
-1 -4 -25 13.90 0.70
1 -4 25 13.90 0.60
-1 -4 -25 14.60 0.80
1 -4 25 13.80 0.80
-1 4 25 14.60 0.60
-1 4 -25 13.20 0.70
-1 -4 25 13.30 0.70
1 -4 -25 13.10 0.70
1 -4 -25 13.10 0.80
-1 -4 25 12.30 0.70
1 4 25 14.10 0.70
1 4 25 14.00 0.60
-1 4 -25 12.40 0.60
-1 4 -25 12.30 0.50
-2 -4 -25 5.80 0.40
2 -4 25 5.10 0.50
-2 4 25 5.50 0.40
2 4 -25 5.80 0.40
2 -4 25 5.00 0.40
-2 -4 -25 6.10 0.50
-2 4 -25 5.40 0.40
-2 -4 25 5.70 0.40
-2 4 -25 5.70 0.30
2 -4 -25 5.90 0.40
-2 4 -25 5.60 0.30
3 -4 25 2.30 0.30
-3 4 25 1.70 0.30
3 4 -25 2.90 0.40
-3 -4 -25 2.20 0.20
3 -4 25 2.60 0.50
-3 -4 -25 2.50 0.30
-3 -4 25 2.60 0.30
3 -4 -25 1.90 0.20
-3 4 -25 2.40 0.20
0 5 25 0.00 0.10
0 5 -25 0.30 0.20
0 5 -25 -0.10 0.10
0 5 25 0.10 0.10
0 -5 -25 0.10 0.10
0 -5 -25 0.00 0.20
0 -5 25 0.10 0.20
1 -5 25 0.20 0.20
-1 5 25 0.20 0.10
-1 -5 -25 -0.30 0.20
-1 -5 -25 0.10 0.20
1 5 -25 0.10 0.10
-1 5 25 0.10 0.10
-1 -5 25 0.20 0.10
1 -5 -25 0.20 0.10
-1 5 -25 0.10 0.10
1 5 25 -0.10 0.10
-1 5 -25 0.10 0.10
0 0 26 78.39 2.90
0 0 -26 81.09 2.80
1 0 -26 4.00 0.30
-1 0 26 3.90 0.40
1 0 26 4.30 0.40
-1 0 -26 4.10 0.40
2 0 26 22.90 1.00
-2 0 26 22.90 1.00
-2 0 -26 23.70 1.00
2 0 26 22.70 1.00
2 0 -26 21.70 0.90
3 0 -26 15.70 0.80
-3 0 -26 16.10 0.70
-3 0 26 15.80 0.70
3 0 26 15.40 0.70
3 0 26 15.80 0.70
0 1 26 23.80 1.00
0 -1 -26 22.00 1.00
0 1 -26 21.50 0.90
0 -1 26 22.30 1.00
0 -1 -26 22.20 1.00
0 1 -26 23.10 1.00
1 1 -26 9.10 0.50
1 1 -26 10.20 0.60
-1 -1 -26 10.60 0.60
1 -1 26 9.70 0.60
-1 1 26 10.80 0.60
-1 1 -26 10.70 0.60
-1 -1 26 9.30 0.60
1 1 26 10.20 0.50
-1 1 -26 9.70 0.50
1 -1 -26 9.90 0.50
-2 -1 -26 10.20 0.50
2 1 -26 9.80 0.60
-2 1 26 10.10 0.50
2 -1 26 9.40 0.50
2 -1 26 9.30 0.60
-2 -1 26 10.20 0.60
-2 -1 26 9.40 0.50
-2 1 -26 9.90 0.50
2 -1 -26 10.30 0.70
2 1 26 10.80 0.50
2 1 26 9.70 0.50
-3 1 26 14.80 0.70
3 -1 26 13.50 0.70
3 -1 26 11.90 0.60
-3 -1 -26 12.90 0.60
3 1 -26 13.30 0.70
3 -1 -26 11.80 1.00
3 1 26 12.40 0.60
-3 1 -26 12.90 0.60
3 1 26 13.20 0.50
-3 -1 26 12.70 0.60
-3 -1 26 12.40 0.60
0 2 -26 2.80 0.30
0 2 26 2.50 0.30
0 -2 -26 2.20 0.30
0 2 -26 2.80 0.30
0 -2 26 2.70 0.40
-1 -2 -26 13.80 0.70
-1 2 26 13.30 0.60
1 2 -26 12.30 0.70
-1 -2 -26 15.60 1.00
1 -2 26 12.40 0.70
-1 2 -26 12.40 0.60
1 2 26 14.00 0.60
-1 -2 26 12.20 0.70
1 -2 -26 13.00 0.60
-1 -2 26 11.90 0.70
-1 2 -26 12.80 0.60
1 -2 -26 12.50 0.70
2 2 -26 8.50 0.50
2 -2 26 8.20 0.50
2 -2 26 7.50 0.40
-2 2 26 8.00 0.50
-2 -2 -26 8.70 0.50
-2 -2 -26 6.90 0.60
-2 -2 26 8.30 0.40
2 2 26 9.30 0.40
2 -2 -26 8.00 0.50
-2 2 -26 8.40 0.50
2 -2 -26 9.70 0.70
-2 -2 26 8.00 0.50
3 -2 26 28.60 1.20
-3 2 26 29.60 1.20
3 -2 26 28.90 1.20
3 -2 -26 32.30 1.30
-3 2 -26 30.00 1.20
-3 -2 26 30.60 1.10
0 3 26 2.70 0.30
0 -3 26 2.40 0.30
0 3 26 2.60 0.20
0 3 -26 2.20 0.30
0 -3 -26 1.50 0.40
0 -3 -26 2.50 0.30
1 -3 26 18.50 0.90
1 3 -26 20.20 0.80
-1 3 26 20.60 0.80
-1 -3 -26 19.80 0.80
-1 -3 -26 19.60 1.10
1 -3 -26 18.50 0.80
-1 -3 26 16.50 0.80
-1 3 -26 18.10 0.70
-1 -3 26 17.30 0.80
-1 3 -26 18.00 0.90
1 3 26 19.60 0.70
-1 3 -26 18.00 0.80
2 -3 26 8.50 0.50
-2 -3 -26 9.20 0.50
-2 -3 -26 7.70 0.70
2 -3 26 8.70 0.50
-2 3 26 9.30 0.50
2 3 -26 8.80 0.50
-2 3 -26 9.60 0.40
-2 -3 26 9.40 0.50
2 -3 -26 8.90 0.50
-2 -3 26 9.40 0.60
0 4 26 16.40 0.70
0 -4 -26 17.10 0.80
0 4 26 16.10 0.60
0 4 -26 15.60 0.70
0 -4 26 14.70 0.70
-1 -4 -26 14.00 0.80
-1 4 26 14.30 0.60
-1 4 26 13.10 0.60
1 -4 26 11.80 0.60
1 4 -26 11.20 0.60
1 -4 -26 13.30 0.70
-1 -4 26 11.20 0.60
-1 4 -26 12.00 0.60
0 0 -27 0.20 0.20
0 0 27 0.10 0.20
0 0 -27 0.10 0.20
1 0 -27 3.60 0.40
-1 0 -27 3.30 0.30
1 0 27 3.50 0.30
1 0 -27 3.20 0.20
-1 0 27 3.40 0.30
-2 0 -27 3.20 0.30
-2 0 27 4.20 0.30
2 0 -27 4.10 0.40
0 1 -27 30.20 1.20
0 1 27 31.50 1.20
0 -1 27 30.00 1.20
0 1 -27 30.50 1.20
0 -1 -27 31.20 1.20
-1 -1 -27 9.70 0.50
1 -1 27 9.70 0.50
-1 1 27 9.70 0.50
-1 1 -27 11.00 0.60
1 1 27 9.60 0.50
1 -1 -27 10.00 0.50
-1 -1 27 9.90 0.60
1 -1 -27 10.50 0.80
2 1 -27 14.30 0.70
-2 1 27 15.50 0.60
-2 -1 -27 14.40 0.70
-2 -1 27 14.40 0.60
2 1 27 15.20 0.60
2 -1 -27 14.20 0.70
0 2 -27 33.90 1.30
0 -2 27 32.30 1.50
0 -2 -27 37.60 1.40
0 2 27 36.70 1.30
-1 2 27 5.30 0.40
1 2 -27 5.20 0.40
1 -2 27 5.50 0.50
-1 -2 -27 5.60 0.50
1 2 27 6.00 0.40
1 -2 -27 5.50 0.30
-1 2 -27 5.20 0.30
-1 -2 27 5.50 0.40
0 0 0 0.00 0.00
_computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)'
;
_shelx_hkl_checksum 15681
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
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
O1 O 0.22614(16) 0.68913(14) 0.74316(5) 0.0349(3) Uani 1 1 d D . . . .
O2 O 0.48385(17) 0.60442(18) 0.74258(6) 0.0481(4) Uani 1 1 d . . . . .
H2 H 0.405181 0.638210 0.753429 0.072 Uiso 1 1 calc GR . . . .
O3 O 0.61516(13) 0.59325(13) 0.66133(6) 0.0335(3) Uani 1 1 d . . . . .
O4 O 0.49882(16) 0.65142(16) 0.40399(6) 0.0461(4) Uani 1 1 d . . . . .
O5 O 0.28604(14) 0.54986(13) 0.39662(5) 0.0316(3) Uani 1 1 d . . . . .
C1 C 0.28424(16) 0.42490(14) 0.57565(7) 0.0203(3) Uani 1 1 d . . . . .
H1A H 0.371081 0.456495 0.598037 0.024 Uiso 1 1 calc R . . . .
C2 C 0.29971(16) 0.46912(15) 0.51184(6) 0.0207(3) Uani 1 1 d . . . . .
H2A H 0.227879 0.440241 0.484539 0.025 Uiso 1 1 calc R . . . .
C3 C 0.40564(16) 0.54543(15) 0.49021(7) 0.0216(3) Uani 1 1 d . . . . .
C4 C 0.53458(17) 0.59444(16) 0.52518(7) 0.0251(3) Uani 1 1 d . . . . .
H4A H 0.618580 0.600385 0.497965 0.030 Uiso 1 1 calc R . . . .
H4B H 0.558322 0.528450 0.556169 0.030 Uiso 1 1 calc R . . . .
C5 C 0.5133(2) 0.72993(16) 0.55557(7) 0.0291(3) Uani 1 1 d . . . . .
H5A H 0.601688 0.752583 0.578296 0.035 Uiso 1 1 calc R . . . .
H5B H 0.499326 0.798317 0.524637 0.035 Uiso 1 1 calc R . . . .
C6 C 0.38575(19) 0.73041(14) 0.59691(7) 0.0256(3) Uani 1 1 d . . . . .
H6 H 0.301248 0.772241 0.581978 0.031 Uiso 1 1 calc R . . . .
C7 C 0.37422(18) 0.68009(15) 0.65197(7) 0.0249(3) Uani 1 1 d . . . . .
C8 C 0.22523(19) 0.66387(16) 0.67973(7) 0.0270(3) Uani 1 1 d . . . . .
H8 H 0.157432 0.727539 0.660292 0.032 Uiso 1 1 calc R . . . .
C9 C 0.16752(17) 0.52337(17) 0.67005(7) 0.0263(3) Uani 1 1 d . . . . .
H9A H 0.073466 0.513354 0.690635 0.032 Uiso 1 1 calc R . . . .
H9B H 0.236028 0.458913 0.687405 0.032 Uiso 1 1 calc R . . . .
C10 C 0.14800(16) 0.49451(15) 0.60268(7) 0.0217(3) Uani 1 1 d . . . . .
H10 H 0.139671 0.582028 0.582421 0.026 Uiso 1 1 calc R . . . .
C11 C 0.00910(17) 0.42094(17) 0.58983(7) 0.0265(3) Uani 1 1 d . . . . .
C12 C 0.01401(19) 0.27416(18) 0.60036(9) 0.0337(4) Uani 1 1 d . . . . .
H12A H -0.079376 0.233972 0.588676 0.040 Uiso 1 1 calc R . . . .
H12B H 0.030137 0.256196 0.643175 0.040 Uiso 1 1 calc R . . . .
C13 C 0.13665(19) 0.21374(17) 0.56361(9) 0.0332(4) Uani 1 1 d . . . . .
H13A H 0.140102 0.117375 0.570610 0.040 Uiso 1 1 calc R . . . .
H13B H 0.117811 0.228576 0.520738 0.040 Uiso 1 1 calc R . . . .
C14 C 0.28003(18) 0.27413(15) 0.58019(7) 0.0242(3) Uani 1 1 d . . . . .
C15 C 0.40341(17) 0.58820(15) 0.42660(7) 0.0247(3) Uani 1 1 d . . . . .
C16 C 0.50153(19) 0.62309(16) 0.68461(7) 0.0283(3) Uani 1 1 d . . . . .
C17 C -0.1069(2) 0.4814(2) 0.56939(10) 0.0391(4) Uani 1 1 d . . . . .
H17A H -0.191788 0.432180 0.560698 0.047 Uiso 1 1 calc R . . . .
H17B H -0.105668 0.574104 0.563355 0.047 Uiso 1 1 calc R . . . .
C18 C 0.39647(19) 0.20419(16) 0.59689(7) 0.0262(3) Uani 1 1 d . . . . .
C19 C 0.4011(2) 0.05509(17) 0.59794(9) 0.0373(4) Uani 1 1 d . . . . .
H19A H 0.306737 0.019989 0.585951 0.056 Uiso 1 1 calc GR . . . .
H19B H 0.424099 0.024839 0.638288 0.056 Uiso 1 1 calc GR . . . .
H19C H 0.475535 0.023822 0.570247 0.056 Uiso 1 1 calc GR . . . .
C20 C 0.53845(19) 0.26320(17) 0.61588(8) 0.0314(4) Uani 1 1 d . . . . .
H20A H 0.582928 0.308709 0.582009 0.047 Uiso 1 1 calc GR . . . .
H20B H 0.603048 0.193010 0.629776 0.047 Uiso 1 1 calc GR . . . .
H20C H 0.521872 0.326321 0.648214 0.047 Uiso 1 1 calc GR . . . .
C21 C 0.2780(2) 0.5912(2) 0.33519(8) 0.0395(4) Uani 1 1 d . . . . .
H21A H 0.350135 0.542993 0.311760 0.059 Uiso 1 1 calc GR . . . .
H21B H 0.297325 0.686093 0.332560 0.059 Uiso 1 1 calc GR . . . .
H21C H 0.181170 0.572642 0.319565 0.059 Uiso 1 1 calc GR . . . .
O6 O 0.19434(17) -0.05006(15) 0.76435(6) 0.0430(3) Uani 1 1 d . . . . .
H6A H 0.247635 -0.017310 0.790790 0.064 Uiso 1 1 calc GR . . . .
C22 C 0.1585(2) 0.0480(3) 0.72218(9) 0.0475(5) Uani 1 1 d . . . . .
H22A H 0.084593 0.106551 0.738872 0.071 Uiso 1 1 calc GR . . . .
H22B H 0.121070 0.006048 0.686010 0.071 Uiso 1 1 calc GR . . . .
H22C H 0.245106 0.099387 0.712385 0.071 Uiso 1 1 calc GR . . . .
H1 H 0.219(3) 0.771(2) 0.7476(13) 0.057 Uiso 1 1 d DR . . . .
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
O1 0.0432(7) 0.0389(7) 0.0226(6) -0.0078(5) -0.0005(5) 0.0063(6)
O2 0.0431(8) 0.0768(11) 0.0245(6) 0.0052(7) -0.0052(6) 0.0173(8)
O3 0.0291(6) 0.0407(7) 0.0306(6) 0.0020(5) -0.0051(5) 0.0025(5)
O4 0.0448(8) 0.0621(9) 0.0315(7) 0.0121(6) 0.0026(6) -0.0207(7)
O5 0.0326(6) 0.0391(6) 0.0230(5) 0.0020(5) -0.0025(5) -0.0018(5)
C1 0.0192(6) 0.0193(7) 0.0223(7) -0.0018(5) -0.0008(6) -0.0013(5)
C2 0.0201(7) 0.0199(7) 0.0222(7) -0.0038(6) -0.0009(5) 0.0011(6)
C3 0.0225(7) 0.0191(6) 0.0232(7) -0.0017(6) 0.0027(6) 0.0029(6)
C4 0.0223(7) 0.0255(7) 0.0274(7) 0.0020(6) 0.0000(6) -0.0023(6)
C5 0.0378(9) 0.0228(7) 0.0267(7) 0.0020(6) -0.0034(7) -0.0077(7)
C6 0.0330(8) 0.0157(6) 0.0280(8) -0.0025(6) -0.0071(7) -0.0018(6)
C7 0.0313(8) 0.0190(7) 0.0243(7) -0.0038(6) -0.0039(6) 0.0009(6)
C8 0.0322(8) 0.0280(8) 0.0207(7) -0.0033(6) -0.0017(6) 0.0054(7)
C9 0.0268(7) 0.0302(8) 0.0219(7) 0.0012(6) 0.0023(6) 0.0012(6)
C10 0.0208(7) 0.0220(7) 0.0224(7) 0.0009(6) 0.0012(6) 0.0003(6)
C11 0.0215(7) 0.0327(8) 0.0252(7) 0.0016(6) 0.0032(6) -0.0033(6)
C12 0.0256(8) 0.0315(8) 0.0440(10) 0.0053(8) -0.0013(7) -0.0073(7)
C13 0.0317(9) 0.0245(8) 0.0434(10) -0.0033(7) -0.0045(8) -0.0061(7)
C14 0.0278(8) 0.0196(7) 0.0252(7) -0.0017(6) 0.0016(6) -0.0021(6)
C15 0.0266(8) 0.0222(7) 0.0253(8) -0.0013(6) 0.0036(6) 0.0018(6)
C16 0.0328(9) 0.0270(8) 0.0252(8) -0.0013(6) -0.0065(7) -0.0006(7)
C17 0.0242(8) 0.0429(10) 0.0502(11) 0.0066(9) -0.0027(8) -0.0017(8)
C18 0.0314(8) 0.0217(7) 0.0256(7) 0.0008(6) 0.0034(7) 0.0003(6)
C19 0.0426(10) 0.0214(8) 0.0479(10) 0.0013(7) 0.0033(9) 0.0030(7)
C20 0.0289(8) 0.0274(8) 0.0379(9) 0.0057(7) -0.0028(7) 0.0042(7)
C21 0.0456(10) 0.0508(11) 0.0219(8) 0.0014(8) -0.0020(8) 0.0064(9)
O6 0.0491(8) 0.0421(7) 0.0378(7) -0.0092(6) -0.0115(6) -0.0027(6)
C22 0.0384(10) 0.0683(14) 0.0359(10) 0.0069(10) -0.0011(8) -0.0076(10)
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
O O 0.0492 0.0322 '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
C8 O1 H1 107(2) . . ?
C16 O2 H2 109.5 . . ?
C15 O5 C21 116.05(14) . . ?
C2 C1 H1A 107.8 . . ?
C2 C1 C10 108.10(12) . . ?
C2 C1 C14 111.23(12) . . ?
C10 C1 H1A 107.8 . . ?
C14 C1 H1A 107.8 . . ?
C14 C1 C10 113.78(13) . . ?
C1 C2 H2A 117.1 . . ?
C3 C2 C1 125.85(14) . . ?
C3 C2 H2A 117.1 . . ?
C2 C3 C4 125.33(14) . . ?
C2 C3 C15 120.31(14) . . ?
C15 C3 C4 114.36(13) . . ?
C3 C4 H4A 108.5 . . ?
C3 C4 H4B 108.5 . . ?
C3 C4 C5 114.91(14) . . ?
H4A C4 H4B 107.5 . . ?
C5 C4 H4A 108.5 . . ?
C5 C4 H4B 108.5 . . ?
C4 C5 H5A 109.2 . . ?
C4 C5 H5B 109.2 . . ?
H5A C5 H5B 107.9 . . ?
C6 C5 C4 112.06(13) . . ?
C6 C5 H5A 109.2 . . ?
C6 C5 H5B 109.2 . . ?
C5 C6 H6 115.4 . . ?
C7 C6 C5 129.13(16) . . ?
C7 C6 H6 115.4 . . ?
C6 C7 C8 119.39(15) . . ?
C6 C7 C16 122.25(16) . . ?
C16 C7 C8 117.91(14) . . ?
O1 C8 C7 112.27(14) . . ?
O1 C8 H8 108.6 . . ?
O1 C8 C9 107.78(14) . . ?
C7 C8 H8 108.6 . . ?
C7 C8 C9 110.90(13) . . ?
C9 C8 H8 108.6 . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
C8 C9 C10 110.68(13) . . ?
H9A C9 H9B 108.1 . . ?
C10 C9 H9A 109.5 . . ?
C10 C9 H9B 109.5 . . ?
C1 C10 H10 106.6 . . ?
C9 C10 C1 111.68(12) . . ?
C9 C10 H10 106.6 . . ?
C11 C10 C1 112.74(12) . . ?
C11 C10 C9 112.19(12) . . ?
C11 C10 H10 106.6 . . ?
C12 C11 C10 115.55(14) . . ?
C17 C11 C10 121.88(16) . . ?
C17 C11 C12 122.55(16) . . ?
C11 C12 H12A 109.8 . . ?
C11 C12 H12B 109.8 . . ?
C11 C12 C13 109.44(15) . . ?
H12A C12 H12B 108.2 . . ?
C13 C12 H12A 109.8 . . ?
C13 C12 H12B 109.8 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 108.1 . . ?
C14 C13 C12 110.85(14) . . ?
C14 C13 H13A 109.5 . . ?
C14 C13 H13B 109.5 . . ?
C13 C14 C1 114.28(14) . . ?
C18 C14 C1 121.67(15) . . ?
C18 C14 C13 124.05(15) . . ?
O4 C15 O5 122.58(15) . . ?
O4 C15 C3 123.27(15) . . ?
O5 C15 C3 114.16(13) . . ?
O2 C16 C7 115.94(15) . . ?
O3 C16 O2 119.66(15) . . ?
O3 C16 C7 124.39(15) . . ?
C11 C17 H17A 120.0 . . ?
C11 C17 H17B 120.0 . . ?
H17A C17 H17B 120.0 . . ?
C14 C18 C19 123.71(16) . . ?
C14 C18 C20 124.67(15) . . ?
C20 C18 C19 111.61(15) . . ?
C18 C19 H19A 109.5 . . ?
C18 C19 H19B 109.5 . . ?
C18 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C18 C20 H20A 109.5 . . ?
C18 C20 H20B 109.5 . . ?
C18 C20 H20C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
O5 C21 H21A 109.5 . . ?
O5 C21 H21B 109.5 . . ?
O5 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C22 O6 H6A 109.5 . . ?
O6 C22 H22A 109.5 . . ?
O6 C22 H22B 109.5 . . ?
O6 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
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
O1 C8 1.4474(19) . ?
O1 H1 0.84(2) . ?
O2 H2 0.8400 . ?
O2 C16 1.326(2) . ?
O3 C16 1.212(2) . ?
O4 C15 1.203(2) . ?
O5 C15 1.335(2) . ?
O5 C21 1.444(2) . ?
C1 H1A 1.0000 . ?
C1 C2 1.508(2) . ?
C1 C10 1.566(2) . ?
C1 C14 1.532(2) . ?
C2 H2A 0.9500 . ?
C2 C3 1.339(2) . ?
C3 C4 1.511(2) . ?
C3 C15 1.493(2) . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 C5 1.546(2) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C5 C6 1.501(3) . ?
C6 H6 0.9500 . ?
C6 C7 1.342(2) . ?
C7 C8 1.521(2) . ?
C7 C16 1.502(2) . ?
C8 H8 1.0000 . ?
C8 C9 1.536(2) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C9 C10 1.551(2) . ?
C10 H10 1.0000 . ?
C10 C11 1.513(2) . ?
C11 C12 1.507(2) . ?
C11 C17 1.318(3) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C12 C13 1.530(3) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C13 C14 1.507(2) . ?
C14 C18 1.342(2) . ?
C17 H17A 0.9500 . ?
C17 H17B 0.9500 . ?
C18 C19 1.512(2) . ?
C18 C20 1.504(2) . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
O6 H6A 0.8400 . ?
O6 C22 1.412(3) . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?