#------------------------------------------------------------------------------
#$Date: 2025-05-03 21:19:56 +0200 (Sat, 03 May 2025) $
#$Revision: 299519 $
#$URL: svn://www.crystallography.net/cod/cif/2/02/34/2023450.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2023450
loop_
_publ_author_name
'Yoshizawa, Fumishi'
'Okui, Anna'
'Nakane, Daisuke'
'Akitsu, Takashiro'
_publ_section_title
;
Crystal structure and Hirshfeld surface analysis of
aqua-(1H-imidazole-κN
3)[N-(2-oxido-benzyl-idene)threonato-κ3
O,N,O']zinc(II).
;
_journal_coeditor_code OX2014
_journal_issue 'Pt 4'
_journal_name_full
'Acta crystallographica. Section E, Crystallographic communications'
_journal_page_first 332
_journal_page_last 335
_journal_paper_doi 10.1107/S2056989025002385
_journal_volume 81
_journal_year 2025
_chemical_absolute_configuration syn
_chemical_formula_iupac '[Zn (C11 H11 N1 O4) (C3 H4 N2) (H2 O1)]'
_chemical_formula_sum 'C14 H17 N3 O5 Zn'
_chemical_formula_weight 372.67
_chemical_name_systematic
Aqua(1H-imidazole-\kN^3^)[N-(2-oxidobenzylidene)threonato-\k^3^O,N,O']zinc(II)
_space_group_crystal_system monoclinic
_space_group_IT_number 5
_space_group_name_Hall 'C 2y'
_space_group_name_H-M_alt 'C 1 2 1'
_atom_sites_solution_hydrogens mixed
_cell_angle_alpha 90
_cell_angle_beta 123.7870(10)
_cell_angle_gamma 90
_cell_formula_units_Z 4
_cell_length_a 18.3835(7)
_cell_length_b 7.7141(3)
_cell_length_c 13.3800(5)
_cell_measurement_reflns_used 6515
_cell_measurement_temperature 173.(2)
_cell_measurement_theta_max 25.0426
_cell_measurement_theta_min 2.9581
_cell_volume 1576.99(11)
_computing_cell_refinement
;
SAINT V8.40B (Bruker, 2019)
;
_computing_data_collection
;
APEX2 (Bruker, 2019)
;
_computing_data_reduction
;
SAINT V8.40B (Bruker, 2019)
;
_computing_molecular_graphics
;
ShelXle (H\"ubschle et al., 2011)
;
_computing_structure_refinement
;
SHELXL2019/1 (Sheldrick, 2015b)
;
_computing_structure_solution
;
SHELXT2018/2 (Sheldrick, 2015a)
;
_diffrn_ambient_temperature 173.(2)
_diffrn_detector_area_resol_mean 7.3910
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type 'Bruker-AXS D8 QUEST'
_diffrn_measurement_method 'profile data from \q/2\q scans'
_diffrn_radiation_type MoK\a
_diffrn_radiation_wavelength 0.71073
_diffrn_reflns_av_R_equivalents 0.0729
_diffrn_reflns_av_unetI/netI 0.0651
_diffrn_reflns_limit_h_max 21
_diffrn_reflns_limit_h_min -21
_diffrn_reflns_limit_k_max 9
_diffrn_reflns_limit_k_min -9
_diffrn_reflns_limit_l_max 15
_diffrn_reflns_limit_l_min -15
_diffrn_reflns_number 10846
_diffrn_reflns_theta_full 25.00
_diffrn_reflns_theta_max 25.06
_diffrn_reflns_theta_min 2.96
_exptl_absorpt_coefficient_mu 1.586
_exptl_absorpt_correction_T_max 0.86
_exptl_absorpt_correction_T_min 0.64
_exptl_absorpt_correction_type multi-scan
_exptl_crystal_colour yellow
_exptl_crystal_density_diffrn 1.570
_exptl_crystal_density_method 'not measured'
_exptl_crystal_description prism
_exptl_crystal_F_000 768
_exptl_crystal_size_max 0.100
_exptl_crystal_size_mid 0.100
_exptl_crystal_size_min 0.100
_refine_diff_density_max 0.352
_refine_diff_density_min -0.288
_refine_ls_abs_structure_details
;
Flack x determined using 1180 quotients
[(I^+^)-(I^-^)]/[(I^+^)+(I^-^)]
(Parsons et al., 2013)
;
_refine_ls_abs_structure_Flack 0.143(11)
_refine_ls_extinction_method none
_refine_ls_goodness_of_fit_ref 1.067
_refine_ls_hydrogen_treatment mixed
_refine_ls_matrix_type full
_refine_ls_number_parameters 218
_refine_ls_number_reflns 2752
_refine_ls_number_restraints 1
_refine_ls_restrained_S_all 1.067
_refine_ls_R_factor_all 0.0319
_refine_ls_R_factor_gt 0.0316
_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^)+(0.0364P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme calc
_refine_ls_wR_factor_gt 0.0737
_refine_ls_wR_factor_ref 0.0740
_reflns_number_gt 2701
_reflns_number_total 2752
_reflns_threshold_expression 'I > 2\s(I)'
_cod_data_source_file ox2014.cif
_cod_data_source_block I
_cod_depositor_comments 'Adding full bibliography for 2023450.cif.'
_cod_database_code 2023450
_shelx_hkl_file
;
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6 -8 0 243.68 95.89
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4 0 -1 640.94 60.39
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-8 0 -1 270.17 21.80
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9 1 -1 161.38 38.40
9 1 -1 112.79 13.70
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7 -1 -1 1158.48 120.19
7 1 -1 1425.46 117.79
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3 1 1 993.70 70.99
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11 -1 1 774.02 56.49
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8 2 1 1769.62 149.29
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9 3 -1 45.00 21.70
9 3 -1 26.70 6.80
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9 3 -1 31.90 7.60
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3 -3 1 1379.96 135.19
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5 -3 1 2172.48 202.38
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13 3 1 249.97 25.70
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6 -4 -1 512.25 38.70
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4 -4 -1 1643.24 164.38
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0 -4 -1 3303.77 291.57
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4 4 1 121.29 11.90
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4 4 1 121.39 13.50
6 -4 1 1593.14 174.38
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8 4 1 411.26 77.59
8 4 1 560.84 40.20
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13 5 -1 298.17 29.20
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11 5 -1 1458.95 107.79
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9 -5 -1 146.79 12.70
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9 -5 -1 140.19 11.80
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-9 -5 1 127.09 17.10
-9 5 1 174.28 63.59
9 5 -1 140.49 49.30
9 5 -1 147.99 17.00
9 5 -1 153.58 16.90
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-9 5 1 156.98 24.40
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5 -5 -1 1077.39 167.78
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5 5 -1 988.90 70.79
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3 -5 -1 1934.91 193.38
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3 5 -1 1414.06 169.98
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1 -5 -1 360.16 29.50
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1 -5 -1 317.27 84.39
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1 5 -1 329.47 83.69
1 5 -1 332.37 28.50
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1 -5 1 169.68 62.19
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1 -5 1 189.48 19.00
1 5 1 166.78 19.10
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1 5 1 241.88 19.30
1 5 1 196.68 63.19
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3 5 1 3496.85 303.47
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7 5 1 204.68 21.40
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7 5 1 263.37 21.20
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9 5 1 1366.96 96.49
9 5 1 1392.86 98.49
9 5 1 1444.16 149.29
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13 5 1 292.57 28.20
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14 6 -1 1192.18 94.49
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10 -6 -1 1097.79 75.29
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10 -6 -1 1136.09 76.29
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8 6 -1 743.83 136.39
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8 6 -1 802.32 61.09
6 -6 -1 829.42 56.99
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6 -6 -1 827.42 59.19
6 -6 -1 890.71 161.98
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6 6 -1 710.63 58.59
6 6 -1 694.13 57.99
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4 -6 -1 1936.91 224.98
-4 -6 1 1941.51 144.89
4 -6 -1 1853.61 143.19
-4 6 1 2108.39 143.29
4 6 -1 2127.89 144.39
4 6 -1 1885.01 216.68
-4 6 1 1892.61 226.08
4 6 -1 2040.70 144.19
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2 -6 -1 1345.57 208.28
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2 -6 -1 1415.06 110.19
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2 6 -1 1686.33 111.39
2 6 -1 1505.55 184.68
0 -6 1 347.77 31.00
0 -6 -1 340.97 31.70
0 -6 -1 269.67 97.39
0 -6 1 506.65 119.29
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0 6 1 375.86 101.19
0 6 1 413.56 31.50
0 6 -1 310.17 30.30
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2 -6 1 2059.69 242.68
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2 6 1 2446.96 163.78
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4 6 1 193.38 18.70
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4 6 1 255.57 75.49
4 6 1 215.88 21.60
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6 -6 1 1465.45 113.09
6 -6 1 1603.34 198.28
-6 -6 -1 1379.66 208.28
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6 6 1 1636.44 184.68
6 6 1 1727.23 117.59
6 6 1 1780.42 114.89
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8 -6 1 327.67 24.40
-8 -6 -1 354.76 92.29
8 -6 1 325.57 24.30
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8 6 1 277.37 27.00
8 6 1 263.17 28.40
8 6 1 300.07 85.19
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-10 -6 -1 93.69 13.70
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10 6 1 88.89 40.70
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10 6 1 107.99 14.00
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12 6 1 640.54 53.89
12 6 1 633.94 51.29
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-15 3 8 115.99 16.60
13 -3 -8 1073.09 194.88
-13 -3 8 962.50 76.79
-13 -3 8 1530.55 214.08
13 -3 -8 973.90 75.59
13 -3 -8 1056.39 79.79
-13 -3 8 938.11 78.69
-13 -3 8 996.80 80.59
13 3 -8 1108.89 172.98
-13 3 8 1058.39 78.69
-13 3 8 1196.58 79.89
-13 3 8 1151.78 77.19
11 -3 -8 73.19 11.70
11 -3 -8 64.19 43.60
-11 -3 8 138.69 59.49
11 -3 -8 82.19 10.20
-11 -3 8 69.39 10.70
-11 -3 8 79.59 14.40
-11 -3 8 51.89 12.30
-11 3 8 70.09 11.60
-11 3 8 73.49 11.60
-11 3 8 92.29 45.70
11 3 -8 70.79 39.90
-11 3 8 56.69 11.20
11 3 -8 47.70 11.60
11 3 -8 48.30 11.70
-9 -3 8 3412.86 291.47
9 -3 -8 2483.05 275.47
-9 -3 8 2556.24 196.88
-9 3 8 2621.04 254.87
9 3 -8 2712.33 260.97
9 3 -8 3080.59 199.68
7 -3 -8 1230.58 94.69
7 -3 -8 1074.09 180.78
-7 -3 8 1267.67 95.89
-7 -3 8 1171.28 182.88
7 -3 -8 1263.07 94.69
-7 3 8 1394.16 96.29
7 3 -8 1432.16 154.48
7 3 -8 1476.15 99.99
-7 3 8 1676.73 176.78
-5 -3 8 387.16 109.19
5 -3 -8 428.96 29.60
-5 -3 8 423.26 29.80
5 -3 -8 406.46 33.10
-5 -3 8 408.76 33.60
5 -3 -8 388.16 33.20
-5 3 8 398.46 35.30
-5 3 8 413.76 33.90
5 3 -8 442.46 89.19
5 3 -8 339.77 35.00
5 3 -8 429.66 36.80
-5 3 8 525.15 91.79
-3 -3 8 1613.54 177.38
3 -3 -8 1595.94 110.59
3 3 -8 1530.95 113.69
-3 3 8 1524.95 109.89
-3 3 8 1609.94 113.29
3 3 -8 1463.45 112.49
3 3 -8 1485.35 158.78
-3 3 8 1467.95 164.98
-1 -3 8 308.87 82.59
-1 -3 8 458.85 34.60
1 -3 -8 441.26 35.70
1 -3 -8 487.05 35.90
1 3 -8 493.65 90.49
1 3 -8 427.06 37.10
-1 3 8 397.06 34.40
-1 3 8 527.65 82.39
-1 3 8 407.86 84.99
-1 3 8 356.96 36.90
1 -3 8 1488.65 167.68
1 -3 8 1391.86 105.39
-1 -3 -8 1398.06 107.09
1 3 8 1555.54 138.29
1 3 8 1641.74 107.19
-1 3 -8 1223.38 144.19
-1 3 -8 1613.54 109.59
-3 -3 -8 1491.55 110.69
-3 -3 -8 1518.05 105.19
3 -3 8 1566.64 107.99
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3 -3 8 1459.55 164.88
3 3 8 1602.34 108.79
3 3 8 1494.25 125.39
3 3 8 1716.63 137.59
-3 3 -8 1664.93 155.88
-3 3 -8 1472.95 110.29
5 -3 8 224.98 59.59
5 -3 8 219.88 20.00
-5 -3 -8 225.58 22.40
-5 -3 -8 210.48 19.10
-5 3 -8 199.88 16.60
-5 3 -8 210.28 16.30
-5 3 -8 223.88 53.39
5 3 8 227.28 21.20
-5 3 -8 188.98 20.90
-5 3 -8 270.17 26.60
-7 -3 -8 554.24 45.20
7 -3 8 642.84 44.90
-7 3 -8 545.95 41.50
-7 3 -8 593.54 71.39
-7 3 -8 558.14 45.50
-7 3 -8 562.04 42.10
-18 -4 8 243.58 26.40
18 -4 -8 208.58 26.80
-18 -4 8 340.67 120.19
18 -4 -8 230.58 20.60
18 4 -8 338.87 104.99
-18 4 8 221.58 20.30
-18 4 8 219.78 90.29
-18 4 8 207.58 78.39
-18 4 8 185.28 24.90
-16 -4 8 1242.38 210.08
16 -4 -8 1088.99 85.99
-16 -4 8 1145.59 85.59
16 -4 -8 1187.08 79.89
16 4 -8 1100.69 88.19
-16 4 8 954.40 191.78
-16 4 8 955.50 83.89
16 4 -8 958.90 193.28
-16 4 8 714.83 150.18
-16 4 8 1252.37 86.39
-16 4 8 994.00 79.39
-14 -4 8 14.90 7.80
-14 -4 8 15.10 24.20
-14 -4 8 16.50 6.60
14 -4 -8 12.90 5.00
-14 -4 8 13.10 7.00
14 -4 -8 11.30 6.40
14 4 -8 14.50 21.00
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14 4 -8 4.40 5.40
-14 4 8 9.70 4.80
-14 4 8 9.00 6.20
-14 4 8 9.00 5.80
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-12 -4 8 1110.29 85.09
-12 -4 8 1284.17 89.19
12 -4 -8 1065.69 85.79
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12 4 -8 1129.79 90.29
12 4 -8 994.00 171.88
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-12 4 8 875.71 155.88
10 -4 -8 671.23 48.20
10 -4 -8 651.43 47.20
-10 -4 8 621.44 50.59
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10 4 -8 519.05 50.79
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10 4 -8 527.55 126.09
-10 4 8 528.65 48.50
-10 4 8 344.57 93.09
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8 -4 -8 81.19 10.40
-8 -4 8 104.09 14.50
8 -4 -8 89.89 12.70
-8 -4 8 98.89 11.40
8 -4 -8 91.59 12.00
8 4 -8 69.79 37.00
-8 4 8 116.39 14.60
8 4 -8 130.69 17.20
-8 4 8 122.29 11.50
-8 4 8 129.59 15.10
-8 4 8 145.69 54.29
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-6 -4 8 292.57 30.50
6 -4 -8 312.07 27.20
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-6 -4 8 352.46 25.10
6 -4 -8 264.27 26.60
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6 4 -8 240.58 70.89
-6 4 8 305.77 22.80
6 4 -8 312.47 30.80
-6 4 8 332.57 93.39
-6 4 8 297.27 29.30
-6 4 8 316.97 28.50
6 4 -8 273.67 29.90
4 -4 -8 493.75 41.20
-4 -4 8 537.65 120.19
-4 -4 8 463.35 36.60
-4 -4 8 484.45 40.90
4 -4 -8 495.05 40.80
-4 4 8 562.44 117.59
-4 4 8 506.55 96.79
4 4 -8 535.95 45.10
4 4 -8 618.24 109.29
-4 4 8 576.94 42.80
-4 4 8 541.95 44.30
-2 -4 8 286.17 82.99
-2 4 8 126.09 15.70
-2 4 8 154.28 49.60
2 4 -8 152.98 18.60
2 4 -8 142.79 10.90
-2 4 8 210.08 67.39
2 4 -8 143.69 52.29
0 -4 -8 2163.68 159.28
0 -4 8 2242.58 238.58
0 4 8 2297.77 158.98
0 4 -8 2245.18 161.78
0 4 -8 2349.36 221.48
0 4 8 2341.77 223.68
2 -4 8 476.55 35.50
2 -4 8 425.16 102.59
-2 -4 -8 440.66 38.10
2 4 8 457.65 37.40
2 4 8 584.84 82.09
2 4 8 355.66 75.89
-2 4 -8 382.66 38.00
-2 4 -8 546.25 99.89
4 -4 8 1979.30 232.78
-4 -4 -8 1831.12 139.49
4 -4 8 1817.22 132.29
-4 4 -8 1777.52 186.08
-4 4 -8 1951.00 128.59
4 4 8 1879.21 134.79
4 4 8 1940.51 159.28
-4 4 -8 1827.52 135.99
4 4 8 1997.20 165.08
-4 4 -8 1945.41 129.09
6 -4 8 232.98 21.70
6 -4 8 198.88 65.49
-6 -4 -8 275.97 27.30
-6 4 -8 234.68 23.90
-6 4 -8 255.77 19.50
-6 4 -8 258.57 63.99
6 4 8 277.17 25.80
17 -5 -8 47.70 12.60
17 -5 -8 56.19 9.30
-17 5 8 41.10 12.80
-17 5 8 63.99 57.19
-15 -5 8 408.16 41.50
15 -5 -8 429.66 36.00
-15 -5 8 491.15 44.20
15 5 -8 471.45 45.10
15 5 -8 420.96 123.19
-15 5 8 509.55 121.69
-15 5 8 425.36 127.69
-15 5 8 491.15 43.30
13 -5 -8 1412.76 102.39
-13 -5 8 1449.65 108.49
-13 -5 8 1132.59 216.38
-13 -5 8 1431.06 106.39
-13 5 8 1399.16 234.98
-13 5 8 1363.66 209.88
13 5 -8 1517.05 111.49
13 5 -8 1297.87 206.38
-13 5 8 1408.86 107.59
-11 -5 8 202.78 24.10
-11 -5 8 224.68 22.10
11 -5 -8 245.38 21.20
-11 -5 8 165.28 75.59
11 5 -8 226.08 74.89
-11 5 8 306.57 101.69
-11 5 8 176.28 67.69
11 5 -8 190.88 24.90
-11 5 8 191.08 23.40
-11 5 8 225.08 21.60
-9 -5 8 641.54 172.38
-9 -5 8 663.63 46.20
9 -5 -8 593.34 45.70
-9 -5 8 574.74 49.10
-9 5 8 391.96 103.59
9 5 -8 465.35 112.89
9 5 -8 494.65 49.50
-9 5 8 504.75 47.70
-9 5 8 611.84 142.79
-9 5 8 607.84 44.40
7 -5 -8 576.94 46.30
-7 -5 8 608.54 138.89
7 -5 -8 508.45 46.40
-7 -5 8 585.24 48.80
-7 -5 8 512.85 44.10
-7 5 8 677.13 146.89
7 5 -8 650.53 52.19
-7 5 8 485.85 111.99
-7 5 8 645.94 49.60
7 5 -8 749.13 134.19
7 5 -8 587.84 43.50
-7 5 8 592.34 42.40
-5 -5 8 251.27 85.49
5 -5 -8 152.08 19.50
5 -5 -8 178.28 19.60
-5 -5 8 200.28 21.20
-5 -5 8 178.78 16.90
5 5 -8 215.48 69.49
-5 5 8 204.78 22.10
5 5 -8 216.68 16.90
-5 5 8 174.58 68.19
-5 5 8 230.28 71.59
5 5 -8 193.18 23.30
3 -5 -8 2277.37 158.58
-3 -5 8 2282.57 157.48
-3 -5 8 1821.32 237.78
3 -5 -8 2182.78 157.38
3 5 -8 2244.48 162.58
-3 5 8 2270.67 224.48
3 5 -8 2059.19 225.98
-3 5 8 2120.79 239.98
1 -5 -8 118.99 16.70
-1 -5 8 185.98 71.79
1 -5 -8 177.08 18.80
-1 5 8 129.79 17.30
-1 5 8 70.29 42.20
1 5 -8 158.48 12.60
1 5 -8 114.49 51.89
-1 5 8 94.59 40.40
1 -5 8 1543.25 232.48
1 -5 8 1627.74 115.69
1 5 8 1748.03 119.39
1 5 8 1910.51 176.18
1 5 8 1260.47 273.67
-1 5 -8 1871.01 193.38
-1 5 -8 1495.55 111.89
3 -5 8 914.81 65.29
3 5 8 894.01 68.69
3 5 8 768.32 99.69
-3 5 -8 1090.69 157.88
3 5 8 858.41 130.09
-3 5 -8 862.21 63.29
5 -5 8 52.89 8.90
5 5 8 86.89 28.70
5 5 8 56.09 12.40
5 5 8 53.39 21.70
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16 -6 -8 701.73 50.49
16 6 -8 582.04 58.99
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-16 6 8 528.75 152.88
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-14 -6 8 98.89 19.30
14 -6 -8 81.89 11.00
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-14 6 8 66.59 15.70
14 6 -8 144.69 65.69
14 6 -8 79.39 17.80
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12 -6 -8 1073.19 83.59
-12 -6 8 1151.98 221.78
-12 -6 8 1325.57 88.49
-12 -6 8 1097.39 89.69
-12 6 8 1476.05 254.37
-12 6 8 1022.60 88.69
12 6 -8 1116.99 91.79
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12 6 -8 1004.40 181.88
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10 -6 -8 1191.58 84.99
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10 6 -8 993.20 179.58
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10 6 -8 1056.39 90.79
-10 6 8 1262.67 84.79
10 6 -8 990.00 83.29
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8 -6 -8 103.59 14.10
-8 -6 8 113.99 18.60
-8 -6 8 111.39 13.90
8 6 -8 104.09 20.00
-8 6 8 102.19 11.40
-8 6 8 104.99 18.40
-8 6 8 146.99 72.19
-8 6 8 192.48 75.19
8 6 -8 120.39 13.40
8 6 -8 79.49 47.80
-6 -6 8 780.42 67.29
-6 -6 8 1111.49 206.58
-6 -6 8 899.81 63.99
-6 6 8 794.92 174.58
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6 6 -8 844.82 62.59
6 6 -8 1141.99 181.78
6 6 -8 880.81 71.79
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4 -6 -8 449.95 36.40
-4 -6 8 336.37 109.99
-4 -6 8 354.76 33.50
-4 -6 8 323.47 29.20
4 6 -8 491.65 113.09
-4 6 8 375.06 35.10
-4 6 8 349.57 94.99
4 6 -8 369.86 29.20
4 6 -8 357.06 37.40
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-2 -6 8 253.97 21.80
2 -6 -8 326.57 30.20
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2 6 -8 355.86 97.39
2 6 -8 265.27 22.00
2 6 -8 247.08 30.30
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0 -6 8 506.35 134.99
0 -6 8 337.47 30.60
0 6 -8 405.86 102.69
0 6 8 283.97 79.79
0 6 -8 361.76 27.90
0 6 8 583.94 130.09
2 -6 8 94.99 63.99
2 -6 8 54.69 10.00
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2 6 8 33.30 29.20
-2 6 -8 73.99 48.30
2 6 8 61.79 13.80
4 -6 8 331.37 25.70
4 -6 8 240.68 126.79
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4 6 8 286.87 66.49
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13 -7 -8 532.25 47.50
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13 7 -8 488.95 52.29
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13 7 -8 365.86 117.99
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-11 -7 8 37.60 12.50
11 -7 -8 38.20 9.40
11 7 -8 35.60 13.80
-11 7 8 37.20 9.30
-11 7 8 27.30 34.60
-11 7 8 26.80 10.60
11 7 -8 47.60 10.60
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-9 -7 8 449.95 46.40
9 7 -8 469.65 46.10
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9 7 -8 416.96 115.49
9 7 -8 449.16 38.30
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-7 -7 8 457.35 37.50
-7 -7 8 363.06 130.69
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7 7 -8 501.55 37.00
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7 7 -8 441.06 120.19
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7 7 -8 402.56 43.20
-5 -7 8 468.05 145.29
-5 -7 8 385.76 40.70
-5 -7 8 413.86 37.00
5 7 -8 677.33 147.79
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5 7 -8 512.35 47.10
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-3 -7 8 435.16 39.20
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3 7 -8 447.66 49.99
3 7 -8 331.57 100.89
3 7 -8 519.45 36.10
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-1 -7 8 38.40 9.90
-1 7 8 51.69 39.00
1 7 -8 24.70 33.00
1 7 -8 27.90 11.60
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1 7 -8 23.70 6.20
1 -7 8 247.98 23.10
1 -7 8 347.07 118.69
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1 7 8 210.68 25.90
1 7 8 357.26 96.49
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20 0 -9 1351.56 114.69
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18 0 -9 748.13 57.89
18 0 -9 560.54 139.49
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16 0 -9 601.44 51.09
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16 0 -9 552.84 47.40
16 0 -9 560.74 130.09
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14 0 -9 528.45 123.69
14 0 -9 535.15 48.90
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14 0 -9 613.64 46.10
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12 0 -9 646.94 52.29
12 0 -9 640.34 126.09
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12 0 -9 639.24 53.79
10 0 -9 2204.98 236.18
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8 0 -9 1726.53 184.58
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6 0 -9 750.92 51.69
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4 0 -9 1732.63 170.68
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2 0 -9 45.10 9.00
2 0 -9 18.80 17.10
2 0 -9 25.70 6.80
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0 0 -9 460.45 77.49
0 0 -9 545.95 38.70
0 0 9 538.45 44.00
0 0 -9 578.04 43.60
0 0 9 521.45 80.69
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2 0 9 381.96 34.00
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21 -1 -9 273.37 32.10
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21 1 -9 275.67 32.40
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19 -1 -9 903.31 184.18
19 -1 -9 809.22 70.49
19 1 -9 1033.70 187.68
19 1 -9 840.22 71.39
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17 -1 -9 915.11 73.09
17 -1 -9 886.01 76.09
17 -1 -9 752.92 167.18
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17 1 -9 944.81 78.09
17 1 -9 945.51 75.19
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17 1 -9 678.43 151.58
15 -1 -9 74.59 14.80
15 -1 -9 80.19 13.30
15 -1 -9 121.89 57.29
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15 1 -9 81.09 15.70
15 1 -9 79.69 15.10
15 1 -9 35.90 33.70
13 -1 -9 627.64 136.39
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13 -1 -9 612.64 50.99
13 -1 -9 718.93 49.80
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13 1 -9 739.23 140.49
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13 1 -9 575.64 49.90
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11 -1 -9 664.03 53.29
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11 -1 -9 928.71 158.58
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11 -1 -9 709.43 55.19
11 1 -9 625.24 125.19
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9 -1 -9 720.33 136.49
9 -1 -9 584.64 46.00
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9 1 -9 671.93 48.80
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9 1 -9 500.15 106.09
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5 -1 -9 641.84 49.99
5 -1 -9 733.53 119.89
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5 1 -9 668.73 52.59
5 1 -9 691.53 111.39
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3 -1 -9 1903.41 181.88
3 -1 -9 1893.51 128.39
3 1 -9 1861.61 175.18
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3 1 -9 1695.83 128.99
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1 -1 -9 1213.18 89.19
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1 -1 -9 1100.19 87.19
1 -1 -9 1408.66 144.59
1 -1 -9 1210.78 90.29
-1 1 9 1308.67 92.39
1 1 -9 1317.67 91.49
1 1 -9 1421.86 132.79
1 -1 9 300.37 61.79
1 -1 9 225.08 22.60
-1 -1 -9 249.68 20.60
-1 -1 -9 199.58 44.80
-1 -1 -9 238.88 22.80
1 1 9 248.98 45.50
1 1 9 261.17 25.40
-1 1 -9 236.58 22.90
-1 1 -9 179.18 44.30
1 1 9 264.77 20.00
3 -1 9 1211.98 121.39
-3 -1 -9 1233.48 93.39
3 -1 9 1305.87 96.09
-3 1 -9 1273.37 97.19
-3 1 -9 1287.47 116.89
3 1 9 1367.76 98.89
-3 1 -9 1470.05 96.49
-5 -1 -9 650.43 52.99
-5 -1 -9 655.93 50.99
5 -1 9 700.13 54.09
-5 1 -9 672.23 48.30
-5 1 -9 633.34 55.29
-5 1 -9 708.93 52.49
-7 -1 -9 80.29 11.20
-7 -1 -9 94.49 13.20
-7 -1 -9 70.39 13.50
-20 -2 9 548.65 46.30
20 -2 -9 570.24 154.88
20 -2 -9 492.85 44.60
20 -2 -9 628.34 62.69
-20 2 9 653.23 137.79
20 2 -9 505.75 51.69
-20 2 9 603.04 43.70
-18 -2 9 51.49 41.00
18 -2 -9 53.49 45.30
-18 -2 9 71.19 13.30
18 -2 -9 69.09 16.10
18 -2 -9 86.59 14.30
-18 2 9 54.69 37.90
18 2 -9 58.39 46.90
-18 2 9 81.09 11.10
-18 2 9 73.49 13.90
18 2 -9 65.89 15.90
16 -2 -9 381.86 35.10
-16 -2 9 436.46 36.70
-16 -2 9 483.15 115.59
-16 -2 9 447.56 37.20
16 -2 -9 356.66 112.59
16 -2 -9 385.96 38.80
-16 2 9 399.56 38.30
-16 2 9 406.86 99.59
-16 2 9 413.36 37.20
16 2 -9 441.46 41.30
16 2 -9 405.26 108.09
-16 2 9 452.55 35.20
-14 -2 9 891.01 75.89
-14 -2 9 961.60 73.09
14 -2 -9 893.31 176.58
14 -2 -9 950.70 75.59
-14 -2 9 1157.48 181.88
-14 -2 9 890.01 73.59
14 -2 -9 887.91 72.59
14 2 -9 1137.59 79.89
-14 2 9 1054.39 184.48
-14 2 9 962.90 75.09
-14 2 9 1077.39 73.39
14 2 -9 1157.98 78.99
14 2 -9 835.32 155.48
12 -2 -9 72.09 11.40
-12 -2 9 87.29 15.20
-12 -2 9 70.29 40.30
-12 -2 9 55.29 13.00
-12 -2 9 74.49 11.00
12 -2 -9 65.19 12.20
-12 2 9 13.00 19.10
12 2 -9 81.69 44.80
-12 2 9 91.39 13.20
-12 2 9 80.99 11.20
-12 2 9 51.09 9.90
12 2 -9 66.99 14.00
12 2 -9 49.70 11.20
10 -2 -9 1613.44 229.28
10 -2 -9 1433.96 109.69
-10 -2 9 1496.85 109.69
-10 -2 9 1512.85 111.49
-10 -2 9 1712.93 184.28
10 -2 -9 1482.95 108.99
-10 2 9 1581.64 109.09
10 2 -9 1601.84 177.68
-10 2 9 1638.04 109.79
10 2 -9 1678.03 113.89
-10 2 9 1411.66 109.29
-10 2 9 1558.64 168.68
10 2 -9 1476.25 112.39
8 -2 -9 285.07 25.60
8 -2 -9 325.97 25.90
-8 -2 9 294.57 25.90
8 -2 -9 426.26 103.49
-8 -2 9 476.65 102.39
-8 -2 9 331.37 23.00
8 2 -9 282.37 76.19
-8 2 9 264.87 23.80
-8 2 9 270.67 24.90
8 2 -9 314.47 28.80
-8 2 9 305.57 74.19
-8 2 9 264.77 26.00
8 2 -9 254.67 27.50
6 -2 -9 1667.73 109.69
6 -2 -9 1508.35 175.18
-6 -2 9 1414.36 165.88
6 2 -9 1331.97 157.28
6 2 -9 1516.85 111.99
-6 2 9 1667.23 161.38
-6 2 9 1430.86 110.09
-4 -2 9 1915.21 135.19
4 -2 -9 2018.60 200.38
4 -2 -9 2141.39 136.59
-4 -2 9 2073.29 200.58
-4 2 9 1828.52 137.19
4 2 -9 1855.61 137.89
4 2 -9 1872.91 186.18
4 2 -9 1822.62 138.09
2 -2 -9 96.89 12.50
2 -2 -9 94.89 11.20
-2 -2 9 102.59 12.10
2 -2 -9 86.29 9.70
2 -2 -9 60.19 32.00
2 2 -9 107.09 14.10
2 2 -9 144.29 44.20
-2 2 9 125.49 15.70
-2 2 9 166.88 44.50
-2 2 9 129.69 12.10
0 -2 -9 231.58 23.90
0 -2 9 226.78 63.79
0 -2 -9 255.07 21.60
0 -2 -9 249.38 21.40
0 -2 9 259.87 24.00
0 2 9 326.57 28.60
0 2 9 384.66 60.69
0 2 9 350.36 65.99
0 2 9 300.27 23.10
0 2 -9 273.87 59.59
0 2 -9 295.17 26.30
-2 -2 -9 154.98 15.50
2 -2 9 161.38 16.20
-2 -2 -9 119.79 13.40
2 -2 9 96.59 38.10
-2 -2 -9 147.79 16.60
-2 2 -9 339.87 60.79
2 2 9 275.77 45.80
-4 -2 -9 331.37 28.70
4 -2 9 334.87 28.90
4 -2 9 446.26 75.09
-4 -2 -9 318.97 28.00
4 2 9 311.37 27.10
-4 2 -9 365.16 59.59
-4 2 -9 334.27 29.70
-6 -2 -9 808.22 60.79
-6 -2 -9 882.61 61.89
-6 2 -9 779.72 60.69
-6 2 -9 754.12 54.99
-6 2 -9 732.23 54.99
-6 2 -9 759.12 69.69
-6 2 -9 853.91 78.49
19 -3 -9 158.98 23.60
-19 -3 9 155.58 20.70
-19 -3 9 348.37 108.39
19 -3 -9 197.68 89.39
19 -3 -9 186.18 19.30
19 3 -9 176.38 25.60
19 3 -9 269.77 92.69
-19 3 9 183.78 23.60
-19 3 9 211.28 18.90
-19 3 9 144.79 66.09
17 -3 -9 829.82 71.49
17 -3 -9 846.02 187.48
-17 -3 9 964.90 70.29
17 -3 -9 951.20 67.19
-17 -3 9 1061.19 187.78
17 3 -9 777.02 72.39
-17 3 9 821.62 154.38
-17 3 9 858.81 70.19
17 3 -9 791.62 163.68
15 -3 -9 33.80 10.20
-15 -3 9 34.90 37.60
-15 -3 9 63.79 14.80
-15 -3 9 26.70 8.10
-15 -3 9 34.90 8.50
15 -3 -9 20.10 27.70
15 -3 -9 49.00 9.50
-15 3 9 34.80 8.20
15 3 -9 37.60 12.00
-15 3 9 54.79 38.80
15 3 -9 37.20 29.80
-15 3 9 38.30 10.20
-15 3 9 49.60 11.70
-13 -3 9 1689.93 199.38
-13 -3 9 1518.05 109.69
13 -3 -9 1038.70 299.37
13 -3 -9 1586.14 109.69
13 -3 -9 1457.35 111.59
-13 -3 9 1636.14 112.69
-13 3 9 1550.24 111.89
13 3 -9 1578.64 186.08
13 3 -9 1341.57 114.09
-13 3 9 1534.05 111.19
-13 3 9 1597.44 110.59
-13 3 9 1310.87 170.58
13 3 -9 1553.54 115.99
11 -3 -9 1922.11 136.29
11 -3 -9 1769.12 225.58
-11 -3 9 1992.30 140.69
-11 -3 9 1799.92 214.48
11 -3 -9 2048.79 137.99
-11 -3 9 2014.80 135.79
11 3 -9 1892.11 141.49
-11 3 9 1854.31 140.69
11 3 -9 1925.31 141.59
-11 3 9 1895.31 137.49
-11 3 9 1721.43 197.88
11 3 -9 1777.62 203.98
9 -3 -9 423.86 36.30
-9 -3 9 436.86 38.40
-9 -3 9 445.46 35.30
9 -3 -9 450.05 115.59
-9 -3 9 382.06 102.49
-9 3 9 441.06 94.99
9 3 -9 508.65 42.40
-9 3 9 502.85 38.70
9 3 -9 572.04 109.59
9 3 -9 465.05 41.90
-9 3 9 466.65 38.80
-7 -3 9 2103.29 211.98
7 -3 -9 1498.85 193.18
7 -3 -9 1630.24 122.59
7 3 -9 1714.63 127.59
-7 3 9 1865.11 183.68
7 3 -9 1824.72 128.79
7 3 -9 1714.43 184.58
-7 3 9 1752.02 125.59
5 -3 -9 83.39 10.90
-5 -3 9 51.49 35.20
5 -3 -9 70.89 7.30
-5 -3 9 80.09 11.20
5 -3 -9 87.89 11.60
5 -3 -9 75.79 38.60
5 3 -9 111.69 17.60
-5 3 9 89.19 36.60
5 3 -9 134.69 48.60
-5 3 9 106.39 14.30
-5 3 9 103.59 12.20
5 3 -9 111.29 14.90
-3 -3 9 1304.67 103.19
3 -3 -9 1651.53 104.79
-3 -3 9 1094.39 179.68
3 -3 -9 1556.94 105.19
-3 3 9 1357.66 103.29
-3 3 9 1493.05 108.09
3 3 -9 1546.15 112.59
-3 3 9 1243.58 142.79
3 3 -9 1126.19 145.69
3 3 -9 1497.45 107.89
-3 3 9 1279.67 157.18
1 -3 -9 1374.46 102.19
-1 -3 9 1385.06 100.09
1 -3 -9 1359.86 100.59
1 3 -9 1163.28 142.09
-1 3 9 1333.37 136.79
-1 3 9 1254.37 148.39
-1 3 9 1412.66 105.29
1 3 -9 1516.65 104.59
-1 3 9 1465.25 100.49
1 -3 9 21.60 6.20
1 -3 9 69.09 37.30
-1 -3 -9 37.30 9.10
-1 -3 -9 21.40 6.80
1 3 9 28.00 15.30
-1 3 -9 24.50 8.00
1 3 9 19.20 6.10
-1 3 -9 23.00 20.00
1 3 9 34.50 21.60
-3 -3 -9 493.75 38.20
-3 -3 -9 420.06 36.30
-3 -3 -9 380.16 31.40
3 -3 9 417.96 34.80
3 -3 9 324.47 79.39
-3 -3 -9 398.16 31.20
3 3 9 455.75 35.50
-3 3 -9 456.75 37.90
3 3 9 507.95 47.60
3 3 9 443.06 50.09
-3 3 -9 709.13 98.79
5 -3 9 139.79 46.00
-5 -3 -9 142.29 14.20
-5 -3 -9 159.88 17.70
-5 3 -9 107.99 35.30
5 3 9 132.69 15.60
-5 3 -9 131.09 16.50
-18 -4 9 132.09 69.99
18 -4 -9 47.00 9.30
-18 -4 9 31.10 10.30
18 -4 -9 31.30 11.20
18 4 -9 94.39 57.09
-18 4 9 73.39 43.00
-18 4 9 100.09 63.29
-18 4 9 56.89 10.30
-18 4 9 42.60 13.00
18 4 -9 47.70 14.60
-16 -4 9 983.70 195.98
-16 -4 9 939.11 78.29
16 -4 -9 1140.49 74.89
16 4 -9 908.91 80.99
16 4 -9 702.03 152.88
-16 4 9 823.02 159.68
-16 4 9 1107.69 75.69
-16 4 9 896.61 77.99
-14 -4 9 1109.09 81.99
-14 -4 9 844.02 73.29
14 -4 -9 863.41 69.39
-14 -4 9 679.53 161.58
-14 -4 9 949.11 71.99
-14 4 9 931.51 72.29
-14 4 9 949.01 74.09
14 4 -9 1026.70 78.59
14 4 -9 1049.59 174.08
-14 4 9 995.10 169.78
-12 -4 9 333.87 27.70
12 -4 -9 347.07 29.00
-12 -4 9 313.07 31.50
-12 -4 9 366.46 108.29
12 -4 -9 277.97 26.20
-12 -4 9 351.66 31.10
12 4 -9 287.17 86.99
-12 4 9 283.37 28.90
12 4 -9 292.77 31.90
-12 4 9 154.28 60.19
-12 4 9 303.07 28.40
-12 4 9 247.08 26.20
-10 -4 9 745.63 151.18
10 -4 -9 557.04 43.90
-10 -4 9 593.24 43.50
-10 -4 9 568.54 46.60
10 -4 -9 600.34 44.00
-10 4 9 451.45 102.19
-10 4 9 499.55 42.40
10 4 -9 512.75 48.50
-10 4 9 524.65 49.30
10 4 -9 508.25 116.09
-8 -4 9 236.88 18.80
-8 -4 9 254.47 86.29
8 -4 -9 216.48 21.20
-8 -4 9 251.57 23.20
8 -4 -9 233.98 21.20
8 4 -9 159.98 22.70
-8 4 9 193.78 21.80
-8 4 9 170.08 66.79
-8 4 9 195.58 17.60
-8 4 9 194.98 22.40
8 4 -9 187.38 64.09
8 4 -9 198.48 24.20
-8 4 9 204.18 65.29
-6 -4 9 92.39 12.70
6 -4 -9 83.69 13.30
6 -4 -9 86.29 11.80
-6 -4 9 70.29 8.30
-6 -4 9 71.39 42.30
-6 4 9 68.29 12.30
6 4 -9 76.59 39.60
6 4 -9 97.09 16.40
6 4 -9 94.79 17.10
-6 4 9 73.59 13.90
-6 4 9 98.99 44.50
-6 4 9 95.69 48.30
4 -4 -9 696.23 58.09
-4 -4 9 750.62 58.19
-4 4 9 730.43 58.69
4 4 -9 894.51 64.59
-4 4 9 837.82 127.69
-4 4 9 748.43 142.19
4 4 -9 917.21 144.29
-4 4 9 727.53 61.59
4 4 -9 772.12 62.79
-2 -4 9 313.17 30.30
2 -4 -9 270.57 27.10
-2 -4 9 283.57 86.39
2 -4 -9 280.17 27.20
-2 4 9 338.17 88.19
2 4 -9 335.07 31.20
-2 4 9 278.97 67.39
2 4 -9 288.27 74.59
-2 4 9 304.57 27.60
0 -4 -9 1043.60 83.39
0 -4 9 1125.29 82.09
0 4 9 1182.28 140.29
0 4 9 1145.49 83.19
0 4 9 1388.36 130.79
0 4 -9 1071.19 86.09
0 4 -9 1353.36 145.49
-2 -4 -9 1627.44 125.99
2 -4 9 1761.32 123.59
2 -4 9 1831.02 205.38
2 4 9 1820.82 125.29
-2 4 -9 1507.05 174.08
-2 4 -9 1834.82 128.79
2 4 9 1682.93 155.58
4 -4 9 147.89 14.80
-4 -4 -9 156.28 18.30
4 -4 9 149.49 56.19
-4 4 -9 84.69 38.00
4 4 9 99.99 14.90
-4 4 -9 93.09 16.40
4 4 9 150.78 26.60
17 -5 -9 208.68 20.80
-17 -5 9 316.37 131.99
-17 -5 9 218.78 26.60
17 -5 -9 231.98 26.70
-17 5 9 219.98 27.30
17 5 -9 452.95 173.38
-17 5 9 360.26 103.49
-17 5 9 202.08 92.59
17 5 -9 235.28 29.70
15 -5 -9 3.10 4.20
-15 -5 9 -0.90 15.10
-15 -5 9 5.20 7.20
15 -5 -9 -1.30 3.70
-15 -5 9 5.50 5.70
15 5 -9 3.90 7.00
-15 5 9 13.40 24.10
-15 5 9 -3.40 12.10
-15 5 9 5.30 6.40
-15 5 9 2.30 5.30
-13 -5 9 1265.87 99.59
13 -5 -9 1202.08 97.29
-13 -5 9 1411.86 103.79
-13 -5 9 1434.16 242.88
13 5 -9 1095.19 195.08
13 5 -9 1511.65 107.99
-13 5 9 1503.85 100.39
-13 5 9 1300.97 102.19
-13 5 9 1359.86 100.29
-13 5 9 1213.48 228.68
-13 5 9 1267.67 201.48
-11 -5 9 978.40 71.89
11 -5 -9 1026.90 71.89
-11 -5 9 1216.88 212.18
-11 -5 9 1076.99 76.99
-11 5 9 793.62 178.08
-11 5 9 917.71 74.79
11 5 -9 888.01 77.29
-11 5 9 856.71 73.09
11 5 -9 720.83 151.18
-11 5 9 959.70 70.99
-11 5 9 826.82 153.78
-9 -5 9 73.19 10.70
9 -5 -9 103.99 15.20
-9 -5 9 98.89 55.89
9 -5 -9 74.09 12.50
-9 -5 9 96.39 16.90
-9 5 9 95.69 15.50
-9 5 9 105.79 51.79
-9 5 9 109.99 59.29
9 5 -9 123.39 66.59
-9 5 9 85.29 14.80
-9 5 9 97.09 10.50
9 5 -9 71.29 15.80
-7 -5 9 530.85 42.30
-7 -5 9 422.76 36.60
7 -5 -9 393.96 42.30
-7 -5 9 392.86 115.09
7 -5 -9 458.55 39.80
-7 5 9 467.65 105.69
-7 5 9 553.64 132.79
7 5 -9 553.24 120.59
-7 5 9 559.64 37.30
5 -5 -9 132.39 18.50
-5 -5 9 166.58 71.89
-5 -5 9 133.19 16.90
-5 -5 9 133.29 12.30
5 -5 -9 166.48 17.70
5 5 -9 85.79 17.90
-5 5 9 113.49 60.19
5 5 -9 144.09 58.59
-5 5 9 142.49 56.19
-5 5 9 122.29 16.90
3 -5 -9 562.04 45.60
-3 -5 9 507.75 129.29
-3 -5 9 497.05 42.80
3 5 -9 583.44 119.19
-3 5 9 448.36 123.49
-3 5 9 389.26 89.29
3 5 -9 572.94 49.70
-3 5 9 515.65 44.30
-1 -5 9 1081.59 195.78
-1 -5 9 1185.48 81.89
1 5 -9 909.41 156.68
-1 5 9 969.30 164.48
-1 5 9 1217.78 137.29
-1 5 9 1037.50 83.09
1 -5 9 28.50 30.40
1 -5 9 37.90 8.40
-1 -5 -9 36.90 10.20
1 5 9 40.40 10.00
-1 5 -9 39.90 32.20
1 5 9 30.90 24.80
1 5 9 47.20 30.80
3 -5 9 610.24 135.49
-3 5 -9 719.83 127.69
3 5 9 597.54 51.49
3 5 9 818.12 88.69
3 5 9 822.62 126.79
-16 -6 9 563.04 49.50
16 -6 -9 496.75 41.20
-16 6 9 338.47 108.29
-16 6 9 496.25 48.50
16 6 -9 528.75 51.69
-16 6 9 383.76 132.59
-14 -6 9 714.13 60.09
-14 -6 9 1226.68 227.88
14 -6 -9 734.53 54.09
-14 6 9 679.53 56.09
14 6 -9 624.74 61.29
-14 6 9 690.13 147.49
14 6 -9 999.00 181.18
-14 6 9 574.24 156.58
-14 6 9 641.74 59.09
-12 -6 9 164.98 79.09
-12 -6 9 105.39 19.30
-12 6 9 102.79 56.49
-12 6 9 123.89 15.20
-12 6 9 86.79 65.69
-12 6 9 161.08 24.00
12 6 -9 112.39 62.59
12 6 -9 125.39 23.40
-10 -6 9 805.52 187.08
-10 -6 9 839.62 71.89
-10 -6 9 980.50 69.19
10 6 -9 838.12 166.18
-10 6 9 888.21 72.49
-10 6 9 901.71 66.09
10 6 -9 890.31 75.19
-10 6 9 795.72 181.58
-10 6 9 592.34 143.79
-8 -6 9 102.49 14.40
-8 -6 9 121.89 20.60
-8 -6 9 170.48 81.49
8 -6 -9 114.19 16.60
8 6 -9 157.08 14.80
-8 6 9 145.69 19.60
8 6 -9 106.59 55.59
-8 6 9 127.49 58.09
-8 6 9 148.09 12.40
8 6 -9 127.79 22.70
-6 -6 9 326.67 32.40
-6 -6 9 467.85 135.59
6 6 -9 365.36 28.50
6 6 -9 347.87 37.50
-6 6 9 397.06 123.49
-6 6 9 368.66 35.20
6 6 -9 337.87 98.49
-6 6 9 399.16 105.09
-4 -6 9 381.66 119.59
-4 -6 9 349.37 29.30
-4 -6 9 324.37 33.60
4 6 -9 420.86 29.70
4 6 -9 780.02 149.69
-4 6 9 417.46 101.69
-4 6 9 503.95 127.69
4 6 -9 422.46 40.70
-2 -6 9 -1.00 12.80
-2 -6 9 18.90 7.40
-2 6 9 25.00 30.50
2 6 -9 13.60 25.50
2 6 -9 7.10 7.50
-2 6 9 5.50 5.90
2 6 -9 13.50 3.70
0 -6 9 835.22 180.28
0 -6 9 897.71 72.39
0 6 -9 889.11 163.48
0 6 9 1006.50 76.59
0 6 -9 1023.10 67.99
0 6 9 988.40 200.48
2 -6 9 606.94 148.49
2 -6 9 540.05 40.70
2 6 9 391.86 85.99
2 6 9 457.75 43.30
-2 6 -9 454.55 111.79
-11 -7 9 118.09 21.20
-11 -7 9 179.38 19.90
-11 -7 9 100.29 77.49
-11 7 9 133.29 22.40
-11 7 9 100.79 64.09
11 7 -9 110.09 22.40
-11 7 9 145.79 16.00
11 7 -9 160.78 84.09
-11 7 9 56.69 47.50
-9 -7 9 87.89 17.80
-9 -7 9 287.77 122.99
-9 -7 9 103.49 14.20
9 7 -9 100.49 21.70
-9 7 9 26.60 39.90
-9 7 9 52.89 45.30
9 7 -9 82.59 52.69
9 7 -9 98.19 13.00
-9 7 9 70.69 15.80
-9 7 9 112.19 11.60
-7 -7 9 1218.58 96.19
-7 -7 9 1816.62 297.57
-7 -7 9 1347.57 102.19
-7 7 9 1314.67 103.69
7 7 -9 1349.07 218.78
7 7 -9 1341.57 95.79
-7 7 9 1494.45 228.38
7 7 -9 1410.86 107.39
-7 7 9 2210.08 455.85
-5 -7 9 139.79 14.80
-5 -7 9 141.19 19.00
-5 -7 9 89.49 77.19
5 7 -9 159.38 71.49
5 7 -9 129.29 24.90
-5 7 9 138.79 66.49
-5 7 9 115.39 22.60
5 7 -9 146.19 14.80
-3 -7 9 424.96 35.10
-3 -7 9 430.06 139.49
-3 -7 9 416.36 39.70
-3 7 9 516.05 119.69
3 7 -9 449.56 46.50
3 7 -9 494.45 35.70
-3 7 9 494.75 43.60
3 7 -9 406.26 115.59
-20 0 10 1479.95 214.98
20 0 -10 1628.84 252.97
20 0 -10 1020.80 98.39
-20 0 10 1223.68 86.89
18 0 -10 678.63 57.99
-18 0 10 759.02 146.09
18 0 -10 703.73 61.39
-18 0 10 730.83 55.59
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16 0 -10 174.08 79.19
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16 0 -10 102.59 19.10
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14 0 -10 845.42 66.29
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14 0 -10 692.03 147.89
14 0 -10 713.73 62.69
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12 0 -10 499.15 40.20
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12 0 -10 431.56 107.49
12 0 -10 421.66 39.90
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8 0 -10 3467.45 330.07
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6 0 -10 155.28 18.50
6 0 -10 161.68 56.19
6 0 -10 178.38 19.00
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2 0 -10 351.16 31.70
2 0 -10 358.06 31.80
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0 0 10 9.80 11.30
0 0 -10 13.40 13.90
0 0 -10 10.30 4.70
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21 -1 -10 709.83 63.79
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17 -1 -10 280.17 100.09
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17 -1 -10 292.17 32.70
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17 -1 -10 303.67 30.30
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11 -1 -10 3240.68 295.27
11 -1 -10 2593.04 188.78
11 -1 -10 2839.22 190.48
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9 -1 -10 1085.49 175.28
9 -1 -10 1156.78 85.89
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7 -1 -10 2160.68 221.78
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5 1 -10 1710.33 122.79
5 1 -10 1555.14 172.28
5 1 -10 1830.72 123.69
3 -1 -10 209.18 19.20
3 -1 -10 227.28 61.29
3 -1 -10 218.18 20.70
3 -1 -10 195.98 16.80
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3 1 -10 203.08 21.20
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3 1 -10 229.38 22.20
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1 -1 -10 695.83 52.69
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1 -1 -10 668.13 56.09
1 -1 -10 718.03 55.29
1 -1 -10 913.21 101.39
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1 1 -10 709.83 57.09
1 1 -10 690.73 108.59
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-1 -1 -10 32.70 5.90
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-1 1 -10 13.00 5.70
1 1 10 14.20 7.00
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3 -1 10 799.82 61.39
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5 -1 10 534.85 45.30
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20 -2 -10 204.58 30.50
20 -2 -10 199.78 23.30
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18 -2 -10 766.92 58.79
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16 -2 -10 5.00 5.50
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16 -2 -10 41.40 33.80
16 -2 -10 5.30 4.40
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14 -2 -10 1676.43 123.69
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-12 -2 10 2096.09 142.09
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8 -2 -10 912.21 164.28
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17 -3 -10 1105.69 91.89
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3 5 -10 49.20 36.60
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1 5 10 472.45 39.70
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14 6 -10 295.87 34.80
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-12 -6 10 230.58 24.50
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12 6 -10 264.77 31.80
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-10 6 10 784.62 181.88
10 6 -10 479.85 121.19
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-8 -6 10 1039.70 87.39
8 6 -10 1138.49 195.48
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6 6 -10 43.90 14.70
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4 6 -10 257.07 33.40
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2 6 -10 186.78 26.50
2 6 -10 138.69 60.49
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0 -6 10 72.59 56.79
0 -6 10 57.79 11.80
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10 0 -11 45.70 10.80
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0 0 -11 113.69 38.00
0 0 -11 174.08 18.30
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11 -1 -11 364.16 35.20
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-9 -1 11 438.66 36.00
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9 -1 -11 342.37 95.99
9 -1 -11 434.96 36.70
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5 -1 -11 1354.36 168.18
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5 1 -11 1621.34 172.68
3 -1 -11 605.94 43.60
3 -1 -11 543.35 102.69
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3 1 -11 482.25 44.50
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3 1 -11 524.75 45.50
1 -1 -11 315.07 69.49
1 -1 -11 329.67 27.50
1 -1 -11 324.57 26.50
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1 -1 -11 324.07 24.20
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1 1 -11 272.37 29.50
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20 -2 -11 10.10 24.40
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20 -2 -11 -1.00 4.90
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18 -2 -11 416.86 42.30
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16 -2 -11 322.97 109.89
16 -2 -11 352.76 35.00
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12 -2 -11 2602.54 283.97
12 -2 -11 2236.38 172.68
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8 -2 -11 1791.92 132.79
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4 -2 -11 245.28 23.40
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0 -2 -11 74.19 9.70
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19 -3 -11 243.88 31.70
19 -3 -11 302.47 29.40
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19 3 -11 350.16 110.09
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17 -3 -11 81.39 15.90
17 -3 -11 95.89 15.10
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15 -3 -11 824.82 65.99
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15 -3 -11 707.23 62.59
15 -3 -11 822.22 183.88
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13 -3 -11 93.09 14.40
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13 3 -11 61.19 15.40
11 -3 -11 1656.73 132.49
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11 -3 -11 1436.26 252.67
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11 3 -11 2132.99 222.48
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9 -3 -11 1559.04 118.49
9 -3 -11 1315.37 229.88
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9 3 -11 1940.11 201.18
-9 3 11 1655.33 120.99
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7 -3 -11 46.00 6.40
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7 -3 -11 28.90 7.90
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5 -3 -11 610.74 48.70
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1 -3 -11 253.47 23.80
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-1 -3 11 237.88 24.00
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-1 3 11 256.57 23.00
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1 3 -11 240.08 64.09
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1 -3 11 635.74 119.89
1 -3 11 601.14 46.60
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13 -5 -11 12.30 5.40
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8 6 -12 77.79 20.20
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20 0 -13 490.35 143.89
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20 0 -13 556.54 49.80
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18 0 -13 70.39 59.99
-18 0 13 46.20 10.80
18 0 -13 57.99 15.60
16 0 -13 1204.08 93.69
-16 0 13 1153.08 86.79
16 0 -13 936.51 196.58
-16 0 13 1121.39 189.78
-16 0 13 1178.98 88.49
-14 0 13 1381.76 104.29
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14 0 -13 2044.00 230.88
14 0 -13 1392.66 108.09
-14 0 13 1368.76 209.18
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12 0 -13 810.12 65.69
12 0 -13 929.21 175.68
-12 0 13 776.52 62.89
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10 0 -13 1182.68 91.99
10 0 -13 1145.29 192.78
-10 0 13 1216.78 90.79
-10 0 13 1385.36 162.38
-10 0 13 1201.78 85.89
-8 0 13 127.69 17.30
8 0 -13 158.78 18.80
-8 0 13 140.29 56.19
8 0 -13 97.89 47.00
-6 0 13 4.30 5.30
6 0 -13 -1.00 7.60
6 0 -13 8.90 6.20
-4 0 13 350.66 35.60
4 0 -13 347.17 86.79
4 0 -13 452.65 37.10
-2 0 13 4.50 10.90
-2 0 13 -1.60 4.20
2 0 -13 -0.30 4.30
2 0 -13 -1.90 8.00
0 0 -13 411.56 37.30
0 0 13 478.15 81.89
0 0 13 392.46 39.40
0 0 -13 470.55 39.40
19 -1 -13 146.19 84.09
19 -1 -13 269.87 33.20
-19 -1 13 291.37 29.90
-19 -1 13 236.78 90.19
-19 1 13 448.66 117.29
19 1 -13 343.27 37.10
-19 1 13 351.66 31.30
-19 1 13 282.67 30.00
17 -1 -13 505.95 147.89
-17 -1 13 517.75 130.09
-17 -1 13 555.24 46.00
17 -1 -13 487.35 48.90
-17 1 13 637.94 49.00
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17 1 -13 538.55 50.99
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17 1 -13 521.55 145.09
15 -1 -13 50.69 13.40
-15 -1 13 61.59 13.50
-15 -1 13 44.60 38.00
-15 -1 13 56.99 11.90
15 -1 -13 53.79 52.99
-15 -1 13 49.90 9.50
-15 1 13 40.70 13.10
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-15 1 13 66.59 13.80
15 1 -13 73.29 17.00
15 1 -13 78.39 48.60
-13 -1 13 618.54 45.10
-13 -1 13 664.33 46.00
13 -1 -13 658.63 157.38
13 -1 -13 545.05 50.19
-13 -1 13 612.14 49.10
-13 -1 13 613.24 50.59
-13 -1 13 850.31 157.78
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11 -1 -13 23.70 8.50
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11 -1 -13 27.30 31.70
-11 -1 13 10.50 16.20
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-11 1 13 28.90 9.50
11 1 -13 20.40 8.70
11 1 -13 4.20 14.60
-11 1 13 51.29 36.70
9 -1 -13 309.37 107.59
-9 -1 13 341.27 29.30
-9 -1 13 295.67 22.50
-9 -1 13 278.37 22.10
9 -1 -13 290.27 28.40
9 1 -13 268.17 85.39
-9 1 13 302.97 25.40
9 1 -13 272.27 29.80
-9 1 13 310.27 29.60
-9 1 13 347.77 88.09
-7 -1 13 428.26 40.50
-7 -1 13 536.55 113.79
7 -1 -13 473.85 115.09
7 -1 -13 443.96 40.20
7 1 -13 546.25 116.89
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5 -1 -13 19.70 23.40
5 -1 -13 16.50 6.10
-5 -1 13 0.00 9.10
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5 1 -13 15.80 7.50
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5 1 -13 32.90 25.90
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3 -1 -13 494.45 39.00
-3 -1 13 402.36 39.10
3 -1 -13 583.34 110.49
-3 -1 13 462.45 99.29
-3 1 13 454.25 33.00
3 1 -13 462.85 41.50
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1 -1 -13 327.87 30.20
-1 -1 13 326.97 32.20
1 -1 -13 330.77 29.40
-1 -1 13 328.87 80.99
1 1 -13 250.97 64.49
-1 1 13 354.06 35.10
1 1 -13 356.36 34.20
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18 -2 -13 -3.00 16.40
-18 -2 13 22.40 8.00
18 -2 -13 20.30 9.40
-18 -2 13 22.60 35.90
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18 2 -13 39.50 44.50
18 2 -13 25.50 11.30
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16 -2 -13 437.36 42.40
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16 2 -13 463.75 45.90
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14 -2 -13 701.63 53.19
14 -2 -13 784.22 178.58
-14 -2 13 553.44 48.90
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14 2 -13 689.33 150.38
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14 2 -13 541.95 52.99
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-12 -2 13 131.59 13.00
-12 -2 13 140.09 66.09
-12 -2 13 139.39 17.70
12 -2 -13 147.59 18.20
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12 2 -13 129.89 22.60
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10 -2 -13 975.80 70.59
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-10 -2 13 719.83 152.68
10 -2 -13 1153.88 202.18
-10 -2 13 837.42 63.99
-10 2 13 916.41 68.79
-10 2 13 950.20 72.79
10 2 -13 1126.19 183.68
-10 2 13 1203.28 173.28
10 2 -13 950.90 75.09
8 -2 -13 227.88 21.90
8 -2 -13 299.97 96.39
-8 -2 13 258.27 80.69
-8 -2 13 239.18 23.80
8 2 -13 217.08 26.00
8 2 -13 161.28 64.69
-8 2 13 213.98 24.80
-8 2 13 145.09 51.59
-8 2 13 218.38 21.00
-6 -2 13 533.65 120.99
6 -2 -13 578.84 44.80
6 -2 -13 507.55 116.69
-6 -2 13 489.65 46.20
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6 2 -13 620.44 120.49
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6 2 -13 619.84 51.49
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4 -2 -13 657.63 50.99
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4 2 -13 639.84 57.29
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4 2 -13 451.35 101.99
2 -2 -13 13.80 4.40
-2 -2 13 -2.10 9.80
-2 -2 13 11.10 6.30
2 -2 -13 17.50 5.00
2 -2 -13 19.50 5.50
2 2 -13 20.30 9.60
-2 2 13 22.50 12.80
-2 2 13 -1.40 6.60
-2 2 13 14.40 4.30
2 2 -13 0.80 10.10
17 -3 -13 357.66 125.89
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-17 -3 13 479.95 39.30
17 -3 -13 404.16 39.30
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17 3 -13 558.94 143.99
-17 3 13 327.87 99.69
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17 3 -13 343.57 41.30
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-15 -3 13 210.08 20.40
15 -3 -13 210.18 97.29
15 -3 -13 265.87 26.20
15 3 -13 211.88 28.10
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-15 3 13 187.18 23.50
-15 3 13 206.58 23.40
-15 3 13 187.58 21.70
15 3 -13 133.59 70.59
-13 -3 13 285.17 27.60
13 -3 -13 416.06 122.29
-13 -3 13 292.37 103.79
-13 3 13 228.48 25.50
13 3 -13 458.75 117.79
-13 3 13 265.97 24.50
13 3 -13 252.57 30.70
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-11 -3 13 248.18 27.30
11 -3 -13 241.78 24.90
-11 -3 13 252.47 21.90
-11 -3 13 422.56 119.19
11 -3 -13 383.16 116.79
11 3 -13 299.37 91.79
-11 3 13 326.97 28.10
11 3 -13 326.77 33.20
-11 3 13 305.17 83.49
-11 3 13 320.77 30.60
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9 -3 -13 243.78 21.50
-9 -3 13 246.98 25.10
9 -3 -13 174.88 77.89
-9 3 13 219.08 26.70
-9 3 13 238.08 23.80
9 3 -13 306.77 85.39
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9 3 -13 223.18 27.90
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7 -3 -13 1280.77 92.79
7 -3 -13 1429.46 221.68
7 3 -13 1341.47 103.89
-7 3 13 1421.66 161.08
-7 3 13 1304.97 96.89
-7 3 13 1430.86 103.89
7 3 -13 1217.48 188.48
5 -3 -13 8.00 4.50
-5 -3 13 4.20 16.90
-5 -3 13 1.50 5.10
5 3 -13 2.50 6.60
-5 3 13 5.00 4.10
5 3 -13 1.50 10.70
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3 -3 -13 517.05 43.50
3 3 -13 579.24 51.99
-3 3 13 590.74 52.29
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-3 3 13 610.84 99.89
3 3 -13 531.75 108.79
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16 -4 -13 270.97 31.00
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-16 -4 13 341.77 32.70
16 -4 -13 241.28 111.59
16 4 -13 364.26 40.00
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16 4 -13 287.57 103.59
14 -4 -13 173.28 88.99
-14 -4 13 182.68 19.80
-14 -4 13 209.38 24.60
-14 -4 13 110.49 68.49
14 -4 -13 177.78 21.60
-14 4 13 221.48 24.80
-14 4 13 279.07 100.89
-14 4 13 236.78 22.00
14 4 -13 307.17 96.69
-14 4 13 242.98 26.60
14 4 -13 227.38 29.30
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12 -4 -13 105.69 12.50
12 4 -13 82.99 26.70
12 4 -13 75.09 47.00
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-12 4 13 56.99 13.50
-12 4 13 56.69 42.70
-10 -4 13 414.06 30.10
-10 -4 13 394.06 118.19
-10 -4 13 399.46 41.50
10 4 -13 419.46 42.40
-10 4 13 386.86 101.09
10 4 -13 445.76 114.99
-10 4 13 397.46 40.60
-8 -4 13 137.99 18.80
-8 -4 13 121.49 71.09
-8 4 13 163.18 29.60
8 4 -13 215.98 75.99
8 4 -13 171.68 27.20
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-8 4 13 124.89 17.20
6 -4 -13 482.55 46.30
-6 -4 13 524.15 44.30
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-6 4 13 521.95 49.40
6 4 -13 501.65 49.99
6 4 -13 600.54 125.59
4 -4 -13 371.46 36.80
-4 -4 13 650.23 143.29
-4 -4 13 349.67 34.20
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-4 4 13 430.16 34.30
4 4 -13 331.87 91.99
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-13 -5 13 852.91 65.29
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-11 -5 13 772.92 184.18
-11 -5 13 870.61 70.49
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9 5 -13 142.29 25.40
9 5 -13 145.99 68.99
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18 0 -14 432.66 139.19
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16 0 -14 165.68 23.60
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16 0 -14 134.09 77.39
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14 0 -14 398.96 43.00
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12 0 -14 80.39 16.00
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-10 0 14 571.14 47.70
10 0 -14 579.94 49.00
-10 0 14 527.75 41.40
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-8 0 14 206.58 23.00
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8 0 -14 181.08 24.70
8 0 -14 164.98 67.49
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6 0 -14 30.30 31.40
4 0 -14 546.25 114.39
4 0 -14 600.14 50.29
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2 0 -14 416.36 38.20
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-19 -1 14 -5.40 14.80
19 -1 -14 20.20 10.30
19 -1 -14 26.80 45.10
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19 1 -14 -4.60 25.00
19 1 -14 32.60 13.90
-19 1 14 47.50 42.80
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17 -1 -14 924.81 78.89
-17 -1 14 1209.08 209.98
17 -1 -14 968.40 214.98
-17 -1 14 1048.60 73.19
17 1 -14 1001.80 198.28
17 1 -14 856.61 79.09
-17 1 14 886.71 74.69
-17 1 14 732.03 156.28
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15 -1 -14 402.76 129.79
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15 -1 -14 271.47 30.10
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-15 1 14 243.88 25.30
15 1 -14 245.78 30.40
15 1 -14 326.37 101.99
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13 -1 -14 127.39 66.49
-13 -1 14 181.58 69.79
13 -1 -14 160.08 21.00
-13 -1 14 157.58 16.10
-13 1 14 153.38 17.30
-13 1 14 281.47 85.59
-13 1 14 193.48 21.90
13 1 -14 148.89 25.10
13 1 -14 178.68 75.69
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-11 -1 14 336.67 24.50
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-11 -1 14 301.97 24.70
11 -1 -14 150.98 74.29
11 1 -14 307.57 32.90
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-11 1 14 296.47 30.70
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9 -1 -14 40.30 35.50
9 -1 -14 26.70 8.70
-9 -1 14 27.40 9.30
-9 -1 14 8.80 18.30
-9 1 14 33.90 6.90
9 1 -14 5.40 18.70
-9 1 14 27.10 25.90
-9 1 14 38.60 10.60
9 1 -14 34.40 10.50
7 -1 -14 269.07 87.09
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7 -1 -14 300.27 28.80
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5 -1 -14 432.26 105.29
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5 -1 -14 437.16 34.90
5 1 -14 455.75 102.19
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-5 1 14 367.96 43.00
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5 1 -14 393.66 37.20
3 -1 -14 23.00 7.90
3 -1 -14 23.50 6.80
3 -1 -14 13.40 17.70
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3 1 -14 20.20 9.00
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3 1 -14 30.30 26.20
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18 -2 -14 324.47 36.10
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18 -2 -14 415.36 142.19
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18 2 -14 339.37 112.39
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18 2 -14 449.56 43.40
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-16 -2 14 70.99 11.90
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16 -2 -14 79.19 16.10
16 -2 -14 55.69 55.59
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16 2 -14 97.09 63.59
-16 2 14 72.79 14.20
-16 2 14 94.79 15.90
16 2 -14 65.79 16.50
14 -2 -14 1010.30 76.09
14 -2 -14 1039.70 209.98
-14 -2 14 970.60 68.99
-14 -2 14 944.21 183.88
-14 -2 14 966.00 87.29
-14 -2 14 935.71 69.19
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-14 2 14 854.81 71.59
-14 2 14 885.91 163.08
-14 2 14 967.50 75.29
14 2 -14 952.60 79.19
14 2 -14 931.81 182.18
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-12 -2 14 220.58 82.69
-12 -2 14 204.18 18.20
12 -2 -14 162.18 79.39
-12 -2 14 194.88 23.90
12 -2 -14 266.17 25.60
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-12 2 14 249.38 26.30
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12 2 -14 145.89 69.49
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-10 -2 14 511.05 43.60
10 -2 -14 619.84 149.59
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10 2 -14 534.05 47.60
-10 2 14 471.55 40.40
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-8 -2 14 500.75 43.20
8 -2 -14 472.95 40.70
-8 -2 14 509.45 120.69
8 -2 -14 471.95 122.09
-8 2 14 754.92 128.79
8 2 -14 528.45 47.10
-8 2 14 495.25 39.40
6 -2 -14 81.99 11.20
6 -2 -14 94.39 49.70
-6 -2 14 42.60 41.90
-6 -2 14 67.09 13.20
-6 2 14 92.79 43.60
6 2 -14 71.09 43.50
-6 2 14 57.29 14.10
-6 2 14 77.49 9.60
6 2 -14 93.79 18.40
4 -2 -14 645.54 46.00
4 -2 -14 663.23 47.40
-4 -2 14 855.61 152.58
-4 -2 14 569.34 54.69
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4 2 -14 602.74 54.39
4 2 -14 414.46 100.79
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17 -3 -14 308.67 32.70
-17 -3 14 313.57 31.80
17 -3 -14 163.48 94.19
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-17 3 14 279.17 30.80
17 3 -14 366.96 39.60
-17 3 14 373.16 106.39
-17 3 14 344.97 31.70
17 3 -14 294.67 105.59
15 -3 -14 230.58 24.30
-15 -3 14 101.09 63.69
15 -3 -14 308.97 119.69
-15 -3 14 184.78 18.80
15 3 -14 191.18 27.30
-15 3 14 110.49 70.49
-15 3 14 187.98 30.40
-15 3 14 192.08 21.00
15 3 -14 250.47 95.19
-15 3 14 182.38 22.10
13 -3 -14 279.77 26.50
13 -3 -14 308.77 110.29
-13 -3 14 292.37 22.50
-13 -3 14 245.78 27.60
-13 -3 14 399.96 118.59
-13 3 14 227.68 23.90
13 3 -14 334.07 119.79
-13 3 14 283.97 27.60
13 3 -14 218.08 30.10
-13 3 14 107.89 59.69
-11 -3 14 661.73 153.38
-11 -3 14 661.53 54.39
11 -3 -14 695.83 167.28
-11 -3 14 656.53 46.10
-11 -3 14 594.84 45.80
11 -3 -14 672.03 51.29
11 3 -14 739.33 149.88
-11 3 14 651.33 52.89
11 3 -14 710.43 59.99
-11 3 14 655.63 60.19
-11 3 14 627.74 126.99
-9 -3 14 192.58 79.89
-9 -3 14 183.28 23.90
9 -3 -14 165.78 77.49
9 -3 -14 163.68 15.90
9 3 -14 226.68 80.29
-9 3 14 168.48 18.60
9 3 -14 117.89 22.10
-9 3 14 163.38 60.39
-9 3 14 159.88 22.50
-7 -3 14 292.27 36.20
-7 -3 14 312.47 100.99
-7 3 14 310.87 34.70
7 3 -14 441.56 106.19
7 3 -14 362.66 36.70
-5 -3 14 126.39 21.80
5 3 -14 143.89 62.49
-5 3 14 193.28 59.59
5 3 -14 182.68 24.50
-5 3 14 165.48 16.60
-5 3 14 153.08 25.10
-14 -4 14 287.67 109.29
-14 -4 14 319.87 29.10
-14 -4 14 361.36 35.70
14 4 -14 304.37 105.59
-14 4 14 305.17 33.60
-14 4 14 400.56 31.80
14 4 -14 373.56 41.30
-14 4 14 273.47 88.29
-14 4 14 375.76 38.10
-12 -4 14 178.18 15.00
-12 -4 14 150.38 75.69
-12 -4 14 143.99 20.80
12 -4 -14 143.59 16.40
-12 4 14 213.28 74.29
-12 4 14 161.58 20.50
12 4 -14 131.39 24.50
12 4 -14 174.98 73.49
-12 4 14 224.58 26.70
-10 -4 14 301.07 105.09
-10 -4 14 299.97 30.60
10 4 -14 224.48 84.79
-10 4 14 260.37 28.50
-10 4 14 359.86 96.39
-10 4 14 292.47 34.20
10 4 -14 326.47 36.10
-8 -4 14 433.26 38.90
-8 -4 14 420.86 121.59
8 4 -14 536.35 47.30
8 4 -14 383.36 107.19
-8 4 14 351.36 35.80
-8 4 14 442.36 101.59
-16 0 15 357.26 107.49
16 0 -15 359.26 124.09
16 0 -15 304.47 36.80
-16 0 15 439.26 34.20
-16 0 15 352.76 35.60
-14 0 15 202.58 24.90
14 0 -15 209.28 27.00
14 0 -15 293.97 101.99
-14 0 15 258.97 22.70
-14 0 15 116.49 62.09
12 0 -15 448.46 122.99
-12 0 15 483.95 119.79
12 0 -15 418.76 39.30
-12 0 15 387.36 31.90
-12 0 15 380.16 37.20
-10 0 15 37.00 30.90
10 0 -15 12.10 20.70
-10 0 15 4.30 2.60
10 0 -15 5.30 5.90
-10 0 15 4.40 6.10
8 0 -15 248.38 26.10
-8 0 15 202.78 25.00
-8 0 15 217.68 73.59
8 0 -15 308.37 94.09
6 0 -15 274.47 27.40
6 0 -15 243.88 76.09
-6 0 15 211.18 26.30
-6 0 15 276.67 76.79
-17 -1 15 356.56 36.60
-17 -1 15 266.47 99.09
17 -1 -15 302.67 119.19
17 -1 -15 286.17 35.10
-17 -1 15 362.46 34.50
-17 -1 15 325.47 30.40
-17 1 15 374.46 35.20
17 1 -15 197.58 87.59
-17 1 15 222.48 86.89
-15 -1 15 710.73 56.09
-15 -1 15 850.71 58.09
15 -1 -15 755.12 64.29
15 1 -15 671.53 64.59
-15 1 15 704.43 145.49
-15 1 15 695.73 61.49
-15 1 15 804.22 59.79
15 1 -15 877.41 178.68
13 -1 -15 50.99 13.10
-13 -1 15 45.70 8.40
-13 -1 15 81.69 53.69
13 -1 -15 77.19 53.49
-13 -1 15 49.40 8.20
-13 -1 15 37.00 10.70
-13 1 15 107.49 53.39
13 1 -15 48.60 39.70
-13 1 15 72.39 15.30
13 1 -15 53.39 14.70
-13 1 15 62.39 11.10
-11 -1 15 313.57 23.30
11 -1 -15 309.17 102.19
11 -1 -15 318.97 31.60
-11 -1 15 268.07 30.20
-11 -1 15 394.16 109.69
11 1 -15 390.86 36.20
-11 1 15 281.97 31.20
11 1 -15 336.97 104.19
-11 1 15 312.27 26.90
-11 1 15 327.07 91.59
9 -1 -15 248.58 89.99
-9 -1 15 347.37 33.30
9 -1 -15 382.26 33.20
-9 -1 15 363.46 98.29
9 1 -15 440.56 114.29
-9 1 15 284.57 84.79
9 1 -15 340.47 34.60
-9 1 15 307.07 26.20
-9 1 15 315.37 33.30
7 -1 -15 57.29 11.80
-7 -1 15 36.80 11.70
7 -1 -15 70.19 48.40
-7 1 15 12.30 20.90
-7 1 15 64.59 10.30
7 1 -15 67.39 14.90
7 1 -15 15.70 24.50
-7 1 15 52.39 13.20
-16 -2 15 14.70 6.20
-16 -2 15 35.50 39.80
-16 -2 15 22.80 6.50
-16 -2 15 23.40 9.90
16 -2 -15 3.40 20.10
16 -2 -15 4.90 6.40
-16 2 15 13.30 7.10
-16 2 15 21.60 10.60
-16 2 15 13.60 24.30
16 2 -15 5.60 20.50
-16 2 15 10.20 6.50
16 2 -15 22.00 11.60
-14 -2 15 306.67 22.70
14 -2 -15 329.47 122.29
-14 -2 15 275.67 23.30
14 -2 -15 261.27 28.30
-14 -2 15 156.58 78.09
14 2 -15 197.78 29.30
-14 2 15 241.68 28.80
-14 2 15 212.98 24.80
14 2 -15 305.47 123.79
-14 2 15 233.98 81.89
-12 -2 15 620.54 148.29
12 -2 -15 595.54 154.38
-12 -2 15 464.75 41.10
12 -2 -15 461.35 40.60
-12 2 15 292.57 91.79
-12 2 15 498.75 43.50
12 2 -15 405.26 43.40
-12 2 15 420.56 37.60
12 2 -15 326.67 104.49
10 -2 -15 34.00 9.30
-10 -2 15 31.50 34.00
-10 -2 15 23.80 8.40
10 2 -15 71.29 49.20
-10 2 15 19.30 22.90
-10 2 15 48.30 13.70
10 2 -15 25.00 10.10
-10 2 15 25.90 7.40
8 -2 -15 328.57 102.59
-8 -2 15 361.96 103.99
-8 -2 15 336.77 34.10
8 -2 -15 324.67 30.90
8 2 -15 384.06 38.00
-8 2 15 407.16 38.20
8 2 -15 397.36 108.89
-8 2 15 356.26 29.30
-13 -3 15 91.19 9.80
-13 -3 15 95.09 17.90
-13 -3 15 98.69 10.10
13 -3 -15 68.29 13.10
-13 3 15 127.19 21.30
13 3 -15 98.99 22.10
-13 3 15 78.69 14.70
11 -3 -15 194.48 98.09
-11 -3 15 456.35 41.00
-11 -3 15 360.96 119.09
11 3 -15 451.65 45.40
11 3 -15 348.77 105.39
-11 3 15 411.16 103.69
-11 3 15 422.76 37.90
-11 3 15 440.66 43.40
0 0 0 0.00 0.00
_computing_structure_solution 'SHELXT 2018/2 (Sheldrick, 2018)'
;
_shelx_hkl_checksum 10538
_shelx_res_file
;
TITL yoshizawa241122ZnSTImi_2_0m_a.res in C2
yoshizawa241122ZnSTImi_2_0m_a.res
created by SHELXL-2019/1 at 11:09:51 on 11-Feb-2025
REM Old TITL yoshizawa241122ZnSTImi_2_0m in C2
REM SHELXT solution in C2: R1 0.063, Rweak 0.035, Alpha 0.007
REM 0.000 for 0 systematic absences, Orientation as input
REM Flack x = 0.166 ( 0.010 ) from 1216 Parsons' quotients
REM Formula found by SHELXT: C15 O7 Zn
CELL 0.71073 18.3835 7.7141 13.3800 90.000 123.787 90.000
ZERR 4.000 0.0007 0.0003 0.0005 0.000 0.001 0.000
LATT -7
SYMM -X, Y, -Z
SFAC C H N O ZN
UNIT 56 68 12 20 4
TEMP -100
L.S. 10
BOND
LIST 4
SIZE 0.1 0.1 0.1
ACTA 50
HTAB
FMAP 2
PLAN 20
EQIV $1 -x+1, y, -z
HTAB O5 O1_$1
EQIV $2 x, y+1, z
HTAB N3 O1_$2
EQIV $3 -x+3/2, y-1/2, -z
HTAB O4 O2_$3
EQIV $4 x-1/2, y-1/2, z
HTAB C2 O3_$4
EQIV $5 x-1/2, y+1/2, z
HTAB C13 O3_$5
HTAB C14 O2
HTAB O5 O3_$3
WGHT 0.036400
FVAR 0.69688
ZN01 5 0.654377 0.427588 0.118985 11.00000 0.01444 0.01485 =
0.01974 0.00248 0.00884 -0.00040
O1 4 0.596028 0.298410 0.191573 11.00000 0.01655 0.01722 =
0.01779 -0.00053 0.00905 -0.00244
O2 4 0.741529 0.537030 0.079948 11.00000 0.01706 0.04307 =
0.03497 0.01928 0.01329 0.00219
O3 4 0.883368 0.563444 0.153274 11.00000 0.02155 0.04526 =
0.04864 0.01755 0.01841 -0.00464
O4 4 0.767586 0.132709 0.119109 11.00000 0.03578 0.04522 =
0.03994 -0.01336 0.02686 -0.00912
O5 4 0.580434 0.304479 -0.037975 11.00000 0.01641 0.03832 =
0.02307 -0.01147 0.00796 0.00397
H16A 2 0.528835 0.301766 -0.084524 11.00000 -1.50000
N1 3 0.772171 0.362463 0.269843 11.00000 0.01902 0.01725 =
0.02383 0.00145 0.01266 0.00116
N2 3 0.612410 0.663845 0.129777 11.00000 0.02222 0.01459 =
0.02569 0.00104 0.00731 -0.00167
N3 3 0.602785 0.943822 0.143016 11.00000 0.04842 0.01239 =
0.03732 -0.00111 0.00656 0.00216
AFIX 43
H17 2 0.611949 1.055498 0.141612 11.00000 -1.20000
AFIX 0
H15 2 0.768339 0.115179 0.061358 11.00000 -1.50000
C1 1 0.629323 0.293510 0.308857 11.00000 0.02215 0.01207 =
0.02144 -0.00138 0.01187 0.00298
C2 1 0.573446 0.262358 0.348130 11.00000 0.02487 0.03359 =
0.02920 -0.00061 0.01859 0.00111
AFIX 43
H2 2 0.512602 0.246220 0.290352 11.00000 -1.20000
AFIX 0
C3 1 0.605635 0.254882 0.469235 11.00000 0.03721 0.05035 =
0.03403 0.00143 0.02738 0.00155
AFIX 43
H3 2 0.566229 0.235803 0.492934 11.00000 -1.20000
AFIX 0
C4 1 0.694621 0.274713 0.557338 11.00000 0.03838 0.05713 =
0.01958 0.00154 0.01818 0.00736
AFIX 43
H4 2 0.716190 0.269067 0.640331 11.00000 -1.20000
REM #####
REM #####
REM #####
AFIX 0
C5 1 0.750130 0.302597 0.520829 11.00000 0.03014 0.04529 =
0.01977 0.00059 0.00991 0.00424
AFIX 43
H5 2 0.810969 0.314747 0.580187 11.00000 -1.20000
AFIX 0
C6 1 0.720398 0.313895 0.398792 11.00000 0.02261 0.02358 =
0.01950 -0.00116 0.01132 0.00258
C7 1 0.786594 0.335901 0.373510 11.00000 0.01779 0.02399 =
0.01922 0.00199 0.00526 0.00077
AFIX 43
H7 2 0.845966 0.330118 0.439697 11.00000 -1.20000
AFIX 0
C8 1 0.843807 0.370268 0.252906 11.00000 0.01165 0.02704 =
0.02587 0.00117 0.00855 -0.00222
AFIX 13
H8 2 0.899618 0.402041 0.330026 11.00000 -1.20000
AFIX 0
C9 1 0.822040 0.503082 0.155923 11.00000 0.02236 0.02613 =
0.03394 0.00276 0.01698 -0.00446
C10 1 0.852334 0.188974 0.209443 11.00000 0.02459 0.03327 =
0.03949 0.00364 0.02302 0.00105
AFIX 13
H10 2 0.887625 0.201059 0.173851 11.00000 -1.20000
AFIX 0
C11 1 0.896429 0.058549 0.310476 11.00000 0.06160 0.03574 =
0.06593 0.01800 0.04232 0.02328
AFIX 137
H11A 2 0.955393 0.099246 0.372280 11.00000 -1.50000
H11B 2 0.900354 -0.053288 0.279021 11.00000 -1.50000
H11C 2 0.862170 0.045004 0.345727 11.00000 -1.50000
AFIX 0
C12 1 0.554581 0.699085 0.160759 11.00000 0.02449 0.02081 =
0.03287 -0.00522 0.00951 0.00216
AFIX 43
H12 2 0.523720 0.613729 0.174295 11.00000 -1.20000
AFIX 0
C13 1 0.547242 0.871811 0.169532 11.00000 0.03544 0.02582 =
0.03865 -0.00519 0.01159 0.00758
AFIX 43
H13 2 0.511549 0.930343 0.189603 11.00000 -1.20000
AFIX 0
C14 1 0.640761 0.816865 0.119641 11.00000 0.03552 0.02349 =
0.02962 0.00245 0.00877 -0.00342
AFIX 43
H14 2 0.681965 0.833681 0.098842 11.00000 -1.20000
AFIX 0
H16B 2 0.598773 0.243394 -0.058731 11.00000 -1.50000
REM #####
HKLF 4
REM yoshizawa241122ZnSTImi_2_0m_a.res in C2
REM wR2 = 0.0740, GooF = S = 1.067, Restrained GooF = 1.067 for all data
REM R1 = 0.0316 for 2701 Fo > 4sig(Fo) and 0.0319 for all 2752 data
REM 218 parameters refined using 1 restraints
END
WGHT 0.0362 0.0000
REM Instructions for potential hydrogen bonds
HTAB O5 O1_$1
HTAB N3 O1_$2
HTAB O4 O2_$3
HTAB C2 O3_$4
HTAB C13 O3_$5
HTAB C14 O2
HTAB O5 O3_$3
REM Highest difference peak 0.352, deepest hole -0.288, 1-sigma level 0.066
Q1 1 0.5769 0.4276 0.1001 11.00000 0.05 0.31
Q2 1 0.5778 0.4216 0.1795 11.00000 0.05 0.27
Q3 1 0.7691 0.4313 0.2419 11.00000 0.05 0.26
Q4 1 0.5000 0.2505 0.5000 10.50000 0.05 0.26
Q5 1 0.4633 0.3490 -0.0717 11.00000 0.05 0.26
Q6 1 0.7308 0.6395 0.2161 11.00000 0.05 0.23
Q7 1 0.7408 0.4320 0.0638 11.00000 0.05 0.21
Q8 1 0.4915 0.9458 0.2270 11.00000 0.05 0.21
Q9 1 0.4501 0.7733 0.1081 11.00000 0.05 0.21
Q10 1 0.5397 0.4929 0.0427 11.00000 0.05 0.21
Q11 1 0.6682 0.4329 0.5278 11.00000 0.05 0.21
Q12 1 0.7492 0.4997 0.0189 11.00000 0.05 0.21
Q13 1 0.6716 1.0774 0.0932 11.00000 0.05 0.20
Q14 1 0.6672 1.1154 0.2595 11.00000 0.05 0.20
Q15 1 0.9686 0.5038 0.3196 11.00000 0.05 0.20
Q16 1 0.8511 0.4376 0.1334 11.00000 0.05 0.20
Q17 1 0.5796 0.5056 0.4209 11.00000 0.05 0.20
Q18 1 0.6235 0.4192 -0.0564 11.00000 0.05 0.19
Q19 1 0.6896 0.9441 0.0421 11.00000 0.05 0.19
Q20 1 0.7684 0.4006 0.1914 11.00000 0.05 0.19
;
_shelx_res_checksum 73327
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Zn Zn01 0.65438(2) 0.42759(7) 0.11898(3) 0.01670(17) Uani d 1 . .
O O1 0.59603(16) 0.2984(3) 0.1916(2) 0.0174(5) Uani d 1 . .
O O2 0.74153(18) 0.5370(4) 0.0799(3) 0.0323(7) Uani d 1 . .
O O3 0.8834(2) 0.5634(5) 0.1533(3) 0.0391(8) Uani d 1 . .
O O4 0.7676(2) 0.1327(5) 0.1191(3) 0.0372(8) Uani d 1 . .
O O5 0.5804(2) 0.3045(4) -0.0380(3) 0.0276(7) Uani d 1 . .
H H16A 0.529(5) 0.302(8) -0.085(6) 0.041000 Uiso d 1 . .
N N1 0.7722(2) 0.3625(4) 0.2698(3) 0.0196(7) Uani d 1 . .
N N2 0.6124(2) 0.6638(4) 0.1298(3) 0.0241(7) Uani d 1 . .
N N3 0.6028(3) 0.9438(6) 0.1430(3) 0.0420(10) Uani d 1 . .
H H17 0.611949 1.055498 0.141612 0.050000 Uiso calc 1 . .
H H15 0.768(5) 0.115(10) 0.061(6) 0.063000 Uiso d 1 . .
C C1 0.6293(2) 0.2935(5) 0.3089(3) 0.0187(7) Uani d 1 . .
C C2 0.5734(3) 0.2624(6) 0.3481(4) 0.0273(9) Uani d 1 . .
H H2 0.512602 0.246220 0.290352 0.033000 Uiso calc 1 . .
C C3 0.6056(3) 0.2549(7) 0.4692(4) 0.0365(11) Uani d 1 . .
H H3 0.566229 0.235803 0.492934 0.044000 Uiso calc 1 . .
C C4 0.6946(3) 0.2747(7) 0.5573(4) 0.0372(11) Uani d 1 . .
H H4 0.716190 0.269067 0.640331 0.045000 Uiso calc 1 . .
C C5 0.7501(3) 0.3026(7) 0.5208(4) 0.0339(10) Uani d 1 . .
H H5 0.810969 0.314747 0.580187 0.041000 Uiso calc 1 . .
C C6 0.7204(3) 0.3139(5) 0.3988(3) 0.0221(8) Uani d 1 . .
C C7 0.7866(3) 0.3359(6) 0.3735(3) 0.0230(8) Uani d 1 . .
H H7 0.845966 0.330118 0.439697 0.028000 Uiso calc 1 . .
C C8 0.8438(2) 0.3703(5) 0.2529(3) 0.0225(8) Uani d 1 . .
H H8 0.899618 0.402041 0.330026 0.027000 Uiso calc 1 . .
C C9 0.8220(3) 0.5031(6) 0.1559(4) 0.0268(9) Uani d 1 . .
C C10 0.8523(3) 0.1890(6) 0.2094(4) 0.0297(9) Uani d 1 . .
H H10 0.887625 0.201059 0.173851 0.036000 Uiso calc 1 . .
C C11 0.8964(4) 0.0585(8) 0.3105(6) 0.0507(14) Uani d 1 . .
H H11A 0.955393 0.099246 0.372280 0.076000 Uiso calc 1 . .
H H11B 0.900354 -0.053288 0.279021 0.076000 Uiso calc 1 . .
H H11C 0.862170 0.045004 0.345727 0.076000 Uiso calc 1 . .
C C12 0.5546(3) 0.6991(6) 0.1608(4) 0.0295(9) Uani d 1 . .
H H12 0.523720 0.613729 0.174295 0.035000 Uiso calc 1 . .
C C13 0.5472(3) 0.8718(6) 0.1695(4) 0.0381(11) Uani d 1 . .
H H13 0.511549 0.930343 0.189603 0.046000 Uiso calc 1 . .
C C14 0.6408(3) 0.8169(7) 0.1196(4) 0.0346(10) Uani d 1 . .
H H14 0.681965 0.833681 0.098842 0.041000 Uiso calc 1 . .
H H16B 0.599(5) 0.243(10) -0.059(6) 0.052000 Uiso d 1 . .
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Zn01 0.0144(2) 0.0149(2) 0.0197(2) -0.00040(18) 0.00884(17) 0.00248(17)
O1 0.0165(12) 0.0172(13) 0.0178(11) -0.0024(11) 0.0091(10) -0.0005(10)
O2 0.0171(14) 0.0431(19) 0.0350(15) 0.0022(13) 0.0133(12) 0.0193(14)
O3 0.0215(15) 0.045(2) 0.0486(18) -0.0046(14) 0.0184(13) 0.0176(16)
O4 0.0358(17) 0.045(2) 0.0399(17) -0.0091(15) 0.0269(15) -0.0134(16)
O5 0.0164(14) 0.0383(19) 0.0231(14) 0.0040(14) 0.0080(12) -0.0115(13)
N1 0.0190(15) 0.0173(14) 0.0238(15) 0.0012(13) 0.0127(13) 0.0015(12)
N2 0.0222(16) 0.0146(17) 0.0257(16) -0.0017(13) 0.0073(13) 0.0010(13)
N3 0.048(2) 0.0124(18) 0.0373(18) 0.0022(19) 0.0066(16) -0.0011(18)
C1 0.0222(18) 0.0121(17) 0.0214(17) 0.0030(15) 0.0119(15) -0.0014(14)
C2 0.025(2) 0.034(2) 0.029(2) 0.0011(18) 0.0186(17) -0.0006(18)
C3 0.037(2) 0.050(3) 0.034(2) 0.002(2) 0.027(2) 0.001(2)
C4 0.038(2) 0.057(3) 0.0196(19) 0.007(2) 0.0182(18) 0.002(2)
C5 0.030(2) 0.045(3) 0.0198(19) 0.004(2) 0.0099(17) 0.0006(19)
C6 0.0226(18) 0.024(2) 0.0195(17) 0.0026(16) 0.0113(15) -0.0012(15)
C7 0.0178(17) 0.024(2) 0.0192(18) 0.0008(15) 0.0053(15) 0.0020(15)
C8 0.0116(16) 0.027(2) 0.0259(18) -0.0022(15) 0.0085(15) 0.0012(15)
C9 0.022(2) 0.026(2) 0.034(2) -0.0045(18) 0.0170(18) 0.0028(18)
C10 0.025(2) 0.033(2) 0.039(2) 0.0010(18) 0.0230(19) 0.0036(19)
C11 0.062(3) 0.036(3) 0.066(3) 0.023(3) 0.042(3) 0.018(3)
C12 0.024(2) 0.021(2) 0.033(2) 0.0022(17) 0.0095(18) -0.0052(17)
C13 0.035(2) 0.026(2) 0.039(2) 0.0076(18) 0.0116(19) -0.0052(18)
C14 0.036(2) 0.023(3) 0.030(2) -0.003(2) 0.0088(19) 0.0024(17)
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'
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'
Zn Zn 0.2839 1.4301 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O5 Zn01 N2 . . 116.22(13) ?
O5 Zn01 N1 . . 130.65(13) ?
N2 Zn01 N1 . . 112.96(13) ?
O5 Zn01 O1 . . 92.14(12) ?
N2 Zn01 O1 . . 94.77(12) ?
N1 Zn01 O1 . . 87.64(11) ?
O5 Zn01 O2 . . 95.52(13) ?
N2 Zn01 O2 . . 91.69(14) ?
N1 Zn01 O2 . . 79.03(12) ?
O1 Zn01 O2 . . 166.60(11) ?
C1 O1 Zn01 . . 123.4(2) ?
C9 O2 Zn01 . . 115.1(3) ?
C7 N1 C8 . . 121.1(3) ?
C7 N1 Zn01 . . 125.5(3) ?
C8 N1 Zn01 . . 113.0(2) ?
C14 N2 C12 . . 105.7(4) ?
C14 N2 Zn01 . . 127.5(3) ?
C12 N2 Zn01 . . 126.5(3) ?
C14 N3 C13 . . 108.9(5) ?
O1 C1 C2 . . 119.4(3) ?
O1 C1 C6 . . 123.1(3) ?
C2 C1 C6 . . 117.4(3) ?
C3 C2 C1 . . 121.2(4) ?
C2 C3 C4 . . 121.5(4) ?
C5 C4 C3 . . 118.1(4) ?
C4 C5 C6 . . 122.5(4) ?
C5 C6 C1 . . 119.2(4) ?
C5 C6 C7 . . 116.4(4) ?
C1 C6 C7 . . 124.2(3) ?
N1 C7 C6 . . 125.5(4) ?
N1 C8 C9 . . 109.2(3) ?
N1 C8 C10 . . 108.0(3) ?
C9 C8 C10 . . 108.7(3) ?
O3 C9 O2 . . 124.9(4) ?
O3 C9 C8 . . 117.8(4) ?
O2 C9 C8 . . 117.2(3) ?
O4 C10 C11 . . 110.5(4) ?
O4 C10 C8 . . 107.7(3) ?
C11 C10 C8 . . 112.3(4) ?
C13 C12 N2 . . 110.8(5) ?
C12 C13 N3 . . 104.6(5) ?
N2 C14 N3 . . 110.0(4) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Zn01 O5 . 1.996(3) ?
Zn01 N2 . 2.015(3) ?
Zn01 N1 . 2.038(3) ?
Zn01 O1 . 2.060(2) ?
Zn01 O2 . 2.117(3) ?
O1 C1 . 1.331(4) ?
O2 C9 . 1.272(5) ?
O3 C9 . 1.238(5) ?
O4 C10 . 1.408(6) ?
N1 C7 . 1.276(5) ?
N1 C8 . 1.456(5) ?
N2 C14 . 1.327(6) ?
N2 C12 . 1.366(6) ?
N3 C14 . 1.337(7) ?
N3 C13 . 1.371(7) ?
C1 C2 . 1.410(6) ?
C1 C6 . 1.427(5) ?
C2 C3 . 1.383(6) ?
C3 C4 . 1.394(7) ?
C4 C5 . 1.371(7) ?
C5 C6 . 1.407(6) ?
C6 C7 . 1.443(6) ?
C8 C9 . 1.522(6) ?
C8 C10 . 1.556(6) ?
C10 C11 . 1.509(7) ?
C12 C13 . 1.351(7) ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
O4 H15 O2 4_645 0.79(7) 1.89(7) 2.678(4) 170.(8) yes
O5 H16A O1 2_655 0.79(7) 1.91(7) 2.708(4) 178.(6) yes
O5 H16B O3 4_645 0.72(8) 2.02(8) 2.724(4) 165.(7) yes
N3 H17 O1 1_565 0.88 2.06 2.830(6) 144.9 yes
C14 H14 O2 . 0.950000 2.610000 3.077(6) 110.800000 ?
C13 H13 O3 3_455 0.950000 2.360000 3.253(6) 156.400000 ?
C2 H2 O3 3_445 0.950000 2.480000 3.351(5) 152.400000 ?