#------------------------------------------------------------------------------
#$Date: 2024-03-05 21:41:45 +0100 (Tue, 05 Mar 2024) $
#$Revision: 290323 $
#$URL: svn://www.crystallography.net/cod/cif/2/02/29/2022998.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_2022998
loop_
_publ_author_name
'Mohamed-Ezzat, Reham A'
'Elgemeie, Galal H.'
'Jones, Peter G.'
_publ_section_title
;
 An unexpected tautomer: synthesis and crystal structure of
 <i>N</i>-[6-amino-4-(methyl-sulfan-yl)-1,2-di-hydro-1,3,5-triazin-2-yl-idene]benzenesulfonamide.
;
_journal_coeditor_code           YZ2047
_journal_issue                   'Pt 2'
_journal_name_full
'Acta crystallographica. Section E, Crystallographic communications'
_journal_page_first              120
_journal_page_last               124
_journal_paper_doi               10.1107/S2056989023011076
_journal_volume                  80
_journal_year                    2024
_chemical_formula_iupac          'C10 H11 N5 O2 S2'
_chemical_formula_moiety         'C10 H11 N5 O2 S2'
_chemical_formula_sum            'C10 H11 N5 O2 S2'
_chemical_formula_weight         297.36
_chemical_name_systematic
<i>N</i>-[6-Amino-4-(methylsulfanyl)-1,2-dihydro-1,3,5-triazin-2-ylidene]benzenesulfonamide
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_audit_creation_method           SHELXL-2019/3
_cell_angle_alpha                90
_cell_angle_beta                 92.9914(14)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.44832(9)
_cell_length_b                   9.03714(14)
_cell_length_c                   26.1141(4)
_cell_measurement_reflns_used    32085
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      79.6610
_cell_measurement_theta_min      3.3680
_cell_volume                     1284.03(4)
_computing_cell_refinement
;
CrysAlisPro 1.171.42.96a (Rigaku OD, 2023)
;
_computing_data_collection
;
CrysAlisPro 1.171.42.96a (Rigaku OD, 2023)
;
_computing_data_reduction
;
CrysAlisPro 1.171.42.96a (Rigaku OD, 2023)
;
_computing_molecular_graphics
;
XP, Version 5.1 (Bruker, 1998)
;
_computing_publication_material
;
<i>SHELXL2019/3</i> (Sheldrick, 2015b)
;
_computing_structure_refinement
;
<i>SHELXL2019/3</i> (Sheldrick, 2015b)
;
_computing_structure_solution
;
<i>SHELXT</i> (Sheldrick, 2015a)
;
_diffrn_ambient_temperature      100.00(13)
_diffrn_detector                 'Hybrid Pixel Array Detector'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0381
_diffrn_reflns_av_unetI/netI     0.0116
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            49520
_diffrn_reflns_theta_full        77.500
_diffrn_reflns_theta_max         80.250
_diffrn_reflns_theta_min         3.389
_diffrn_source                   'micro-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    3.838
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.62524
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(CrysAlisPro; Rigaku OD, 2023)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.538
_exptl_crystal_description       plate
_exptl_crystal_F_000             616
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.02
_refine_diff_density_max         0.411
_refine_diff_density_min         -0.384
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.047
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     185
_refine_ls_number_reflns         2789
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.047
_refine_ls_R_factor_all          0.0312
_refine_ls_R_factor_gt           0.0306
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0457P)^2^+0.9076P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0845
_refine_ls_wR_factor_ref         0.0850
_reflns_number_gt                2713
_reflns_number_total             2789
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            yz2047sup1.cif
_cod_data_source_block           I
_cod_depositor_comments          'Adding full bibliography for 2022998.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2022998
_cod_database_fobs_code          2022998
_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_min   0.597
_shelx_estimated_absorpt_t_max   0.927
_shelx_hkl_file
;
   0   0  -2 180937. 6600.14  20
   0   0  -2 182858. 6598.45  13
   0   0   2 196886. 6597.65  12
   0   0  -2 169392. 6596.80   9
   0   0  -2 173390. 6598.29  16
   0   0  -2 181686. 6599.53  15
   0   0  -2 176058. 6594.07  17
   0   0  -2 201475. 6603.36  10
   0   0  -3 98.2785 35.7169  20
   0   0   3 28.6566 17.4195  22
   0   0   3 64.9237 16.0276   8
   0   0  -3 9.38451 30.0970   9
   0   0  -3 36.8201 30.6789  13
   0   0  -3 8.52790 23.3467  17
   0   0  -3 125.070 35.1592  15
   0   0   3 41.1606 27.6385  12
   0   0  -3 29.8567 29.3496  16
   0   0   4 50479.6 1927.61  22
   0   0  -4 52850.1 1949.96  20
   0   0   4 54129.6 1925.73   8
   0   0  -4 52979.1 1938.00  17
   0   0   4 57514.6 1943.89  11
   0   0  -4 52746.9 1948.79  15
   0   0  -4 53806.1 1946.81  13
   0   0  -4 50917.5 1944.52   9
   0   0  -4 51960.1 1946.57  16
   0   0  -5 7.46945 55.3175  20
   0   0   5 60.2673 27.7977  22
   0   0  -5 3.19904 51.1700   9
   0   0   5 12.8234 23.2424   8
   0   0  -5 94.8498 40.7759  17
   0   0  -5 9.97869 53.4541  13
   0   0  -5-3.57871 58.4901  15
   0   0  -5 68.1266 52.4640  16
   0   0   5 178.122 47.8169  11
   0   0   6 199355. 7512.92  22
   0   0   6 221697. 7542.49  21
   0   0  -6 209289. 7549.17  20
   0   0   6 205607. 7508.84   8
   0   0  -6 205020. 7542.91  13
   0   0  -6 209054. 7541.31   9
   0   0  -6 208612. 7544.38  16
   0   0   6 221593. 7536.92  11
   0   0  -6 202526. 7545.16  15
   0   0  -6 204309. 7528.22  17
   0   0   7 83.9410 36.7817  22
   0   0   7 134.540 66.1492  21
   0   0  -7 103.328 81.2751  20
   0   0   7 10.8017 29.9494   8
   0   0  -7 96.9450 88.0917   9
   0   0   7 65.5864 57.3583  11
   0   0  -7 101.152 72.8978  13
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   0   0  -7 23.2311 58.8201  17
   0   0   8 59712.5 2260.77  22
   0   0   8 66253.2 2302.60  21
   0   0  -8 63670.8 2315.80  20
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   0   0   8 59204.9 2253.47   8
   0   0  -8 65011.4 2305.75   9
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   0   0   8 65627.4 2294.90  11
   0   0  -8 62162.5 2284.09  17
   0   0  -8 65047.4 2309.73  13
   0   0  -8 63318.1 2308.42  16
   0   0   9 267.289 37.7181  22
   0   0   9 70.0424 63.7134  21
   0   0  -9 51.0790 80.1602  20
   0   0  -9 12.3306 73.4093   9
   0   0   9 46.8703 23.2704   8
   0   0   9 48.9497 44.8941   7
   0   0  -9 65.4105 69.4183  16
   0   0   9 80.9548 59.0535  11
   0   0  -9 38.9621 75.3018  13
   0   0  -9 50.8978 52.9382  17
   0   0   9 42.2713 62.2112  14
   0   0  10 105164. 3632.98  22
   0   0  10 120379. 3700.84  21
   0   0 -10 118147. 3724.44  20
   0   0  10 122212. 3668.96   7
   0   0 -10 118699. 3704.95   9
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   0   0  10 123119. 3690.55  11
   0   0 -10 121474. 3712.81  16
   0   0 -10 116155. 3671.84  17
   0   0 -10 119856. 3713.46  13
   0   0 -11 56.1763 100.054  20
   0   0  11 76.8950 32.3456  22
   0   0  11 95.5541 69.1134  21
   0   0 -11 212.911 93.8889   9
   0   0  11 199.303 55.9766   7
   0   0  11 59.9062 76.2816  14
   0   0 -11 75.2673 77.8876  16
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   0   0  13 26.4341 50.5629   7
   0   0 -13 113.665 85.1853  16
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   0   0 -13 63.0321 90.6330  13
   0   0 -14 165411. 6113.98  20
   0   0  14 160208. 6074.52  21
   0   0 -14 162685. 6087.03   9
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   0   0 -16 21575.0 914.900  18
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   0   0 -16 22370.5 947.619  13
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   0   0  17 11.7246 76.7655  14
   0   0  18 38866.4 1474.18  33
   0   0  18 39637.2 1477.44  27
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   0   0  18 41509.9 1589.47  19
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   0   0  18 40912.2 1576.04  14
   0   0 -18 41726.4 1589.52  18
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   0   0  19 258.024 62.4114  28
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   0   0  24 38234.6 1504.11  28
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   0   0 -25 70.0528 137.780  13
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   1   6  -6 1407.37 100.900   3
   1   6  -6 1537.05 108.594   4
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   1   6   0 49901.0 1998.29   3
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   1   6   0 57745.3 2011.22   4
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   1   6  10 1380.32 175.914   1
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   1   6  11 166.631 72.1358  25
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   1   6  13 441.711 151.843   7
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   2   2   4 13355.5 610.834   7
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   2  -2   6 48948.6 1888.17   2
   2   2   6 52522.1 1880.69   2
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   2  -2   6 49679.6 1852.78   6
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   2   2  11 82766.5 3187.48   2
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   2   2  12 288.520 74.3099   2
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   2   2  12 260.621 60.4940  28
   2  -2  12 304.913 52.5180  35
   2  -2  12 310.087 62.4590  29
   2   2  12 275.106 48.7969  61
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   2   2  13 5103.37 327.094  19
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   2   2  13 4745.01 230.844  27
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   2   2  13 5129.35 233.274  28
   2  -2  13 4941.02 231.189  27
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   2  -2  13 5232.49 222.081  70
   2   2  13 5120.09 222.736  61
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   2   2  14 1681.87 181.092   7
   2  -2  14 1778.88 169.815   6
   2  -2  14 1807.52 121.986  28
   2   2  14 2152.15 128.866  28
   2   2  14 1816.01 123.843  27
   2  -2  14 1653.60 112.769  29
   2   2  14 2073.45 120.384  29
   2  -2  14 1936.00 116.221  35
   2  -2  14 1862.49 121.766  27
   2  -2  14 2013.82 176.570  22
   2  -2  14 1972.05 201.589  19
   2  -2  14 1992.90 121.532  23
   2   2  14 1753.57 109.748  23
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   2   2  14 1722.34 121.671  64
   2  -2  14 1784.16 109.083  70
   2  -2  14 1913.30 115.660  41
   2   2  14 2108.05 114.473  61
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   2   2  15 16132.4 807.498   7
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   2  -3  -7 1589.04 166.590  16
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   2   3  -7 1690.41 179.024   1
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   2   3  -7 1658.49 171.231   2
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   2  -3  -7 1680.23 133.827  22
   2  -3  -7 1832.76 148.882  20
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   2   3  -6 36804.4 1517.03   1
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   2   3  -6 39303.6 1501.05   2
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   2  -3  -6 36830.1 1447.21  22
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   2   3  -5 1297.14 93.8789  13
   2  -3  -5 1884.96 187.439  17
   2  -3  -5 1895.19 162.254  16
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   2   3  -5 1579.28 182.042   1
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   2   3  -5 2013.90 178.482   2
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   2   7   3 886.120 98.2358   3
   2   7   3 1163.26 117.140   4
   2   7   3 926.361 198.218   7
   2   7   3 1220.07 212.782   1
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   2   7   3 1144.07 109.418 112
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   2   7   4 2031.30 258.255   1
   2   7   4 2069.06 141.589   3
   2   7   4 2217.47 155.280   4
   2   7   4 2170.66 272.327   7
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   2   7   4 1878.02 136.605 112
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   2   7   4 2141.02 168.019  86
   2   7   4 1732.90 159.060  85
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   2   7   4 1987.79 163.610  94
   2   7   4 2161.90 132.408  98
   2  -7   4 1657.23 135.145  23
   2  -7   4 1774.33 233.430  22
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   2  -7   5 22792.4 1062.87  17
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   2   7   5 21818.0 1113.14   1
   2   7   5 25705.4 946.432   4
   2   7   5 19917.5 1122.83   7
   2  -7   5 23647.1 1124.36   6
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   2   7   5 24480.5 948.742  86
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   2   7   5 23629.5 919.304  98
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   2  -7   5 23008.8 1088.23  22
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   2   7   7 11067.4 697.208   1
   2   7   7 14157.9 565.934   4
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   2   7   8 1423.73 222.420   1
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   2   7   8 1850.22 159.835 100
   2   7   8 2228.79 150.238 120
   2   7   8 1736.81 127.180 112
   2   7   8 2225.40 168.889  86
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   2   7   8 2134.62 138.589  97
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   2  -7   8 1820.37 239.227  22
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   2  -7   9 236.649 142.838   6
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   2   7   9-22.2357 111.429   1
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   2   7   9 151.730 76.1830   4
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   2   7   9 165.657 88.3953 111
   2   7   9 6.57516 95.6340 100
   2   7   9 124.610 53.0223 110
   2   7   9 573.536 105.034 120
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   2   7   9 166.431 62.3100  91
   2   7   9 185.011 73.6472  98
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   2  -7   9 48.3070 82.6873  42
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   2  -7   9 112.190 69.4944  29
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   2   7  10 6415.51 287.531 112
   2   7  10 6702.39 330.766  86
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   2   7  11 39290.5 1554.09 100
   2   7  11 39789.6 1526.02 110
   2   7  11 41042.1 1563.79  86
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   2   7  11 38321.6 1541.02   4
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   2   7  12 157.407 57.5328 110
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   2   7  12 169.672 109.764  86
   2   7  12 225.485 70.1804  91
   2   7  12 253.795 78.3114  98
   2   7  12 129.697 76.4140  97
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   2   7  13 563.098 69.5371 110
   2   7  13 559.898 112.304  86
   2   7  13 466.993 78.6289  91
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   2   7  13 607.059 89.3461  97
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   2  -7  13 509.032 71.0274  74
   2   7  13 416.426 80.0786  77
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   2  -7  13 405.676 82.7802  41
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   2  -7  13 606.889 93.3089  28
   2  -7  13 589.342 74.8977  29
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   3   1  -6 47001.5 1880.15  16
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   3   1  -6 48833.9 1913.02   2
   3  -1  -6 48646.0 1917.96   2
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   3  -1  -4 37958.5 1531.71   2
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   3   1  -2 26338.5 1077.64   2
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   3   1   5 10317.0 488.403   2
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   3   1   6 30815.3 1261.22   2
   3  -1   6 31807.6 1264.60   2
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   3   1   6 30828.9 1240.74  19
   3  -1   6 31174.8 1220.80  19
   3   1   7 9673.25 475.381  19
   3  -1   7 9232.32 456.212  19
   3  -1   7 9674.93 397.459  29
   3   1   7 9383.93 389.527  70
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   3   1   7 10618.8 494.638   2
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   3  -1   8 19530.5 773.543  23
   3   1   8 20019.2 870.966  19
   3  -1   8 19925.9 853.187  19
   3   1   8 21561.9 778.218  29
   3  -1   8 20517.2 779.980  29
   3   1   8 19832.8 769.268  35
   3   1   8 20272.2 773.010  70
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   3   1   8 20407.0 871.328   2
   3  -1   8 19952.9 869.245   2
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   3   1   9 232.415 89.6897   2
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   3  -1   9 86.1470 83.8993   2
   3  -1   9 96.9706 85.4732  19
   3  -1   9 227.407 52.5890  23
   3   1   9 284.354 107.814  19
   3  -1   9 266.027 58.6143  28
   3   1   9 215.310 55.7214  28
   3   1   9 156.935 47.0293  35
   3  -1   9 163.973 57.0142  29
   3   1   9 240.817 53.5652  29
   3   1   9 193.449 52.7871  70
   3   1   9 240.598 46.0121  61
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   3   1  10 5542.27 324.067   2
   3  -1  10 6093.20 333.302   2
   3  -1  10 5892.70 258.001  28
   3   1  10 5883.61 254.153  28
   3   1  10 6220.50 257.437  29
   3   1  10 5501.27 247.210  35
   3  -1  10 5451.94 251.081  23
   3   1  10 6007.25 244.724  23
   3   1  10 5219.06 339.975  19
   3  -1  10 5990.69 339.738  19
   3  -1  10 5517.96 250.157  70
   3   1  10 5633.27 252.152  70
   3   1  10 5515.04 246.799  61
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   3   1  11 4459.09 288.916   2
   3  -1  11 5057.95 295.591   2
   3  -1  11 5138.65 232.804  28
   3   1  11 5234.30 230.379  28
   3   1  11 5123.16 224.144  35
   3   1  11 5472.62 234.423  29
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   3   1  11 4281.98 231.938  97
   3  -1  11 4956.98 226.560  23
   3   1  11 5250.95 219.554  23
   3   1  11 5569.47 339.489  19
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   3   1  11 4796.84 221.574  73
   3  -1  11 4530.23 224.822  70
   3   1  11 5037.85 222.257  61
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   3   1  12 1072.50 131.960   2
   3  -1  12 1086.22 124.841   2
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   3   1  12 988.052 92.0192 113
   3   1  12 1078.05 88.4627  92
   3   1  12 1081.79 93.2029  91
   3  -1  12 1227.27 87.3952  81
   3   1  12 1111.42 99.4080  97
   3  -1  12 1286.35 164.141  19
   3  -1  12 946.454 90.0049  23
   3   1  12 1082.86 83.8904  23
   3   1  12 1043.53 161.487  19
   3   1  12 1029.25 86.1720  73
   3  -1  12 1083.02 91.6342  73
   3  -1  12 1088.76 88.0138  70
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   3   1  12 1137.31 86.3187  61
   3  -1  12 1031.83 94.6764  28
   3   1  12 1221.97 97.1114  28
   3   1  12 1189.92 89.3895  35
   3   1  12 1287.95 97.8455  29
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  -3   1 -13 3207.05 256.525  15
   3   1  13 3394.16 182.994 113
   3   1  13 3537.41 179.443  92
   3   1  13 3049.90 177.963  91
   3   1  13 3301.68 185.825  97
   3   1  13 3433.34 180.281  87
   3  -1  13 3449.38 177.180  95
   3  -1  13 3735.43 175.015  81
   3  -1  13 2909.98 256.196  19
   3  -1  13 3732.60 181.985  23
   3   1  13 3686.48 174.155  23
   3   1  13 3249.28 274.491  19
   3   1  13 3435.02 175.982  73
   3  -1  13 3714.62 181.572  73
   3  -1  13 3322.39 180.510  70
   3   1  13 3689.78 176.894  61
   3  -1  13 3254.48 174.836  27
   3  -1  13 3808.80 187.798  28
   3   1  13 3667.81 187.171  28
   3  -1  13 4058.55 189.034  29
   3   1  13 3962.22 187.292  29
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   3  -1  14 10248.7 444.299 113
   3   1  14 10657.9 452.497 113
   3   1  14 10739.5 447.573  92
   3   1  14 10809.8 450.087  91
   3   1  14 10532.1 457.540  97
   3  -1  14 9988.02 443.279  95
   3  -1  14 11288.2 442.423  81
   3   1  14 10959.4 450.370  87
   3  -1  14 11364.3 451.344  23
   3   1  14 11310.7 444.794  23
   3   1  14 10142.6 572.270  19
   3  -1  14 11238.9 574.042  19
   3   1  14 11244.0 445.708  73
   3  -1  14 11603.5 451.861  73
   3  -1  14 10675.6 447.017  70
   3   1  14 11331.8 447.478  61
   3  -1  14 10790.1 446.016  27
   3  -1  14 11960.4 459.959  28
   3   1  14 11269.5 455.448  28
   3   1  14 10206.6 445.890  27
   3  -1  14 11718.6 456.712  29
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   3  -1  15 1314.86 103.014 113
   3   1  15 1270.18 109.544 113
   3   1  15 1473.08 109.030  92
   3   1  15 1521.65 113.303  91
   3   1  15 1355.83 116.678  97
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   3   3   1 10540.2 520.798  19
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   3  -3   2 10984.8 548.323   2
   3  -3   2 9072.17 417.513  23
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   3   3   2 10470.3 499.538  19
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   3   3   2 10362.3 409.991  26
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   3   3   3 174.858 121.533   2
   3  -3   3 268.344 125.511   2
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   3   3   3 195.606 72.3631   4
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   3  -3   3 204.206 65.3346  23
   3   3   3 193.158 54.5014  26
   3   3   3 100.047 88.1539  19
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   3   3   3 153.801 69.5072  50
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   3   3   4 2745.22 165.417   4
   3   3   4 2843.57 249.080   2
   3  -3   4 2985.67 252.576   2
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   3  -3   4 2831.61 240.565  22
   3   3   4 2692.42 216.733  19
   3  -3   4 2672.37 150.104  28
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   3   3   4 2904.90 168.762  50
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   3   3   5 690.133 138.274   2
   3  -3   5 638.547 139.628   2
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   3   3   5 507.976 87.3517   4
   3  -3   5 326.071 72.5188  23
   3   3   5 636.526 125.872  19
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   3  -3   5 493.770 73.3676  28
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   3  -3   5 459.620 71.6907  29
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   3  -3   5 623.232 74.1198  66
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   3   3   5 572.142 86.5436  50
   3  -3   5 625.145 85.4980  45
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   3   3   6 31.2525 99.4914   2
   3  -3   6 80.6187 102.651   2
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   3   3   6 118.713 67.4190   4
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   3  -3   6 121.977 63.9094  28
   3   3   6 100.451 49.0009  29
   3  -3   6 144.981 64.9330  23
   3   3   6 268.753 108.052  19
   3  -3   6 192.227 71.4858  65
   3  -3   6 42.6087 53.2303  66
   3   3   6 218.824 44.7237  70
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   3  -3   6 145.663 64.1628  45
   3   3   6 111.237 64.6288  50
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   3   3   7 37666.4 1463.53   2
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   3   3   7 33318.7 1337.48   4
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   3  -3   7 34260.9 1332.62  23
   3   3   7 35887.6 1445.27  19
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   3   3   7 37044.6 1319.33  70
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   3   3   8 1540.37 184.857   2
   3  -3   8 1704.18 187.938   2
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   3   3   8 1652.32 127.754   4
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   3  -3   8 1601.62 123.997  28
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   3   3   8 1626.13 109.842  28
   3   3   8 1859.45 115.845  29
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   3   3   8 1537.92 184.724  19
   3  -3   8 1642.95 197.094  22
   3  -3   8 1713.75 114.081  73
   3  -3   8 1771.52 122.105  66
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   3  -3   8 1849.64 118.396  42
   3   3   8 1798.32 127.635  50
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   3   3   9 10596.1 546.178   2
   3   3   9 9228.63 443.198   4
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   3  -3   9 11269.2 550.502   2
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   3  -3   9 11573.3 574.010  22
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   3   3  10 15467.7 743.758   2
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   3   3  10 15768.4 637.627  28
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   3   3  11 2426.81 224.500   2
   3  -3  11 2697.56 226.477   2
   3   3  11 2937.86 148.865 112
   3   3  11 2805.59 167.067 111
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   3   3  11 2733.94 164.433  91
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   3  -3  11 3603.70 272.982  22
   3   3  11 2845.95 258.295  19
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   3   3  14 227.633 81.3296  91
   3   3  14 77.1842 57.6007  98
   3   3  14 79.5094 80.4794  97
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   3  -3  14 157.949 73.2187  95
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   3   3  14 215.828 134.511  19
   3   3  14 152.665 51.8024  73
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   3  -3  14 83.5181 79.2266  28
   3   3  14 210.658 74.1582  28
   3  -3  14 136.541 62.7512  35
   3   3  14 216.330 72.8848  27
   3  -3  14 68.8334 69.2475  29
   3   3  14 235.665 74.1851  29
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   3   3  15 10498.6 424.784  91
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   3   3  16 8235.91 381.742  92
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  -3  -4  16 225.457 75.5558  24
   3  -4 -16 545.900 110.122  68
  -3   4  16 225.884 66.0830  79
   3   4 -16 117.221 75.3490  78
   3  -4 -16 134.847 94.0140  63
   3  -4 -16 73.1327 93.6518  53
   3   4 -16 125.470 77.6566  46
   3  -4 -16 202.363 104.532  52
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   3  -4 -16 110.960 104.845  44
   3   4 -16 142.574 75.0079  47
   3  -4 -16 97.1096 95.3410  38
  -3   4  16 171.421 50.7300  37
  -3   4  16 221.371 83.2114  36
   3   4 -16 167.445 63.7808  34
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   3  -4 -15 188.765 102.673  15
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   3  -4 -15 128.399 132.903  17
   3  -4 -15 259.594 131.069  16
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   3  -4 -15 245.385 77.2778 116
   3   4 -15 241.983 109.597  89
   3   4 -15 242.911 104.101  96
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   3   4 -15 166.570 71.3421  26
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   3  -4 -15 200.120 99.2298  68
   3  -4 -15 235.432 92.2563  63
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   3   4 -15 198.653 83.7766  78
   3  -4 -15 100.481 88.1447  53
   3   4 -15 141.496 81.3429  46
   3  -4 -15 95.6664 106.674  52
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   3   4 -15 202.546 75.0750  47
   3  -4 -15 200.185 103.407  38
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   3   4 -15 129.265 64.3437  34
   3  -4 -14 83990.4 3416.54  15
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   3  -4 -14 88850.2 3522.16  17
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   3  -4 -14 92662.4 3506.47  16
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   3  -4 -14 91189.3 3309.22 116
   3   4 -14 92233.2 3320.58  89
   3   4 -14 88090.4 3318.89  96
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   3   4 -14 92216.5 3297.97  26
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   3  -4 -14 88449.1 3334.33  68
   3  -4 -14 92109.7 3324.97  63
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   3   4 -14 85419.1 3302.47  78
   3   4 -14 92246.4 3305.66  46
   3  -4 -14 90790.3 3321.18  53
   3  -4 -14 92556.7 3342.01  52
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   3   4 -14 89684.7 3301.39  47
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   3  -4 -14 89911.6 3332.05  38
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   3   4 -14 88848.8 3292.96  34
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   3  -4 -13 1739.11 253.495  17
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   3  -4 -13 1427.77 217.424  16
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  -3   4  13 1795.42 239.239   7
  -3   4  13 2093.73 198.337   1
  -3   4  13 1780.60 114.086   3
   3  -4 -13 1946.32 144.167 116
   3   4 -13 1617.19 154.484 115
   3   4 -13 2027.80 175.084  89
   3   4 -13 1875.58 158.222  96
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   3   4 -13 1933.02 136.432  26
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  -3   4  13 1864.78 140.413  24
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   3  -4 -13 2067.18 173.044  68
   3  -4 -13 1997.44 159.316  63
  -3   4  13 1848.41 132.306  79
   3   4 -13 1745.65 144.773  78
   3   4 -13 1922.65 148.062  46
   3  -4 -13 2108.34 163.745  53
   3  -4 -13 2272.07 180.686  52
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   3   4 -13 2250.11 146.623  47
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   3  -4 -13 2026.48 168.476  38
   3   4 -13 2087.44 135.145  34
  -3   4  13 2024.66 126.144  37
  -3   4  13 1955.80 154.466  36
  -3  -4  12 194211. 6840.36  14
   3  -4 -12 181670. 6908.29  17
  -3  -4  12 194993. 6860.17  11
   3  -4 -12 182619. 6867.87  16
  -3   4  12 178167. 6822.26  12
   3   4 -12 163202. 6805.60   2
  -3  -4  12 189349. 6865.57   8
  -3   4  12 190310. 6836.41   8
  -3   4  12 181636. 6800.11   1
  -3   4  12 182448. 6665.35   3
   3  -4 -12 186895. 6819.32   2
   3  -4 -12 181979. 6676.66 108
   3  -4 -12 178127. 6689.94 116
   3   4 -12 166686. 6693.66 115
   3   4 -12 182648. 6699.59  89
   3   4 -12 172956. 6694.00  96
  -3   4  12 190607. 6805.83  21
   3   4 -12 185339. 6677.57  26
  -3   4  12 177313. 6688.93  25
  -3   4  12 178039. 6680.92  24
  -3  -4  12 183264. 6810.10  21
  -3   4  12 182629. 6677.20  79
   3  -4 -12 188830. 6716.89  68
   3  -4 -12 189257. 6702.04  63
   3   4 -12 180637. 6686.78  78
   3   4 -12 193045. 6687.92  46
   3  -4 -12 191245. 6701.16  53
   3  -4 -12 192241. 6722.10  52
  -3  -4  12 171191. 6674.32  49
   3   4 -12 187647. 6684.29  47
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  -3   4  12 183871. 6661.81  30
   3  -4 -12 186495. 6710.45  38
  -3   4  12 194538. 6679.22  37
  -3   4  12 184647. 6694.27  36
   3   4 -12 182599. 6675.31  34
  -3   4  11 1857.73 212.969  12
  -3  -4  11 1920.08 228.399  14
  -3  -4  11 2481.47 242.107  11
   3  -4 -11 1930.67 238.911  16
   3   4 -11 1937.93 130.977   5
   3  -4 -11 2043.85 128.715   5
   3   4 -11 1973.79 228.632   2
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  -3   4  11 2311.49 234.101   8
   3   4 -11 1566.49 137.453   4
  -3   4  11 1793.52 200.120   1
  -3   4  11 2009.85 122.967   3
   3  -4 -11 2173.64 224.001   2
   3   4 -11 1767.00 126.666 112
   3  -4 -11 1921.03 140.248 116
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   3  -4 -11 1769.69 125.886 108
   3   4 -11 2046.42 155.096 115
   3   4 -11 1830.31 166.575  89
   3   4 -11 1801.16 153.481  96
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   3   4 -11 1827.14 132.982  26
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   3  -4 -11 2014.24 161.298  68
   3  -4 -11 2178.29 154.611  63
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   3   4 -11 1828.34 147.383  78
   3   4 -11 1934.74 141.113  46
   3  -4 -11 2141.52 153.708  53
   3  -4 -11 1880.49 164.647  52
  -3   4  11 2164.97 115.691  51
   3  -4 -11 2072.28 164.678  44
   3   4 -11 2194.31 140.117  47
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   3  -4 -11 2262.89 165.536  38
   3   4 -11 1974.40 130.696  34
  -3   4  11 2103.34 131.521  37
  -3   4  11 2101.02 146.120  36
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   3  -4 -10 27690.6 1261.20  16
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   3   4 -10 25635.3 1107.44   5
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   3  -4 -10 28767.3 1110.89   5
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   3   4 -10 30702.1 1270.93   2
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   3   4 -10 25900.0 1121.68   4
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   3  -4 -10 30996.0 1266.25   2
   3   4 -10 28497.7 1107.34 112
   3  -4 -10 29254.1 1123.82 116
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   3  -4 -10 28478.6 1113.00 108
   3   4 -10 29306.6 1134.50  89
   3   4 -10 29645.0 1129.30  96
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   3   4 -10 30420.2 1111.51  26
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   3   4  -9 4305.56 233.903   5
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   3   4  -9 4676.17 347.554   2
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   3   4  -9 4697.93 231.787  47
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   3   4  -8 58521.4 2331.48   5
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   3   4  -8 60060.3 2488.10   2
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   3   4  -8 58796.4 2346.49   4
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   3   4  -8 62676.9 2326.07  26
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   3  -4  -7 11901.0 613.356  16
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   3   4  -7 11486.5 503.640   5
   3  -4  -7 12767.0 507.820   5
   3   4  -7 11773.2 641.877   2
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   3   4  -7 11721.2 520.593   4
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   3  -4  -7 14196.8 668.184   2
   3   4  -7 11738.8 498.155 112
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   3  -4  -7 12111.5 504.473 108
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   3   4  -7 12512.9 521.147  89
   3  -4  -7 13293.4 499.654  95
   3   4  -7 11813.7 493.802  26
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   3  -4  -7 12385.0 521.499  68
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   3  -4  -7 11930.3 523.672  44
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   3   4  -7 12509.3 500.659  47
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   3  -4  -7 11651.9 513.470  38
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   3   4  -7 12200.1 494.232  34
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   3   4  -6 23691.1 923.451   5
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   3   4  -6 21893.6 932.290   4
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   3   4  -6 23648.2 910.963  34
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   3  -4  -5 2986.11 275.347  17
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   3  -4  -5 2305.52 207.942  16
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   3  -4  -5 2728.88 262.024   2
   3   4  -5 2449.90 154.439   5
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   3  -4  -5 2718.34 160.196   5
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   3   4  -5 2284.35 249.084   2
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   3   4  -5 2478.69 165.633   4
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   3   4  -5 2719.08 150.020 112
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   3   4  -5 2763.92 172.772  99
   3   4  -5 2772.16 170.679  89
   3  -4  -5 2967.99 222.403  22
   3   4  -5 2533.79 141.149  26
   3  -4  -5 2873.32 166.272  68
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   3  -4  -5 2636.55 167.364  52
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   3  -4  -5 2705.91 158.858  38
   3   4  -5 2527.95 140.788  34
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   3  -4  -4 23005.8 1058.08  17
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   3  -4  -4 20959.3 972.873  16
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   3  -4  -4 23598.5 1060.59   2
   3   4  -4 22457.5 902.692   5
   3  -4  -4 22451.3 902.110   5
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   3   4  -4 24685.0 1061.02   2
   3   4  -4 22469.9 915.186   4
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   3   4  -4 23660.4 913.835  99
   3   4  -4 24627.7 898.640 112
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   3  -4  -4 23663.8 904.839 108
   3   4  -4 23850.9 908.720  89
   3   4  -4 23025.6 888.105  26
   3  -4  -4 23404.4 996.344  22
   3  -4  -4 23526.0 907.914  68
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   3   4  -4 23914.9 896.640  46
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   3  -4  -4 23337.3 912.840  44
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   3  -4  -4 24071.9 906.156  38
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   3   7   5 293.543 58.8621  91
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   3  -7   6 24711.3 901.678   5
   3   7   6 21522.9 907.736   4
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   3  -7   6 23560.6 905.264  29
   3  -7   6 21931.2 885.467  27
   3  -7   7 2002.17 133.486   5
   3   7   7 1735.25 141.525   4
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   3   7   7 1784.75 130.662 111
   3   7   7 1787.42 114.395 110
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   3   7   7 1809.51 119.525 118
   3   7   7 1733.01 113.083 104
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   3   7   7 1704.59 144.975  86
   3  -7   7 1790.48 127.588  81
   3   7   7 1594.10 112.076  91
   3   7   7 1838.66 129.841  98
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   3   7   7 2035.66 141.403  84
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   3   7   7 1631.34 151.154  50
   3  -7   7 1882.86 135.358  42
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   3  -7   7 2108.86 145.063  28
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   3  -7   8 6011.19 270.614   5
   3   7   8 5344.58 278.407   4
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   3   7   8 5881.20 263.853 112
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   3   7   8 6111.88 263.480  91
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   3   7   8 5287.84 263.411  97
   3   7   8 6244.27 283.911  84
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   3   7   9 1041.44 107.743   4
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   3   7   9 1304.59 91.6135 118
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   3   7   9 1103.60 94.7810  91
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   3  -7   9 1256.12 107.833  29
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   3  -7  10 1500.77 101.436   5
   3   7  10 1168.68 112.631   4
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   3   7  10 1847.37 117.843 120
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   3   7  10 1131.08 118.584 100
   3   7  10 1393.29 98.5522 110
   3   7  10 1490.98 96.2459 104
   3   7  10 1468.03 94.3330 118
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   3   7  10 1164.28 94.2118 112
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   3   7  10 1420.85 124.382  86
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   3   7  10 1260.13 117.905  84
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   3   7  10 1533.19 136.237  50
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   3  -7  10 1489.55 97.2226  35
   3  -7  10 1346.31 104.164  27
   3   7  11 2775.76 157.526   4
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   3   7  11 5917.53 188.672 120
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   3   7  11 3506.61 151.016 110
   3   7  11 2829.35 156.759 100
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   3  -7  11 3579.71 162.738 108
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   3   7  11 3042.88 169.122  86
   3  -7  11 3635.28 165.733  81
   3   7  11 3370.52 156.745  91
   3   7  11 3187.74 169.368  84
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   3   7  12 261.970 65.2133  91
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   3   7  12 123.090 66.6413  97
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   3  -7  13 68.9170 47.4726 108
   3   7  13 114.866 56.6558  91
   3   7  13 66.4617 61.3388  98
   3   7  13 46.5371 61.0641  97
   3  -7  13 51.7651 54.8040  81
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   3  -7  19 57.2914 33.6463  95
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   3   8 -16 489.970 62.9261  85
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   3   8 -16 599.238 77.0542  99
   3   8 -15 2100.33 122.230 100
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   3   8 -14 2321.22 138.394  85
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   3   8 -13 9530.01 387.790  99
   3   8 -13 9538.03 394.347 106
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   3   8 -13 8772.11 376.191  85
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   3   8 -13 9312.78 380.844  78
   3  -8 -13 8483.56 382.829  71
   3   8 -13 9091.12 360.869  46
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   3  -8 -13 8920.12 375.373  44
   3  -8 -13 8729.00 377.056  29
   3  -8 -12 2023.63 108.429   5
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   3   8 -12 2100.48 148.173 106
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   3   8 -12 1986.51 130.976  85
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   3   8 -12 2007.73 134.793  78
   3  -8 -12 1898.87 132.045  71
   3   8 -12 1980.47 110.492  46
   3  -8 -12 1961.22 136.011  45
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   3  -8 -12 1947.67 122.345  44
   3  -8 -12 1816.39 126.605  29
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   3  -8 -11 4426.00 198.099   5
   3   8 -11 4589.18 229.109  99
   3   8 -11 4826.64 236.424 106
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   3  -8 -11 4725.22 211.263 116
   3   8 -11 4358.85 217.227  85
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   3   8 -11 4604.38 223.189  78
   3  -8 -11 4436.09 221.540  71
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   3   8 -11 4502.44 197.120  46
   3  -8 -11 4351.40 223.945  45
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   3  -8 -11 4499.91 211.037  44
   3  -8 -11 4352.06 218.529  29
   3  -8 -10 5407.17 251.030   5
   3   8 -10 4295.45 253.087   4
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   3   8 -10 5891.43 280.315  99
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   3  -8 -10 5764.01 261.596 116
   3  -8 -10 5297.55 242.145 108
   3   8 -10 5902.73 269.094  85
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   3   8 -10 6009.37 274.442  78
   3  -8 -10 5506.69 271.856  71
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   3   8 -10 5757.65 246.043  46
   3  -8 -10 4906.60 268.536  45
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   3  -8 -10 5266.01 268.139  29
   3  -8  -9 2955.17 163.134   5
   3   8  -9 2711.18 171.292   4
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   3  -8  -9 2903.89 154.590 108
   3   8  -9 3469.33 197.017  99
   3   8  -9 3020.36 178.841  85
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   3  -8  -8 13246.7 508.190   5
   3   8  -8 10917.6 511.040   4
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   3  -8  -8 13922.1 516.614 116
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   3   8  -8 13539.2 528.554  99
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   3  -8  -8 11285.3 513.427  23
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   3   8  -8 13545.6 524.314  78
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   3  -8  -8 12574.2 522.255  45
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   3  -8  -8 12352.9 520.929  29
   3  -8  -7 4134.70 201.698   5
   3   8  -7 3224.91 202.387   4
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   3   8  -7 4479.31 218.947  78
   3  -8  -7 3898.73 204.893  71
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   3  -8  -7 3990.96 211.434  45
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   3  -8  -7 3761.17 209.008  29
  -3   8   6 72.7824 56.6692   3
   3  -8  -6 56.1481 74.3666   5
   3   8  -6 148.740 83.8454   4
   3   8  -6 229.719 95.0040 106
   3   8  -6 167.680 96.8559 120
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   3  -8  -6 69.1552 59.7311 108
   3   8  -6 37.1212 84.0259  85
   3  -8  -6 92.9826 78.2810  23
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   3  -8  -6-19.2270 77.1751  65
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   3   8  -6 185.547 97.1864  78
   3  -8  -6 33.9321 66.9656  71
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   3  -8  -6 29.0127 71.9954  45
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   3  -8  -6 152.170 83.6137  29
   3  -8  -5 23947.2 912.306   5
   3   8  -5 21114.4 916.519   4
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   3   8  -5 23231.8 914.216 106
   3  -8  -5 23590.4 904.105 108
   3   8  -5 24377.5 913.559  85
   3  -8  -5 20737.4 909.250  23
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   3   8  -5 25426.8 922.757  78
   3  -8  -5 24016.7 913.813  71
   3  -8  -5 23240.8 922.471  65
   3  -8  -5 23942.5 917.100  45
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   3  -8  -4 8998.34 381.401   5
   3   8  -4 7978.25 386.695   4
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   3   8  -4 8790.17 382.646 106
   3  -8  -4 8463.01 371.206 108
   3   8  -4 8646.28 384.202 120
   3   8  -4 8993.40 383.254  85
   3  -8  -4 7832.49 377.020  23
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   3   8  -4 8581.57 387.203  78
   3  -8  -4 8769.03 378.184  71
   3  -8  -4 8751.61 390.131  65
   3  -8  -4 8773.35 381.928  45
  -3   8   4 8621.74 373.911  60
  -3   8   4 8182.60 358.304  30
   3  -8  -3 2334.56 149.208   5
   3   8  -3 1691.53 148.546   4
   3   8  -3 1863.21 143.106 106
   3  -8  -3 1996.07 138.548 108
   3   8  -3 2126.19 159.857 120
   3   8  -3 3128.60 169.822 112
   3   8  -3 2303.85 154.345  85
   3   8  -3 2469.42 168.711  94
   3  -8  -3 2090.43 146.365  23
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   3   8  -3 2501.02 163.208  78
   3  -8  -3 2210.43 141.052  71
   3  -8  -3 2281.87 156.808  65
   3  -8  -3 2252.67 146.725  45
  -3   8   3 2241.25 140.915  60
  -3   8   3 2043.01 126.662  30
   3  -8  -2 191.286 79.6582   5
   3   8  -2 155.185 86.3051   4
   3   8  -2 115.509 96.7231 120
   3  -8  -2 253.625 70.3311 108
   3   8  -2 87.1505 84.7028  85
   3   8  -2 177.128 100.846  94
   3  -8  -2 189.770 73.2820  23
   3  -8  -2 164.479 79.5427  65
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   3  -8  -2 130.050 60.3077  71
  -3   8   2 248.591 65.9008  60
   3   8  -2 305.967 96.3408  50
   3  -8  -2 237.977 71.7692  45
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   3  -8  -2 59.2539 82.8434  28
   3  -8  -2 151.347 76.5347  29
   3  -8  -1 917.732 104.080   5
   3   8  -1 901.231 113.690   4
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   3   8  -1 902.881 123.962 120
  -3   8   1 943.664 90.2198 103
   3  -8  -1 847.334 98.2903 108
   3   8  -1 940.528 123.326  94
   3  -8  -1 908.132 100.430  23
   3  -8  -1 776.037 102.741  65
  -3   8   1 940.398 76.1926  79
   3  -8  -1 1000.81 93.5199  71
  -3   8   1 1012.21 92.4460  60
   3   8  -1 988.427 121.240  50
   3  -8  -1 976.842 99.0450  45
  -3   8   1 887.457 85.8640  30
   3  -8  -1 980.125 107.388  28
   3  -8  -1 935.331 106.945  29
   3   8   0 3232.13 205.416   4
  -3   8   0 3705.77 188.426   3
  -3   8   0 3513.82 185.947 103
   3  -8   0 3471.13 195.113 108
   3   8   0 3917.30 199.365 112
   3  -8   0 3731.21 170.620  81
   3   8   0 3650.54 209.345  94
   3  -8   0 3278.53 192.267  23
   3  -8   0 3463.13 199.834  65
  -3   8   0 3470.02 169.068  79
   3  -8   0 3529.15 201.914  66
  -3   8   0 3830.26 191.426  75
   3   8   0 3545.30 217.088  50
   3  -8   0 3845.38 195.955  45
  -3   8   0 3675.68 189.435  60
  -3   8   0 3646.54 183.620  30
   3  -8   0 3648.77 201.993  29
   3  -8   0 3978.63 205.718  28
  -3   8  -1 2167.29 126.448   3
  -3   8  -1 1852.79 121.296 103
   3  -8   1 1988.62 133.784 108
   3   8   1 2003.02 133.321 112
   3   8   1 2190.07 155.857  86
   3  -8   1 1883.77 106.532  81
   3   8   1 2029.86 154.370  94
   3  -8   1 1726.45 127.586  23
   3  -8   1 1877.24 133.313  65
   3  -8   1 2056.85 140.771  66
   3   8   1 2355.93 163.135  50
  -3   8  -1 2084.63 123.672  60
   3  -8   1 2094.68 130.937  45
  -3   8  -1 1862.22 119.628  30
   3  -8   1 2021.54 136.843  29
   3  -8   1 2058.62 137.429  28
   3  -8   2 2099.48 141.143   5
  -3   8  -2 2072.68 128.636   3
   3   8   2 2235.03 163.648 100
  -3   8  -2 2195.62 131.422 103
   3  -8   2 1934.37 134.689 108
   3   8   2 1930.10 135.629 112
   3   8   2 1955.12 149.565  86
   3  -8   2 2018.02 112.932  95
   3   8   2 2060.53 156.781  94
   3  -8   2 2238.22 118.873  81
   3  -8   2 1892.24 131.437  23
   3  -8   2 2057.96 141.132  65
   3   8   2 2414.24 166.862  50
   3  -8   2 2017.16 138.542  29
   3  -8   2 2409.87 148.253  28
   3   8   3 101.370 71.7253 112
  -3   8  -3 47.3526 59.9815 103
   3   8   3 83.7154 58.2558 111
   3   8   3 42.6699 97.3338 100
   3   8   3 5.44011 94.1466 120
   3  -8   3-5.53650 64.0129 108
   3   8   3 131.458 89.6623  86
   3  -8   3 62.3040 48.3432  81
   3   8   3 25.1598 79.3361  84
   3  -8   3 77.3231 44.6668  95
   3   8   3 69.9143 95.3653  94
   3  -8   3 82.8136 64.2164  23
   3  -8   3 166.798 70.7843  65
   3  -8   3 85.8844 73.9531  28
   3  -8   3 131.722 73.0927  29
  -3   8  -3 55.1673 57.4984   3
   3  -8   3 125.389 72.6870   5
   3   8   3 19.1994 80.4157   4
   3  -8   4 2427.13 148.413   5
   3   8   4 2114.77 157.168   4
  -3   8  -4 2217.53 135.405   3
   3   8   4 2253.80 136.622 111
   3   8   4 2451.55 157.051 120
  -3   8  -4 2567.97 145.952 103
   3   8   4 2484.39 168.647 100
   3   8   4 2372.24 143.303 112
   3   8   4 2362.43 161.765  86
   3   8   4 2263.44 149.998  84
   3  -8   4 2365.59 127.881  95
   3   8   4 2333.13 167.260  94
   3  -8   4 2200.68 131.788  81
   3  -8   4 2410.31 145.723  23
   3  -8   4 2459.84 152.683  65
   3  -8   4 2410.93 146.860  42
   3  -8   4 2538.20 155.319  28
  -3   8  -4 2500.81 140.847  30
   3  -8   4 2441.91 148.287  29
  -3   8  -5 582.238 69.3963   3
   3  -8   5 731.740 88.2052   5
   3   8   5 516.625 95.1753   4
  -3   8  -5 497.457 77.4542 103
   3   8   5 481.212 77.1268 111
   3   8   5 524.771 107.307 100
   3   8   5 719.528 89.5119 112
   3   8   5 508.294 97.0756  86
   3   8   5 554.996 90.8248  84
   3  -8   5 407.960 66.7436  81
   3  -8   5 478.551 63.7384  95
   3   8   5 522.110 109.341  94
   3  -8   5 532.355 79.0551  23
  -3   8  -5 572.161 77.5631  75
   3   8   5 334.269 98.4896  50
   3  -8   5 598.172 86.5617  42
  -3   8  -5 583.487 73.6046  30
   3  -8   5 512.345 87.0280  28
   3  -8   5 487.145 81.8535  29
   3  -8   6 1801.95 123.633   5
   3   8   6 1615.98 133.765   4
  -3   8  -6 1898.56 115.150   3
   3   8   6 1778.38 121.967 111
   3   8   6 1606.51 142.043 100
   3  -8   6 1613.95 124.801 108
  -3   8  -6 2129.30 130.535 103
   3   8   6 2306.18 130.391 112
   3   8   6 1785.67 140.783  86
   3   8   6 1782.88 131.985  84
   3  -8   6 1849.97 112.010  95
   3   8   6 1830.59 147.223  94
   3  -8   6 1750.30 116.451  81
   3  -8   6 1919.54 123.179  23
  -3   8  -6 1886.07 122.204  75
   3   8   6 1744.12 146.403  50
   3  -8   6 1847.39 129.404  42
  -3   8  -6 1911.81 119.241  30
   3  -8   6 1846.51 124.351  29
  -3   8  -7 7.50612 48.4817   3
   3  -8   7-24.2480 56.8053   5
   3   8   7-57.6601 68.6663   4
  -3   8  -7-79.0848 61.6604 103
   3   8   7 41.9653 62.1591 111
   3   8   7 50.4537 87.8897 100
   3  -8   7 14.7450 61.1192 108
   3   8   7 34.8624 82.1245  86
   3   8   7 50.6921 70.4825  84
   3  -8   7 65.4431 54.3455  81
   3  -8   7 44.7666 46.6484  95
   3   8   7 92.2356 93.6248  94
   3  -8   7 104.624 57.2502  23
  -3   8  -7 31.5999 57.8756  75
   3   8   7-33.7040 79.7600  50
   3  -8   7 57.8388 61.9418  42
  -3   8  -7-32.7532 51.5837  30
   3  -8   7-9.12504 59.6338  29
  -3   8  -8 548.131 63.5015   3
   3  -8   8 465.961 68.7536   5
   3   8   8 409.259 77.9736   4
  -3   8  -8 520.233 80.0628 103
   3   8   8 474.942 75.8453 111
   3   8   8 444.496 92.1352 100
   3  -8   8 476.518 73.6015 108
   3   8   8 522.267 91.7530  86
   3   8   8 499.989 83.5714  84
   3  -8   8 458.978 67.1832  81
   3  -8   8 438.852 62.6723  95
   3  -8   8 458.568 69.6614  23
  -3   8  -8 442.366 71.9285  75
   3  -8   8 613.688 82.2440  66
   3   8   8 434.451 91.0358  50
   3  -8   8 509.491 76.5675  42
  -3   8  -8 641.463 68.7583  30
   3  -8   8 487.061 52.7576  35
   3  -8   8 470.811 72.4043  29
  -3   8  -9 12441.6 487.189   3
   3  -8   9 12161.3 489.203   5
   3   8   9 9983.08 495.185   4
   3   8   9 12335.0 499.182 111
   3   8   9 12194.0 503.285 100
   3  -8   9 13302.8 505.226 108
  -3   8  -9 12699.0 505.809 103
   3  -8   9 12099.1 497.189  81
  -3   8  -9 13298.2 508.094  82
   3   8   9 12624.3 506.518  86
   3   8   9 11810.3 501.969  84
   3  -8   9 12570.1 495.251  95
   3  -8   9 13099.6 498.663  23
  -3   8  -9 12580.8 500.255  75
   3  -8   9 12886.8 512.156  66
   3   8   9 12758.9 522.686  50
   3  -8   9 12622.9 505.185  42
  -3   8  -9 13376.5 497.426  30
   3  -8   9 13017.1 500.206  29
  -3   8 -10 10889.0 417.490   3
  -3   8 -10 11814.2 423.378   4
   3   8  10 8371.93 423.017   4
   3   8  10 9831.67 430.766 111
   3  -8  10 11566.1 435.504 108
  -3   8 -10 10457.1 437.436 103
   3   8  10 9811.49 433.858  86
  -3   8 -10 11333.8 440.684  82
   3   8  10 9736.43 432.110  84
   3  -8  10 10683.2 427.585  95
   3  -8  10 10680.7 430.628  81
   3  -8  10 11553.5 431.900  23
  -3   8 -10 11297.3 433.921  75
   3  -8  10 10912.3 442.958  66
   3   8  10 11195.5 453.608  50
   3  -8  10 10737.3 436.308  42
   3  -8  10 10534.0 436.990  28
  -3   8 -10 10750.1 426.365  30
   3  -8  10 10957.1 429.813  29
   3   8  11 1620.22 107.119 111
   3  -8  11 1626.73 99.8368 108
  -3   8 -11 1700.36 110.827 103
  -3   8 -11 1681.37 109.259  82
   3   8  11 1454.82 106.780  84
   3  -8  11 1604.97 99.3783  95
   3  -8  11 1687.66 102.823  81
   3  -8  11 1623.44 98.8509  23
  -3   8 -11 1846.26 105.900  75
   3   8  11 1816.95 121.279  50
   3  -8  11 1675.09 108.786  42
   3  -8  11 1606.10 108.471  28
  -3   8 -11 1833.62 96.4083  30
   3  -8  11 1717.60 99.0412  29
  -3   8 -12 88.6736 60.0069 103
   3   8  12 117.861 53.7228 111
   3  -8  12 81.1566 43.2388 108
   3   8  12 50.2972 44.2447  97
  -3   8 -12 49.9227 54.9902  82
   3  -8  12 66.6220 45.9919  81
   3  -8  12 95.4634 45.1362  95
   3  -8  12 32.2923 41.4838  23
  -3   8 -12 71.0712 47.8923  75
   3  -8  12 39.9644 31.0966  73
   3   8  12 78.5155 58.2393  50
   3  -8  12 93.3739 50.2018  42
  -3   8 -12 79.8978 38.4657  30
   3  -8  12 73.4709 50.9217  28
   3  -8  12 71.0699 42.5468  29
  -3   8 -13 32.1789 53.1446 103
   3   8  13 49.9260 45.1045  97
  -3   8 -13 38.8564 49.5383  82
   3  -8  13 3.05987 41.3889  81
   3  -8  13 58.9698 41.9461  95
   3  -8  13 23.6266 41.4535  23
  -3   8 -13 25.5821 42.9469  75
   3  -8  13 30.9218 30.7313  73
   3   8  13 55.2739 51.4630  50
   3  -8  13 48.9985 47.6593  42
  -3   8 -13 51.7756 32.2628  30
   3  -8  13 3.31299 46.5587  28
   3  -8  13 28.8477 35.8096  29
  -3   8 -14 5458.18 226.447  82
   3   8  14 4601.19 213.039  97
   3  -8  14 5345.97 218.803  95
   3  -8  14 5724.90 221.741  81
   3  -8  14 5548.61 214.681  23
  -3   8 -14 5159.61 214.127  75
   3  -8  14 4858.50 206.520  61
   3  -8  14 4804.04 203.324  73
  -3   8 -14 4698.93 222.924 103
   3  -8  14 5529.66 223.234  28
  -3   8 -14 5066.48 207.083  30
   3  -8  14 5143.54 208.613  29
  -3   8 -15 2815.17 145.560 103
  -3   8 -15 3281.46 146.213  82
   3   8  15 2728.75 137.221  97
   3  -8  15 3299.21 141.091  95
   3  -8  15 3610.31 144.183  81
   3  -8  15 3417.55 136.034  23
   3  -8  15 2765.06 126.563  73
   3  -8  15 2748.90 126.303  61
   3  -8  15 3404.53 144.713  28
   3   8  16 1144.24 72.0754  97
   3  -8  16 1428.63 74.7024  95
   3  -8  16 1363.13 67.4357  23
  -3   8 -16 1300.85 79.9324 103
   3  -8  16 1394.57 76.0329  28
   3  -8  16 1199.27 61.5402  73
   3  -8  17 846.212 53.6295  95
   3  -8  17 965.611 55.8513  28
  -3   8 -17 766.544 58.7550 103
  -3   8 -18 566.111 41.5425 103
   3  -8  18 692.831 39.6141  95
  -3   9  15 1399.44 63.7379  79
   3   9 -15 1244.40 75.4212  86
  -3   9  14 2533.96 98.3244  79
   3  -9 -14 2110.35 108.938  71
  -3  -9  14 2341.18 104.362  24
   3  -9 -14 2138.86 107.812  45
   3  -9 -14 2650.61 111.339  90
   3   9 -14 2155.61 106.829  94
   3   9 -13 2628.37 135.129  85
   3   9 -13 3136.08 145.551  94
   3  -9 -13 2741.41 143.413  23
  -3  -9  13 3580.09 142.296  24
  -3   9  13 3667.87 134.305  79
   3  -9 -13 3065.83 143.956  71
   3  -9 -13 3332.56 146.370  45
   3  -9 -13 2970.44 141.498  29
   3   9 -12 1886.83 113.860 106
   3  -9 -12 1965.74 90.2884 116
   3   9 -12 1754.80 96.5690 100
   3   9 -12 1857.56 100.054  85
   3   9 -12 1894.43 107.739  94
  -3   9  12 2099.21 90.6528  79
   3  -9 -12 1804.59 101.957  71
   3  -9 -12 1980.25 105.805  45
   3  -9 -12 1702.12 102.723  29
   3  -9 -11 860.752 55.4864   5
   3   9 -11 991.833 89.2840 106
  -3   9  11 1026.26 64.4707 117
   3  -9 -11 958.399 65.5068 116
   3   9 -11 869.105 77.3678 100
   3   9 -11 1002.41 77.3155  85
   3   9 -11 759.225 80.2971  94
   3  -9 -11 894.614 77.3931  23
   3  -9 -11 859.594 72.3724  71
  -3   9  11 1177.89 61.2720  79
   3  -9 -11 771.807 76.0828  65
   3  -9 -11 1114.48 77.8119  45
  -3  -9  11 944.638 60.1389  49
   3  -9 -11 820.120 75.5864  29
   3  -9 -10 6510.28 262.016   5
   3   9 -10 6657.69 282.639 106
  -3   9  10 6766.08 266.415 117
   3  -9 -10 7439.60 273.056 116
   3   9 -10 7176.90 280.028 100
   3   9 -10 6996.82 276.130  85
   3   9 -10 6809.06 279.376  94
   3  -9 -10 6072.51 275.236  23
   3  -9 -10 7166.46 277.126  71
  -3   9  10 7362.58 261.820  79
   3  -9 -10 6650.64 283.542  65
   3  -9 -10 6650.78 276.594  45
  -3  -9  10 6775.96 262.530  49
   3  -9 -10 6261.13 276.651  29
  -3   9   9 1625.45 87.5949   3
   3  -9  -9 1772.80 94.4719   5
  -3   9   9 2090.79 96.6446   4
   3   9  -9 1040.98 95.0846   4
   3  -9  -9 1876.21 101.782 116
  -3   9   9 1789.77 95.5046 117
   3   9  -9 1749.38 115.948 100
   3   9  -9 1801.05 107.797  85
   3   9  -9 1774.73 113.680  94
   3  -9  -9 1418.95 103.703  23
  -3   9   9 1857.31 89.2140  79
   3  -9  -9 1781.34 104.765  71
  -3   9   9 1678.96 84.6539  77
   3  -9  -9 1569.16 108.901  65
   3  -9  -9 1691.29 102.892  45
  -3  -9   9 1536.99 90.9385  49
   3  -9  -9 1516.57 105.728  29
   3  -9  -9 1508.33 99.7258  28
  -3   9   8 1704.13 90.5212   3
   3  -9  -8 1737.37 98.6268   5
  -3   9   8 1820.26 97.3453   4
   3   9  -8 1102.41 98.0288   4
  -3   9   8 1721.66 95.1484 117
   3  -9  -8 1481.47 83.7449 108
   3  -9  -8 1820.14 103.338 116
   3   9  -8 1476.97 117.264 100
   3   9  -8 1807.72 109.603  85
   3   9  -8 1492.83 111.062  94
   3  -9  -8 1506.29 103.524  23
   3  -9  -8 1657.71 112.523  65
  -3   9   8 1693.64 85.8526  79
   3  -9  -8 1781.64 102.991  71
  -3   9   8 1635.35 87.5109  77
   3  -9  -8 1612.43 103.524  45
   3  -9  -8 1543.80 108.140  29
   3  -9  -8 1479.56 101.155  28
  -3   9   7 44.3358 38.5529   3
   3  -9  -7 58.8199 52.0133   5
  -3   9   7 95.3574 46.5604   4
   3   9  -7 4.00063 54.4656   4
  -3   9   7 66.4746 41.1470 117
   3   9  -7 4.21723 76.2469 100
   3  -9  -7 32.7770 49.9087 116
   3  -9  -7 36.2767 34.5945 108
   3   9  -7-7.26569 58.5539  85
   3   9  -7 38.7822 69.2469  94
   3  -9  -7 66.1103 52.8291  23
   3  -9  -7 74.7397 55.7954  65
   3  -9  -7 59.1779 47.9113  71
  -3   9   7 2.36352 39.9622  77
   3  -9  -7-7.25474 49.3876  45
   3  -9  -7 47.3072 53.7955  28
  -3   9   6 3116.88 143.875   3
   3  -9  -6 3360.23 155.048   5
   3   9  -6 2464.86 156.508   4
  -3   9   6 2890.73 144.104 117
   3  -9  -6 3212.62 155.229 116
   3  -9  -6 2830.86 141.248 108
   3   9  -6 3094.50 169.565 100
   3   9  -6 2609.74 159.876  94
   3  -9  -6 2616.07 151.667  23
   3  -9  -6 2889.55 160.501  65
   3  -9  -6 3043.35 148.305  71
  -3   9   6 2873.66 138.437  77
   3  -9  -6 2996.05 151.381  45
   3  -9  -6 3045.86 155.742  28
  -3   9   5 1923.95 108.262   3
   3  -9  -5 2105.83 119.897   5
   3   9  -5 1640.40 123.696   4
   3  -9  -5 2169.10 121.759 116
  -3   9   5 1966.57 110.529 117
   3  -9  -5 2027.72 111.055 108
   3   9  -5 1863.05 136.851 100
   3   9  -5 1979.32 130.364  94
   3  -9  -5 1769.49 115.735  23
   3  -9  -5 1999.97 126.665  65
  -3   9   5 1908.26 104.774  77
   3  -9  -5 1803.42 112.560  45
  -3   9   5 1788.68 97.6460  30
   3  -9  -5 2018.82 122.238  28
  -3   9   4 1764.74 105.278   3
   3  -9  -4 1986.08 118.102   5
   3   9  -4 1501.66 121.502   4
  -3   9   4 1786.48 105.602 117
   3  -9  -4 1728.43 105.253 108
   3   9  -4 1850.31 138.299 100
   3   9  -4 1715.16 124.173  94
   3  -9  -4 1605.93 109.716  23
   3  -9  -4 1655.51 116.517  65
   3  -9  -4 1760.61 120.136  66
  -3   9   4 1836.42 102.145  77
   3  -9  -4 1886.39 109.902  45
  -3   9   4 1746.90 95.6118  30
   3  -9  -4 1645.58 116.398  29
   3  -9  -4 1765.19 115.276  28
   3  -9  -3 914.409 82.8811   5
   3   9  -3 809.001 93.8768   4
  -3   9   3 873.434 77.3763 102
  -3   9   3 895.268 75.1911 117
   3   9  -3 846.828 106.166 100
   3  -9  -3 935.982 77.2524 108
   3   9  -3 1004.14 101.964  94
   3  -9  -3 799.468 80.3696  23
   3  -9  -3 884.166 86.1415  65
   3  -9  -3 890.107 88.2218  66
  -3   9   3 998.342 75.2745  77
   3  -9  -3 803.430 75.6019  45
  -3   9   3 805.741 65.7623  30
   3  -9  -3 870.599 85.6487  29
   3  -9  -3 837.387 84.4366  28
  -3   9   2 52.4012 48.3362 117
   3   9  -2 53.9590 89.0416 100
  -3   9   2 79.9145 49.1652 102
   3  -9  -2 58.0598 49.3766 108
   3   9  -2 96.3188 78.6228  94
   3  -9  -2 64.1038 53.6929  23
   3  -9  -2 85.9762 59.7563  65
   3  -9  -2 56.2125 59.0555  66
   3  -9  -2 139.034 63.4824   5
   3   9  -2 96.2625 69.2950   4
  -3   9   2 39.7673 40.3877  30
   3  -9  -2 195.056 64.1445  28
   3  -9  -2 109.575 61.0304  29
  -3   9   1 1549.37 103.332 102
   3  -9  -1 1476.95 103.238 108
   3   9  -1 1631.33 133.323 100
   3   9  -1 1492.40 125.515  86
   3   9  -1 1470.23 124.340  94
   3  -9  -1 1256.56 100.244  23
   3  -9  -1 1540.25 110.962  65
  -3   9   1 1358.91 91.7655  30
   3  -9  -1 1487.52 110.298  29
   3  -9  -1 1561.59 110.212  28
  -3   9   1 1429.31 96.8551   3
   3  -9  -1 1262.69 105.067   5
   3   9  -1 1169.67 115.697   4
  -3   9   0 4639.02 209.868   3
   3   9   0 3851.37 223.876   4
  -3   9   0 4746.20 212.363 102
   3  -9   0 4775.92 216.699 108
   3   9   0 4841.80 229.303  86
   3   9   0 4946.51 220.983  84
   3   9   0 5027.13 229.866  94
   3  -9   0 4351.35 210.953  23
   3  -9   0 4636.02 220.161  65
   3  -9   0 4498.06 212.783  42
   3  -9   0 4600.60 219.012  28
  -3   9   0 4388.07 205.199  30
   3  -9   0 4852.25 219.550  29
  -3   9  -1 4434.14 204.192   3
  -3   9  -1 4553.32 208.640 102
   3  -9   1 4705.08 214.778 108
   3   9   1 4798.86 225.332  86
   3   9   1 4448.83 214.305  84
   3   9   1 4842.96 225.687  94
   3  -9   1 4380.87 206.910  23
   3  -9   1 4489.78 213.833  65
   3  -9   1 4531.58 211.038  42
   3  -9   1 4557.80 215.562  28
  -3   9  -1 4382.67 201.968  30
   3  -9   1 4511.91 212.899  29
  -3   9  -2 469.255 58.3312   3
   3  -9   2 429.682 69.2575   5
   3   9   2 432.738 85.5108  86
   3   9   2 360.995 76.1349  84
   3   9   2 428.931 84.8495  94
   3   9   2 431.293 95.6890 100
  -3   9  -2 388.602 61.5311 102
   3  -9   2 353.186 63.8817 108
   3  -9   2 514.559 64.4754  23
   3  -9   2 328.598 62.6341  42
  -3   9  -2 323.251 54.8837  30
   3  -9   2 392.659 69.8026  28
   3  -9   2 477.238 70.1638  29
  -3   9  -3 73.5189 46.8696   3
   3  -9   3 73.7451 56.6824   5
   3   9   3-4.72247 63.7218   4
   3   9   3 38.4994 74.4130  86
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   4   1  12 2591.24 243.383  19
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   4   1  12 2761.31 156.504  73
   4  -1  12 2955.38 160.455  70
   4   1  12 2780.76 158.278  70
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   4  -1  12 2728.38 155.523  28
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   4  -2   1 78.9622 52.5351 116
   4   2   1 81.8183 54.5967 104
   4  -2   1 80.5951 60.7632 108
   4   2   1 77.4767 52.6786  80
   4   2   1 37.8595 54.4569  83
   4  -2   1 112.847 54.3942  23
   4   2   1 12.9067 62.6512  26
   4  -2   1 7.28411 47.4959  73
  -4   2  -1-8.20679 48.8481  54
   4  -2   1 44.4862 70.9224  45
  -4   2  -1 41.5812 60.0933  37
   4  -2   1 45.8624 58.5008  29
  -4   2  -2 19504.3 816.567  12
  -4  -2  -2 16960.8 811.808  12
  -4   2  -2 17044.1 767.038   9
   4   2   2 18518.3 687.835   5
   4  -2   2 17686.0 684.141   5
  -4  -2  -2 16815.1 800.651   8
  -4   2  -2 17803.5 798.353   8
   4   2   2 16949.7 835.630   2
   4  -2   2 16737.1 831.449   2
   4   2   2 17607.9 678.371 110
   4  -2   2 16339.2 681.274 108
   4   2   2 17546.4 675.833 107
   4   2   2 17507.3 674.696  80
   4  -2   2 18663.5 684.843  95
   4   2   2 16705.2 671.253  83
   4  -2   2 15983.4 671.282  23
  -4   2  -2 17850.0 793.477  18
   4   2   2 15747.4 752.397  19
   4   2   2 18054.0 677.907  26
   4  -2   2 17021.7 667.766  73
   4   2   2 16013.4 660.412  70
  -4   2  -2 17095.2 668.369  54
  -4   2  -2 17434.7 677.314  37
   4  -2   2 17375.8 679.041  29
   4   2   3 482.471 158.173   2
   4  -2   3 572.507 162.912   2
   4   2   3 658.246 87.3120   5
   4  -2   3 563.927 85.2479   5
  -4   2  -3 474.400 118.513   9
  -4  -2  -3 517.953 127.217   8
  -4   2  -3 502.389 122.705   8
   4   2   3 577.187 75.5329 107
   4  -2   3 701.135 74.1334 119
   4   2   3 653.160 81.4161 110
   4  -2   3 619.610 78.4899 108
   4   2   3 846.301 79.7170  83
   4  -2   3 630.960 76.0643  95
   4   2   3 675.918 73.8532  80
   4  -2   3 642.619 76.8975  23
   4   2   3 635.235 119.941  19
   4   2   3 603.455 80.9013  26
   4  -2   3 563.011 70.4711  73
   4   2   3 622.543 67.2345  70
  -4   2  -3 786.764 143.918  12
  -4  -2  -3 657.014 153.857  12
  -4   2  -3 637.968 133.484  18
  -4   2  -3 554.836 70.8607  30
  -4   2  -3 579.359 74.6193  37
   4  -2   3 567.686 75.4235  29
   4   2   4 873.981 167.040   2
   4  -2   4 954.543 96.2156   5
   4  -2   4 986.073 175.794   2
   4   2   4 920.089 94.9667   5
  -4   2  -4 899.204 144.156   9
  -4  -2  -4 986.680 151.696   8
  -4   2  -4 618.107 127.162   8
   4   2   4 921.952 88.4809 105
   4   2   4 876.702 91.7767 110
   4   2   4 871.932 88.0888 119
   4  -2   4 984.617 87.5083 119
   4  -2   4 973.296 89.4765 108
   4  -2   4 921.147 91.0624  95
   4   2   4 942.029 87.1235  83
   4   2   4 763.787 82.4764  80
   4  -2   4 839.260 84.1200  23
   4   2   4 974.228 92.7988  26
   4   2   4 870.551 137.320  19
   4  -2   4 768.742 83.1429  73
   4   2   4 899.502 78.8131  70
  -4   2  -4 1167.78 88.8891  30
  -4   2  -4 870.426 81.1654  37
   4  -2   4 1029.14 95.9992  29
  -4   2  -4 1093.80 162.546  12
  -4  -2  -4 1101.03 179.895  12
  -4   2  -4 979.097 165.371  18
  -4   2  -5 1812.01 199.986  12
  -4  -2  -5 1490.01 200.073  12
  -4   2  -5 1185.04 179.394  18
  -4   2  -5 2015.74 203.382   9
   4   2   5 1582.03 124.295   5
   4  -2   5 1979.10 126.093   5
   4   2   5 2113.81 234.828   2
  -4   2  -5 1734.73 181.450   8
   4  -2   5 1954.48 229.278   2
   4   2   5 1667.37 123.323 110
   4   2   5 1838.10 119.083 105
   4   2   5 1846.14 121.225 119
   4  -2   5 1828.68 116.747 119
   4  -2   5 2038.98 124.285 108
   4   2   5 1699.42 126.055  91
   4   2   5 1492.27 110.861  80
   4  -2   5 1843.20 123.200  95
   4   2   5 2081.80 121.416  83
   4  -2   5 1613.57 114.516  23
   4   2   5 1964.95 189.556  19
   4  -2   5 1518.12 112.946  73
   4   2   5 1622.79 108.619  70
  -4   2  -5 1724.58 117.356  51
  -4   2  -5 1699.35 114.642  30
   4  -2   5 1867.75 116.983  28
  -4   2  -5 1829.11 111.878  37
   4  -2   5 1772.22 122.893  29
   4   2   5 1699.33 109.933  29
  -4   2  -6 6646.91 397.918  12
  -4  -2  -6 6222.09 412.171  12
  -4   2  -6 6883.89 397.121   9
   4   2   6 6329.50 287.600   5
   4  -2   6 6384.51 284.722   5
   4   2   6 6285.27 413.325   2
   4  -2   6 6531.42 413.771   2
   4   2   6 6324.64 283.666 105
   4   2   6 6796.67 289.469 110
   4   2   6 6483.16 286.739 119
   4  -2   6 6169.96 282.353 108
   4  -2   6 6442.54 282.774 119
   4   2   6 6386.45 290.262  91
   4   2   6 6120.54 274.982  80
   4  -2   6 6560.37 288.979  95
   4   2   6 6174.71 279.052  83
   4  -2   6 5812.69 280.079  23
   4   2   6 5362.80 359.342  19
  -4   2  -6 5893.91 400.396  18
   4   2   6 5859.28 281.097  73
   4  -2   6 6160.82 280.207  73
   4   2   6 6068.88 275.125  70
  -4   2  -6 6668.71 283.551  51
  -4   2  -6 6166.19 278.322  30
   4  -2   6 6437.65 280.492  28
   4  -2   6 6710.06 290.564  29
   4   2   6 6278.70 276.277  29
  -4   2  -7 1901.07 209.491  12
  -4  -2  -7 1851.80 225.108  12
  -4   2  -7 1991.20 227.299  18
   4   2   7 2089.15 132.028   5
   4   2   7 1813.65 219.492   2
   4  -2   7 2036.34 130.745   5
   4  -2   7 2142.76 231.211   2
  -4  -2  -7 1856.71 227.053   9
  -4   2  -7 1996.38 216.548   9
   4   2   7 2021.62 130.802 105
   4   2   7 2020.01 134.800 110
   4   2   7 2192.03 135.731 119
   4  -2   7 2097.85 127.892 108
   4  -2   7 1982.84 129.575 119
   4   2   7 2001.57 140.929  91
   4   2   7 1938.45 120.955  80
   4  -2   7 2152.23 136.835  95
   4   2   7 2075.89 130.368  83
   4  -2   7 2182.16 133.074  23
   4   2   7 2230.21 214.295  19
   4   2   7 1967.53 131.989  73
   4  -2   7 1984.24 129.555  73
   4   2   7 2064.13 123.755  70
  -4   2  -7 2004.90 127.103  51
  -4   2  -7 2256.62 128.025  30
   4  -2   7 2002.10 128.141  28
  -4   2  -7 1990.90 130.980  39
   4  -2   7 1821.62 133.086  29
   4   2   7 2100.14 125.504  29
  -4   2  -8 207.834 117.051  12
  -4  -2  -8 391.429 146.280  12
  -4   2  -8 247.057 123.284  18
  -4  -2  -8 227.527 109.575  18
   4   2   8 220.490 118.494   2
   4  -2   8 145.410 119.485   2
   4   2   8 304.325 68.0946   5
   4  -2   8 385.111 67.3944   5
  -4  -2  -8 265.223 136.494   9
  -4   2  -8 298.834 136.415   9
   4   2   8 332.918 70.7965 119
   4   2   8 290.584 73.9862 110
   4   2   8 311.181 70.7761 105
   4  -2   8 282.935 64.4240 119
   4  -2   8 314.094 59.8119 108
   4   2   8 260.762 82.0140  91
  -4   2  -8 333.784 66.7831  82
   4   2   8 243.532 57.3406  80
   4  -2   8 306.156 68.7845  95
   4   2   8 244.643 64.7919  83
   4  -2   8 185.599 62.1132  23
   4   2   8 263.707 113.391  19
   4   2   8 237.165 69.2948  73
   4  -2   8 418.263 71.1751  73
   4   2   8 338.118 64.4903  70
  -4   2  -8 398.645 64.8714  51
  -4   2  -8 362.037 68.8178  56
  -4   2  -8 254.175 57.2842  30
  -4   2  -8 313.875 66.5404  39
   4  -2   8 294.197 67.0038  28
   4  -2   8 302.064 74.5305  29
   4   2   8 263.459 63.8922  29
  -4   2  -9 9940.20 537.212  12
  -4  -2  -9 9768.00 567.456  12
  -4   2  -9 9326.75 559.451  18
  -4  -2  -9 11580.6 590.321   9
  -4  -2  -9 8804.19 531.074  18
  -4   2  -9 9588.08 543.018   9
   4   2   9 9641.75 413.223   5
   4  -2   9 10229.3 412.630   5
   4   2   9 9224.70 536.367   2
   4  -2   9 9630.17 534.581   2
   4   2   9 10239.5 421.484 105
   4   2   9 9635.86 419.902 110
   4  -2   9 10017.0 418.592 119
   4   2   9 10261.7 422.799 119
   4   2   9 9634.04 423.808  91
  -4   2  -9 9594.45 418.985  82
   4   2   9 9881.97 403.423  80
   4  -2   9 10003.1 420.898  95
   4   2   9 9702.93 413.725  83
   4  -2   9 9916.11 416.908  23
   4   2   9 9155.59 523.578  19
   4   2   9 9918.98 415.801  73
   4  -2   9 9721.53 416.840  73
   4   2   9 9784.00 411.493  70
  -4   2  -9 9878.76 410.857  51
  -4   2  -9 10690.2 422.838  56
  -4   2  -9 10063.8 407.535  30
   4  -2   9 10750.5 419.533  28
  -4   2  -9 9917.22 413.779  39
   4  -2   9 10269.2 423.838  29
   4  -2   9 9739.85 415.149  35
   4   2   9 10479.9 416.290  29
  -4   2 -10 280.817 119.328  12
  -4  -2 -10 64.3656 117.531  12
  -4   2 -10 22.1058 132.017  18
  -4  -2 -10 117.788 121.195  18
   4   2  10 153.354 109.609   2
   4  -2  10 116.217 107.846   2
   4   2  10 158.952 62.9563   5
   4  -2  10 182.628 58.0349   5
  -4  -2 -10 256.076 135.845   9
  -4   2 -10 190.309 131.609   9
   4   2  10 141.295 67.1710 119
   4   2  10 234.063 72.4708 105
   4  -2  10 210.888 67.7127 119
   4   2  10 134.434 71.2451 110
   4   2  10 127.273 81.8527  91
   4   2  10 148.089 47.4723  80
  -4   2 -10 189.142 68.7476  82
   4  -2  10 279.043 66.6599  95
   4  -2  10 258.585 64.9709  23
   4   2  10 248.046 124.602  19
   4   2  10 149.557 65.2690  73
   4  -2  10 198.425 70.2413  73
   4  -2  10 160.559 71.2264  70
   4   2  10 161.253 61.6644  70
  -4   2 -10 158.327 58.0111  51
   4   2  10 174.363 46.3933  61
  -4   2 -10 195.711 67.8761  56
  -4   2 -10 188.704 62.7681  39
   4  -2  10 208.699 71.0526  28
   4  -2  10 200.690 66.1707  35
  -4   2 -10 152.225 50.7889  30
   4   2  10 80.8915 56.2153  28
   4  -2  10 111.316 70.1697  29
   4   2  10 116.510 66.8171  29
  -4   2 -11 368.229 118.485  12
  -4  -2 -11 174.276 125.896  12
  -4   2 -11 295.921 134.661  18
  -4  -2 -11 184.762 122.926  18
   4   2  11 221.753 60.8415   5
   4  -2  11 257.814 56.3025   5
  -4  -2 -11 260.057 146.236   9
  -4   2 -11 469.198 149.566   9
   4   2  11 305.058 77.1391 105
   4   2  11 307.161 75.8991 119
   4  -2  11 296.323 71.5245 119
   4   2  11 344.345 80.6046 110
   4   2  11 281.962 77.4351  91
  -4   2 -11 204.877 68.3620  82
   4  -2  11 357.167 70.9901  95
   4  -2  11 242.601 65.1803  23
   4   2  11 400.483 132.416  19
   4   2  11 301.701 69.2793  73
   4  -2  11 311.031 73.2388  73
   4  -2  11 357.277 72.9646  70
   4   2  11 373.230 70.8648  70
  -4   2 -11 186.967 54.3476  51
  -4   2 -11 281.732 65.5643  56
  -4   2 -11 373.679 65.1960  39
   4  -2  11 379.757 75.2341  28
   4   2  11 280.052 64.3902  28
   4  -2  11 277.854 75.0430  29
   4   2  11 353.113 73.2193  29
  -4   2 -12 4921.03 347.549  12
  -4  -2 -12 5184.41 383.908  12
  -4   2 -12 5100.57 375.083   9
  -4   2 -12 5073.88 397.334  18
  -4  -2 -12 5446.64 385.607  18
  -4  -2 -12 5541.00 400.935   9
   4   2  12 5387.85 253.169 105
   4   2  12 5334.60 252.145 110
   4   2  12 5144.03 250.337 119
   4  -2  12 5365.97 250.741 119
   4   2  12 5000.55 237.834  92
   4   2  12 4991.35 252.535  91
  -4   2 -12 4716.86 249.896  82
   4  -2  12 5375.01 246.898  95
   4  -2  12 5183.27 244.751  23
   4   2  12 4828.21 350.789  19
   4   2  12 5151.97 241.660  73
   4  -2  12 5434.47 250.515  73
   4  -2  12 5263.30 247.743  70
  -4   2 -12 5302.13 243.136  56
   4  -2  12 5663.81 250.490  28
  -4   2 -12 5589.29 240.115  39
   4   2  12 4375.05 236.557  28
   4   2  12 5132.04 246.340  29
  -4   2 -13 2045.56 218.509  12
  -4   2 -13 2076.70 259.703  18
  -4  -2 -13 1921.79 235.988  18
  -4  -2 -13 2472.90 265.546   9
  -4   2 -13 1846.41 229.578   9
   4   2  13 2529.30 140.047 112
   4   2  13 2488.92 152.339 105
   4   2  13 2336.98 149.044 119
   4   2  13 2547.59 151.740 110
   4  -2  13 2594.09 148.780 119
   4   2  13 2322.11 137.315  92
   4   2  13 2042.64 145.557  91
  -4   2 -13 2146.49 147.794  82
   4  -2  13 2388.56 140.641  95
   4  -2  13 2518.24 143.357  23
   4   2  13 1991.09 225.910  19
   4   2  13 2482.51 140.581  73
   4  -2  13 2185.11 142.520  73
  -4   2 -13 2153.01 143.534  67
   4  -2  13 2439.81 144.897  70
  -4   2 -13 2473.87 138.837  56
   4  -2  13 2700.23 150.181  28
  -4   2 -13 2124.14 128.300  39
   4   2  13 1935.14 135.547  28
   4   2  13 2516.92 147.805  29
  -4   2 -14 2061.55 254.473  18
   4   2  14 1894.08 122.327 112
   4   2  14 2137.00 138.287 105
   4  -2  14 2021.46 121.372 105
   4   2  14 1925.22 134.553 119
   4   2  14 1949.41 134.827 110
   4  -2  14 1876.03 132.065 119
   4   2  14 1885.50 123.783  92
   4   2  14 1972.64 137.693  91
  -4   2 -14 1804.79 134.951  82
   4  -2  14 2226.59 129.414  95
   4  -2  14 2272.47 131.214  23
   4   2  14 2099.14 126.876  73
   4  -2  14 2050.17 133.394  73
   4  -2  14 2128.57 129.282  61
  -4   2 -14 2142.95 133.103  67
   4  -2  14 2022.81 129.842  70
  -4   2 -14 2152.85 125.034  56
   4  -2  14 2122.43 133.449  28
   4   2  14 1546.12 124.222  28
   4   2  14 1904.98 133.751  29
   4  -2  15 77.9914 50.4653 105
   4   2  15-17.7211 51.6010 112
   4  -2  15 50.4309 65.8875 119
   4   2  15-46.0072 63.8747 119
   4   2  15 10.1764 67.1040 105
   4   2  15 69.6598 67.4265 110
   4   2  15-12.7604 56.3576  92
   4   2  15-10.1287 68.1726  91
  -4   2 -15-22.0627 64.6828  82
   4  -2  15 8.62284 49.6632  95
   4  -2  15 44.8253 55.4286  23
   4   2  15 65.1949 58.6392  73
  -4   2 -15 46.0685 60.1890  67
   4  -2  15-9.31936 59.4193  70
   4  -2  15 41.8490 56.4231  61
  -4   2 -15 22.6784 46.9870  56
   4  -2  15 29.5106 66.6505  28
   4   2  15 4.53340 61.4339  28
   4   2  15 115.855 65.1267  29
   4   2  16 1781.50 113.863 112
   4   2  16 2316.29 142.266 105
   4  -2  16 2027.98 123.286 105
   4   2  16 2393.62 143.097 119
   4  -2  16 2104.44 137.622 119
   4   2  16 2138.10 137.965 110
   4   2  16 2092.83 128.521  92
   4   2  16 2215.86 138.293  91
  -4   2 -16 1961.40 138.664  82
   4  -2  16 2242.94 126.201  95
   4  -2  16 2445.09 133.970  23
   4   2  16 2215.60 126.838  73
  -4   2 -16 2173.00 131.993  67
   4  -2  16 2347.37 135.355  70
   4  -2  16 2306.58 134.629  61
  -4   2 -16 2435.18 141.643  58
   4  -2  16 2245.87 138.078  28
   4   2  16 1920.03 132.507  28
   4  -2  16 2363.28 140.815  29
   4  -2  16 2363.93 137.631  35
   4   2  16 2040.19 137.224  29
   4   2  17 79.9969 61.6449 105
   4   2  17 42.1481 60.1816 119
   4  -2  17 32.5985 58.8105 119
   4  -2  17 43.5923 47.6015 105
   4   2  17 31.5436 62.1512 110
   4   2  17 24.7355 50.3792  83
   4   2  17 3.89266 51.0035  92
   4   2  17 40.1867 61.3232  91
  -4   2 -17 82.9319 66.7663  82
   4  -2  17 52.9800 42.0578  95
   4  -2  17 49.3094 56.4371  23
   4   2  17 117.877 53.4917  73
  -4   2 -17 40.0681 53.8407  67
   4  -2  17 21.1814 53.9088  70
   4  -2  17 56.2008 54.3215  61
  -4   2 -17 40.7482 59.0332  58
  -4   2 -17 103.659 64.2893  31
   4  -2  17 13.8760 63.2476  28
   4   2  17 86.2068 60.9493  28
   4  -2  17 37.2212 64.1690  29
   4   2  17 40.6508 61.6304  29
   4   2  18 3493.76 174.404 105
   4   2  18 3017.43 165.270 110
   4   2  18 3333.88 170.353 119
   4  -2  18 3157.84 166.931 119
   4  -2  18 2952.37 155.287 105
   4   2  18 3016.83 158.488  92
   4   2  18 3283.90 167.699  91
  -4   2 -18 2644.91 168.224  82
   4   2  18 3176.81 154.102  83
   4  -2  18 3314.49 163.916  23
  -4   2 -18 3408.76 171.404  62
   4  -2  18 3345.54 166.418  73
  -4   2 -18 3244.66 159.468  67
   4  -2  18 3233.63 164.373  70
  -4   2 -18 3485.76 170.517  58
   4  -2  18 3220.92 170.076  28
   4   2  18 2900.72 164.747  28
   4  -2  18 3503.46 173.684  29
   4   2  18 2954.41 166.860  29
  -4   2 -18 3288.55 169.378  31
   4   2  19 363.472 70.4717 105
   4   2  19 463.874 69.4148 119
   4  -2  19 315.004 53.2694 105
   4   2  19 311.375 64.3965 110
   4  -2  19 301.526 62.4617 119
   4   2  19 240.476 53.5773  92
   4   2  19 319.312 60.4004  91
  -4   2 -19 181.374 63.0983  82
   4   2  19 299.991 46.0495  83
   4  -2  19 299.501 58.4266  23
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   4   3   2 11243.4 602.085   2
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   4  -3   2 10666.4 590.256   2
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   4   3   2 9422.95 426.696 101
   4   3   2 10122.3 423.680 110
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   4   3   2 9682.89 418.534 104
   4  -3   2 9712.04 429.892 108
   4   3   2 9472.02 416.521 107
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   4   3   2 10055.1 418.052  83
   4  -3   2 10236.3 428.096  95
   4   3   2 9936.23 426.789  94
   4  -3   2 9741.42 425.505  23
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   4   3   2 10602.4 423.812  26
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   4  -3   2 10709.2 436.713  65
   4  -3   2 10108.8 410.964  73
   4  -3   2 10253.9 420.585  66
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   4  -3   2 10945.3 444.347  45
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   4  -3   2 10304.2 430.473  29
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   4   3   3 2109.27 142.258   5
   4   3   3 2167.08 247.987   2
   4  -3   3 1870.25 133.449   5
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  -4   3  -3 1897.97 201.233   8
   4  -3   3 2344.94 258.947   2
   4   3   3 1790.08 134.053 101
   4  -3   3 1870.06 125.678 116
   4   3   3 1889.72 130.874 110
   4  -3   3 2081.38 137.553 108
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   4  -3   3 2105.18 133.791  81
   4   3   3 2268.79 127.802  83
   4   3   3 1885.57 139.252  94
   4  -3   3 1771.03 129.038  23
   4   3   3 2045.99 130.805  26
   4   3   3 1545.30 183.504  19
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   4  -3   3 1829.84 117.007  73
   4  -3   3 1716.55 120.436  66
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   4  -3   3 2082.95 144.387  45
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   4  -3   3 1674.54 120.292  28
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   4  -3   3 1962.39 135.792  29
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   4   3   4 20595.0 775.416   5
   4  -3   4 19966.2 771.819   5
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   4   3   4 20556.6 943.470   2
   4  -3   4 20350.3 944.603   2
   4   3   4 18224.5 762.139 101
   4   3   4 19314.9 766.297 110
   4  -3   4 18138.1 758.406 116
   4  -3   4 18944.5 771.236 108
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   4   3   4 20317.3 761.753  83
   4  -3   4 19986.0 772.097  81
   4   3   4 19569.2 767.939  94
   4  -3   4 18948.7 768.987  23
   4   3   4 17669.0 864.051  19
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   4  -3   4 19217.6 755.847  73
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   4  -7   5 1086.42 94.1996  28
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   4   7   6 2103.71 116.976 104
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   4   7   6 1721.58 128.254 100
   4   7   6 2054.42 123.703 112
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   4   7   6 1984.79 144.166  94
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   4   7   6 1650.19 134.673   4
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   4  -7   6 2016.63 126.894  29
   4   7   7 6347.58 290.995 120
   4   7   7 6980.34 284.482 104
   4  -7   7 6892.27 295.150 108
   4   7   7 6471.03 284.524 112
   4  -7   7 6636.45 289.640  95
   4  -7   7 6548.80 290.220  81
   4  -7   7 6919.27 296.203  23
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   4  -7   7 6949.99 287.990   5
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   4  -7   7 6993.91 294.718  28
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   4  -7   7 6802.98 294.974  29
   4   7   8 3496.59 164.525 110
   4   7   8 3173.81 171.215 120
   4   7   8 3883.97 167.583 104
   4  -7   8 3920.73 176.920 108
   4   7   8 3550.47 166.238 112
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   4  -7   8 3428.83 172.274  81
   4  -7   8 3610.24 176.009  23
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   4  -7   9 2944.28 149.003  95
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   4   7  11 1088.20 74.8755 110
   4   7  11 1234.54 73.4475 104
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   5   0 -24 22.9412 29.6159  89
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   5   1 -19 95.7475 55.8099  26
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   5  -1 -12 505.673 73.0543   5
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   5  -1 -11 262.974 64.3525   5
   5  -1 -11 159.241 76.1555  90
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   5  -1 -10 1874.16 127.356   5
   5   1 -10 2081.46 145.200 115
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   5   1 -10 1997.65 156.913  89
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   5  -1  -8 1703.73 127.582   5
   5   1  -8 1764.77 112.878 112
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   5   1  -7 178.743 157.372   2
   5  -1  -7 469.928 157.614   2
   5   1  -7 315.038 87.0696   5
   5  -1  -7 376.013 78.7638   5
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   5   1  -7 284.247 78.2023 115
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   5  -1  -7 333.609 71.1859  80
   5   1  -7 175.775 93.0604  89
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   5  -1  -6 6478.97 288.896   5
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   5   1  -6 6135.40 432.076   2
   5  -1  -6 6014.00 431.942   2
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   5  -1  -5 1003.92 104.238   5
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   5   1  -4 949.496 107.877   5
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   5   1  -3 1043.41 201.932   2
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   5  -1  -3 1672.26 226.906   2
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   5   1  -2 5482.58 257.725  83
   5  -1  -2 5308.03 250.601  83
   5   1  -2 5187.89 265.000   5
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   5   1  -2 4827.19 393.937   2
   5  -1  -2 5436.58 410.991   2
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   5   1  -1 5226.39 254.573   5
   5  -1  -1 5223.67 255.198   5
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   5   1  -1 4886.26 228.419 104
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   5  -1  -1 5124.74 236.955  83
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   5   1   0 3074.09 162.236 104
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   5  -1   0 3270.75 171.932  83
   5  -1   0 3384.58 176.560  80
   5   1   0 3549.41 178.964  26
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   5  -1   1-71.0345 132.988   2
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   5   1   1 11.9269 52.6741 104
   5   1   1 20.0229 66.9284  80
   5  -1   1 20.0706 67.5416  80
   5   1   1 72.1970 64.6442  83
   5  -1   1-18.2513 59.1858  83
   5   1   1 23.7989 62.7705  26
   5   1   1 83.7416 47.3153  70
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   5   1   2 308.096 73.5432 107
   5   1   2 375.760 63.8293 104
   5   1   2 406.134 79.1846  80
   5   1   2 415.646 75.2197  83
   5  -1   2 416.822 71.9405  83
   5   1   2 231.996 142.141   2
   5  -1   2 372.328 151.508   2
   5   1   2 321.878 84.5155   5
   5  -1   2 387.969 84.7673   5
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   5  -1   2 371.840 71.6386  73
   5   1   2 416.526 64.5210  70
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   5  -1   2 285.632 59.7717  35
   5  -1   2 389.106 61.3867  29
   5   1   3 13.5648 61.8150 107
   5   1   3 61.4202 54.8794 104
   5   1   3 63.4247 65.3852  80
   5  -1   3 55.6720 59.8778  95
   5   1   3 48.4913 65.7149  83
   5  -1   3 75.0797 64.1503  83
   5   1   3 45.5884 161.420   2
   5  -1   3 159.244 121.044   2
   5   1   3-44.1941 76.0073   5
   5  -1   3 38.4345 73.0838   5
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  -5   1  -3 51.2456 97.1675   9
   5  -1   3 76.1783 62.0513  73
   5   1   3 48.4397 50.7066  70
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   5  -1   3 4.13595 50.6045  35
   5  -1   3 72.7216 54.1480  29
   5   1   4 514.077 71.7507 107
   5   1   4 528.371 77.4390 110
   5   1   4 564.016 73.2685 104
   5  -1   4 682.629 84.4687  80
   5  -1   4 686.157 83.0079  95
   5   1   4 683.601 84.8508  80
   5   1   4 495.497 82.0494  83
   5  -1   4 702.597 84.3010  83
   5   1   4 599.336 168.432   2
   5  -1   4 773.957 167.801   2
   5   1   4 574.940 89.5247   5
   5  -1   4 570.168 89.8526   5
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   5   3   1 7917.34 345.326 101
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   5  -3   1 7845.25 333.841  23
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   5   3   2 4584.18 222.725   5
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   5   3   2 4171.22 212.233 112
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   5  -3   2 4250.43 196.536  23
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   5  -3   2 3908.00 198.676  29
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   5   3   3 444.820 91.5755   5
   5  -3   3 558.450 85.3361   5
   5   3   3 382.422 89.7096 112
   5   3   3 626.010 87.4035 110
   5   3   3 466.921 80.9458 118
   5   3   3 492.330 76.8310 104
   5  -3   3 463.577 64.9619  83
   5  -3   3 481.459 66.4527  23
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   5  -3   3 421.687 64.4151  73
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   5  -3   3 515.296 76.6969  29
   5   3   4 3037.06 179.918   5
   5  -3   4 3221.81 174.413   5
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   5   3   4 3228.49 173.395 110
   5   3   4 2931.51 164.482 104
   5   3   4 3164.60 167.898  83
   5  -3   4 3092.71 173.974  95
   5  -3   4 3172.90 160.687  83
   5  -3   4 3207.18 162.692  23
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   5  -3   4 2999.48 157.300  73
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   5  -3   4 3043.50 167.747  29
   5   3   5 1711.46 134.204   5
   5  -3   5 1762.78 129.632   5
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   5   3   5 1898.53 131.509 110
   5   3   5 1735.62 122.559 104
   5   3   5 2143.67 126.805  83
   5  -3   5 2134.16 134.705  95
   5  -3   5 2072.25 120.844  83
   5  -3   5 2043.15 120.549  23
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   5  -3   5 1845.91 116.405  73
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  -5   3  -5 1875.73 112.702  37
   5  -3   5 2013.89 127.466  29
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   5   3   6 54.4864 72.5137   5
   5  -3   6 153.417 65.9892   5
   5   3   6 121.730 80.3902 112
   5   3   6 177.403 71.9010 110
   5   3   6 157.253 66.4175 104
   5  -3   6 203.306 70.2102  95
   5   3   6 141.297 61.5274  83
   5  -3   6 100.738 54.6558  83
   5  -3   6 105.972 54.0588  23
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   5  -3   6 172.442 55.9294  73
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   5  -3   6 134.595 59.0505  35
   5  -3   6 93.4607 62.7718  29
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   5   3   7 130.106 66.4930   5
   5  -3   7 177.855 63.0693   5
   5   3   7 131.555 72.4705 112
   5   3   7 184.025 66.7128 110
   5   3   7 133.680 65.1481 104
   5  -3   7 69.1420 60.4188  95
   5   3   7 145.111 61.2094  83
   5  -3   7 64.6638 57.0717  83
   5  -3   7 119.811 54.4827  23
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   5  -3   7 153.913 57.3119  73
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   6   1   8 2455.11 124.858 118
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   6   1   9 78.7326 43.2189 118
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   6  -1   9 63.6924 38.6080  70
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   6  -1  10 1961.97 104.299 112
   6   1  10 1955.47 100.518 118
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   6  -1  10 2305.97 102.265  70
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   6  -1  10 1907.42 100.998  83
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  -6   5   5 777.430 51.4735   3
  -6   5   5 804.541 49.9354  30
  -6   5   5 892.967 51.3813  79
   6  -5  -5 746.783 48.9096  70
   6   5  -4 94.1741 33.0184 112
   6   5  -4 20.8771 48.0724 120
  -6   5   4 76.7999 30.2531   3
   6  -5  -4 22.7445 35.9735   5
  -6   5   4 41.2809 28.0807  30
  -6   5   4 44.0598 29.6821  79
   6  -5  -4 72.3738 27.8425  70
   6  -5  -3 1489.96 84.4789   5
   6   5  -3 1520.94 92.1643 120
   6   5  -3 1432.87 80.2246 112
  -6   5   3 1565.00 80.1566  79
   6  -5  -3 1496.49 77.4651  70
   6   5  -2 5954.71 243.070 112
   6   5  -2 5858.94 251.423 120
   6  -5  -2 6282.29 247.703 107
  -6   5   2 6766.41 244.578  79
   6  -5  -2 6094.45 242.219  70
   6  -5  -2 6302.51 247.675   5
  -6   5   2 5974.67 244.031   3
   6  -5  -2 5619.32 236.711  35
   6  -5  -1 296.280 44.5320 107
   6   5  -1 306.527 44.4717 112
  -6   5   1 411.082 39.8344  79
   6  -5  -1 329.394 39.3573  70
   6  -5  -1 278.714 30.5764  80
  -6   5   1 257.793 38.6366   3
  -6   5   1 228.166 35.6888  30
   6  -5  -1 337.725 33.5704  35
   6  -5   0 112.192 37.8385 107
  -6   5   0 76.7732 33.7783  79
   6  -5   0 37.7411 30.4671  70
  -6   5   0 37.2930 30.5293   3
  -6   5   0 98.1124 30.8384  30
   6  -5   0 60.1221 28.7853  35
   6  -5   0 44.3564 25.7066  80
   6   5   1 7413.84 282.162 112
   6   5   1 7360.55 287.089 120
   6  -5   1 7093.63 279.831 107
   6  -5   1 7546.09 283.857   5
  -6   5  -1 6602.03 279.486   3
  -6   5  -1 6546.88 277.981  30
   6  -5   1 7409.13 277.248  35
   6  -5   1 7080.78 275.011  80
   6   5   2 5046.25 216.203 112
   6   5   2 5870.26 222.054 120
   6  -5   2 4956.04 211.421 107
   6  -5   2 6034.56 218.421   5
  -6   5  -2 5157.66 213.733   3
  -6   5  -2 5155.38 213.269  30
   6  -5   2 5559.11 212.363  35
   6  -5   2 5227.61 211.607  80
   6   5   3 65.3702 40.2214 120
   6  -5   3 35.8303 28.4054  80
  -6   5  -3 20.3871 24.5311   3
   6  -5   3-14.7669 28.2486   5
  -6   5  -3 58.8279 24.5348  30
   6  -5   3 20.6810 22.6859  35
   6  -5   4 1929.92 91.1413  80
   6   5   4 1802.68 92.6733 120
   6  -5   4 2161.81 91.1003   5
  -6   5  -4 2101.79 92.7808  79
  -6   5  -5 1684.46 79.8977  79
   6  -5   5 1727.15 80.6264  70
   6   5   5 1835.42 83.3542 112
   6  -5   5 1665.50 79.6840  80
  -6   5  -6 454.203 32.8639  79
   6  -5   6 508.965 35.0530  80
   6   5   6 489.220 36.5358 112
   6  -5   7 4048.85 158.835  80
   0   0   0    0.00    0.00   0
TITL elg_rst1 in P2(1)/n
REM P2(1)/n (#14 in standard setting)
CELL 1.54184   5.448317   9.037137  26.114124  90.0000  92.9914  90.0000
ZERR    3.00   0.000045   0.000069   0.000191   0.0000   0.0007   0.0000
LATT  1
SYMM -x+1/2, y+1/2,-z+1/2
SFAC C H N O S
UNIT 36.00 33.00 21.00 6.00 6.00
REM  CrysAlisPro recorded range (K): Min=99.9; max=100.1; aver:100.0
TEMP -173
TREF
HKLF 4
END
;
_shelx_hkl_checksum              49116
_shelx_res_file
;
TITL elg_rst1 in P2(1)/n
    shelx.res
    created by SHELXL-2019/3 at 10:52:44 on 25-Nov-2023
CELL 1.54184   5.448317   9.037137  26.114124  90.0000  92.9914  90.0000
ZERR    4.00   0.00009    0.00014    0.0004     0.0000   0.0014   0.0000
LATT  1
SYMM -x+1/2, y+1/2,-z+1/2
SFAC C H N O S
UNIT 40 44 20 8 8
TEMP -173
SIZE 0.15 0.12 0.02
L.S.  6
FMAP  2
PLAN  10
ACTA 155
CONF
REM Instructions for potential hydrogen bonds
EQIV $1 -x+1, -y, -z+1
HTAB N1 N2_$1
EQIV $2 -x, -y+1, -z+1
HTAB N4 N5_$2
HTAB N4 O2_$1
EQIV $3 x, y+1, z
HTAB C7 O2_$3
EQIV $4 1+x,y,z
RTAB CONT O1 C2_$4
RTAB CONT O1 N1_$4
RTAB CONT O1 C6_$4
MPLA N1 C2 N3 C4 N5 C6 6 N2 N4 S1 C7 S2 H04A H04B
MPLA C8 C9 C10 C11 C12 C13 6 S2
WGHT    0.045700    0.907600
FVAR       4.66256
N1    3    0.385497    0.194986    0.488752    11.00000    0.02032    0.01777 =
         0.02084    0.00212    0.00389    0.00467
H01   2    0.371611    0.118479    0.507730    11.00000    0.03234
C2    1    0.543706    0.192680    0.449548    11.00000    0.01664    0.01972 =
         0.02113   -0.00053    0.00031    0.00134
N3    3    0.568042    0.312534    0.419964    11.00000    0.01866    0.01700 =
         0.02177   -0.00027    0.00177    0.00177
C4    1    0.420278    0.424896    0.429424    11.00000    0.01878    0.01813 =
         0.02042   -0.00141   -0.00084   -0.00015
N5    3    0.245556    0.431044    0.463508    11.00000    0.02064    0.01666 =
         0.02307    0.00014    0.00279    0.00309
C6    1    0.225560    0.310029    0.492634    11.00000    0.01955    0.01823 =
         0.02103   -0.00078    0.00013    0.00289
N2    3    0.662914    0.065741    0.443273    11.00000    0.02199    0.01914 =
         0.02351    0.00193    0.00578    0.00471
N4    3    0.050947    0.302227    0.525411    11.00000    0.02466    0.01928 =
         0.02784    0.00495    0.00811    0.00773
H04A  2   -0.033231    0.382338    0.529485    11.00000    0.03209
H04B  2    0.050440    0.230576    0.545566    11.00000    0.03024
S1    5    0.443811    0.589235    0.394933    11.00000    0.02901    0.01943 =
         0.02703    0.00326    0.00611    0.00336
C7    1    0.711736    0.556507    0.358915    11.00000    0.03981    0.02473 =
         0.03372    0.00166    0.01475   -0.00051
AFIX 137
H7A   2    0.663476    0.504404    0.327051    11.00000   -1.50000
H7B   2    0.829641    0.496006    0.379343    11.00000   -1.50000
H7C   2    0.787821    0.651309    0.350761    11.00000   -1.50000
AFIX   0
S2    5    0.848009    0.057398    0.396396    11.00000    0.01881    0.01887 =
         0.02305    0.00141    0.00438    0.00429
O1    4    1.043187    0.163440    0.400009    11.00000    0.01831    0.03103 =
         0.02801   -0.00037    0.00173   -0.00056
O2    4    0.920888   -0.096897    0.394653    11.00000    0.03394    0.02154 =
         0.03269    0.00414    0.01263    0.01130
C8    1    0.673653    0.090700    0.338279    11.00000    0.02036    0.02409 =
         0.02354   -0.00512    0.00234    0.00462
C9    1    0.461843    0.008982    0.326672    11.00000    0.02525    0.03085 =
         0.03790   -0.00838    0.00457    0.00006
AFIX  43
H9    2    0.404045   -0.061191    0.350305    11.00000   -1.20000
AFIX   0
C10   1    0.336865    0.032495    0.279669    11.00000    0.02529    0.04859 =
         0.04438   -0.01765   -0.00285    0.00024
AFIX  43
H10   2    0.192098   -0.022469    0.270891    11.00000   -1.20000
AFIX   0
C11   1    0.421536    0.135412    0.245485    11.00000    0.03746    0.05958 =
         0.02711   -0.01060   -0.00454    0.01230
AFIX  43
H11   2    0.334422    0.150368    0.213437    11.00000   -1.20000
AFIX   0
C12   1    0.631684    0.216577    0.257578    11.00000    0.04005    0.04371 =
         0.02477   -0.00031    0.00442    0.00888
AFIX  43
H12   2    0.688191    0.287312    0.233994    11.00000   -1.20000
AFIX   0
C13   1    0.760014    0.194388    0.304332    11.00000    0.02818    0.02898 =
         0.02462   -0.00178    0.00420    0.00354
AFIX  43
H13   2    0.904891    0.249408    0.312962    11.00000   -1.20000
AFIX   0
HKLF 4
REM  elg_rst1 in P2(1)/n
REM wR2 = 0.0850, GooF = S = 1.047, Restrained GooF = 1.047 for all data
REM R1 = 0.0306 for 2713 Fo > 4sig(Fo) and 0.0312 for all 2789 data
REM 185 parameters refined using 0 restraints
END
WGHT      0.0457      0.9077
REM Highest difference peak  0.411,  deepest hole -0.384,  1-sigma level  0.056
Q1    1   0.7669  0.0748  0.3628  11.00000  0.05    0.41
Q2    1   0.7306  0.1126  0.3187  11.00000  0.05    0.31
Q3    1   0.7228  0.0681  0.4248  11.00000  0.05    0.31
Q4    1   0.4584  0.5163  0.4181  11.00000  0.05    0.28
Q5    1   1.0053 -0.0483  0.4182  11.00000  0.05    0.27
Q6    1   0.3175 -0.0536  0.3064  11.00000  0.05    0.26
Q7    1   0.5966  0.0455  0.3300  11.00000  0.05    0.25
Q8    1   0.4459  0.1912  0.4667  11.00000  0.05    0.25
Q9    1   0.5816  0.5625  0.3702  11.00000  0.05    0.24
Q10   1   0.2380  0.3733  0.4741  11.00000  0.05    0.24
;
_shelx_res_checksum              50207
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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
N N1 0.3855(2) 0.19499(14) 0.48875(5) 0.0195(3) Uani d 1 . .
H H01 0.372(4) 0.118(3) 0.5077(8) 0.032(5) Uiso d 1 . .
C C2 0.5437(3) 0.19268(16) 0.44955(5) 0.0192(3) Uani d 1 . .
N N3 0.5680(2) 0.31253(13) 0.41996(5) 0.0191(2) Uani d 1 . .
C C4 0.4203(3) 0.42490(16) 0.42942(5) 0.0192(3) Uani d 1 . .
N N5 0.2456(2) 0.43104(13) 0.46351(5) 0.0201(3) Uani d 1 . .
C C6 0.2256(3) 0.31003(16) 0.49263(5) 0.0196(3) Uani d 1 . .
N N2 0.6629(2) 0.06574(14) 0.44327(5) 0.0214(3) Uani d 1 . .
N N4 0.0509(2) 0.30223(15) 0.52541(5) 0.0237(3) Uani d 1 . .
H H04A -0.033(4) 0.382(3) 0.5295(8) 0.032(5) Uiso d 1 . .
H H04B 0.050(4) 0.231(2) 0.5456(8) 0.030(5) Uiso d 1 . .
S S1 0.44381(7) 0.58924(4) 0.39493(2) 0.02499(11) Uani d 1 . .
C C7 0.7117(3) 0.55651(19) 0.35892(7) 0.0323(4) Uani d 1 . .
H H7A 0.663476 0.504404 0.327051 0.048 Uiso calc 1 . .
H H7B 0.829641 0.496006 0.379343 0.048 Uiso calc 1 . .
H H7C 0.787821 0.651309 0.350761 0.048 Uiso calc 1 . .
S S2 0.84801(6) 0.05740(4) 0.39640(2) 0.02013(11) Uani d 1 . .
O O1 1.04319(19) 0.16344(13) 0.40001(4) 0.0258(2) Uani d 1 . .
O O2 0.9209(2) -0.09690(12) 0.39465(4) 0.0290(3) Uani d 1 . .
C C8 0.6737(3) 0.09070(17) 0.33828(6) 0.0226(3) Uani d 1 . .
C C9 0.4618(3) 0.0090(2) 0.32667(7) 0.0312(4) Uani d 1 . .
H H9 0.404045 -0.061191 0.350305 0.037 Uiso calc 1 . .
C C10 0.3369(3) 0.0325(2) 0.27967(8) 0.0396(4) Uani d 1 . .
H H10 0.192098 -0.022469 0.270891 0.047 Uiso calc 1 . .
C C11 0.4215(4) 0.1354(3) 0.24549(7) 0.0416(5) Uani d 1 . .
H H11 0.334422 0.150368 0.213437 0.050 Uiso calc 1 . .
C C12 0.6317(4) 0.2166(2) 0.25758(7) 0.0361(4) Uani d 1 . .
H H12 0.688191 0.287312 0.233994 0.043 Uiso calc 1 . .
C C13 0.7600(3) 0.19439(19) 0.30433(6) 0.0272(3) Uani d 1 . .
H H13 0.904891 0.249408 0.312962 0.033 Uiso calc 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
N1 0.0203(6) 0.0178(6) 0.0208(6) 0.0047(5) 0.0039(5) 0.0021(5)
C2 0.0166(6) 0.0197(7) 0.0211(6) 0.0013(5) 0.0003(5) -0.0005(5)
N3 0.0187(6) 0.0170(6) 0.0218(6) 0.0018(4) 0.0018(4) -0.0003(5)
C4 0.0188(7) 0.0181(7) 0.0204(7) -0.0002(5) -0.0008(5) -0.0014(5)
N5 0.0206(6) 0.0167(6) 0.0231(6) 0.0031(4) 0.0028(5) 0.0001(5)
C6 0.0196(7) 0.0182(7) 0.0210(6) 0.0029(5) 0.0001(5) -0.0008(5)
N2 0.0220(6) 0.0191(6) 0.0235(6) 0.0047(5) 0.0058(5) 0.0019(5)
N4 0.0247(7) 0.0193(6) 0.0278(6) 0.0077(5) 0.0081(5) 0.0049(5)
S1 0.0290(2) 0.01943(19) 0.0270(2) 0.00336(14) 0.00611(15) 0.00326(13)
C7 0.0398(10) 0.0247(8) 0.0337(9) -0.0005(7) 0.0147(7) 0.0017(7)
S2 0.01881(19) 0.01887(18) 0.02305(18) 0.00429(12) 0.00438(13) 0.00141(13)
O1 0.0183(5) 0.0310(6) 0.0280(5) -0.0006(4) 0.0017(4) -0.0004(4)
O2 0.0339(6) 0.0215(6) 0.0327(6) 0.0113(5) 0.0126(5) 0.0041(4)
C8 0.0204(7) 0.0241(7) 0.0235(7) 0.0046(6) 0.0023(5) -0.0051(6)
C9 0.0252(8) 0.0308(8) 0.0379(9) 0.0001(7) 0.0046(6) -0.0084(7)
C10 0.0253(8) 0.0486(11) 0.0444(10) 0.0002(8) -0.0028(7) -0.0176(9)
C11 0.0375(10) 0.0596(13) 0.0271(8) 0.0123(9) -0.0045(7) -0.0106(8)
C12 0.0401(10) 0.0437(10) 0.0248(8) 0.0089(8) 0.0044(7) -0.0003(7)
C13 0.0282(8) 0.0290(8) 0.0246(7) 0.0035(6) 0.0042(6) -0.0018(6)
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'
N N 0.0311 0.0180 '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'
S S 0.3331 0.5567 '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
C6 N1 C2 . . 119.71(13) y
N2 C2 N3 . . 124.13(13) ?
N2 C2 N1 . . 115.72(13) ?
N3 C2 N1 . . 120.15(13) y
C4 N3 C2 . . 115.57(12) y
N3 C4 N5 . . 127.97(13) y
N3 C4 S1 . . 119.57(11) ?
N5 C4 S1 . . 112.46(10) ?
C4 N5 C6 . . 115.19(12) y
N4 C6 N5 . . 119.77(13) ?
N4 C6 N1 . . 119.64(13) ?
N5 C6 N1 . . 120.59(13) y
C2 N2 S2 . . 117.22(10) y
C4 S1 C7 . . 102.30(8) ?
O1 S2 O2 . . 116.23(7) ?
O1 S2 N2 . . 114.00(7) ?
O2 S2 N2 . . 104.44(6) ?
O1 S2 C8 . . 107.80(7) ?
O2 S2 C8 . . 105.75(7) ?
N2 S2 C8 . . 108.09(7) ?
C13 C8 C9 . . 121.62(15) ?
C13 C8 S2 . . 118.46(12) ?
C9 C8 S2 . . 119.86(13) ?
C10 C9 C8 . . 118.34(17) ?
C11 C10 C9 . . 120.54(17) ?
C12 C11 C10 . . 120.59(17) ?
C11 C12 C13 . . 119.80(18) ?
C8 C13 C12 . . 119.11(16) ?
C6 N1 H01 . . 119.8(14) ?
C2 N1 H01 . . 119.8(14) ?
C6 N4 H04A . . 116.2(14) ?
C6 N4 H04B . . 118.6(14) ?
H04A N4 H04B . . 123(2) ?
S1 C7 H7A . . 109.5 ?
S1 C7 H7B . . 109.5 ?
H7A C7 H7B . . 109.5 ?
S1 C7 H7C . . 109.5 ?
H7A C7 H7C . . 109.5 ?
H7B C7 H7C . . 109.5 ?
C10 C9 H9 . . 120.8 ?
C8 C9 H9 . . 120.8 ?
C11 C10 H10 . . 119.7 ?
C9 C10 H10 . . 119.7 ?
C12 C11 H11 . . 119.7 ?
C10 C11 H11 . . 119.7 ?
C11 C12 H12 . . 120.1 ?
C13 C12 H12 . . 120.1 ?
C8 C13 H13 . . 120.4 ?
C12 C13 H13 . . 120.4 ?
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
N1 C6 . 1.3637(18) y
N1 C2 . 1.3725(18) y
C2 N2 . 1.3326(18) y
C2 N3 . 1.3410(19) y
N3 C4 . 1.3270(18) y
C4 N5 . 1.3379(19) y
C4 S1 . 1.7451(15) y
N5 C6 . 1.3398(19) y
C6 N4 . 1.3144(19) y
N2 S2 . 1.6279(13) y
S1 C7 . 1.8017(17) ?
S2 O1 . 1.4309(12) ?
S2 O2 . 1.4512(11) ?
S2 C8 . 1.7737(16) ?
C8 C13 . 1.389(2) ?
C8 C9 . 1.390(2) ?
C9 C10 . 1.389(3) ?
C10 C11 . 1.385(3) ?
C11 C12 . 1.382(3) ?
C12 C13 . 1.389(2) ?
N1 H01 . 0.86(2) ?
N4 H04A . 0.87(2) ?
N4 H04B . 0.83(2) ?
C7 H7A . 0.9800 ?
C7 H7B . 0.9800 ?
C7 H7C . 0.9800 ?
C9 H9 . 0.9500 ?
C10 H10 . 0.9500 ?
C11 H11 . 0.9500 ?
C12 H12 . 0.9500 ?
C13 H13 . 0.9500 ?
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
N1 H01 N2 3_656 0.86(2) 2.11(2) 2.9701(18) 178(2) yes
N4 H04A N5 3_566 0.87(2) 2.06(2) 2.9245(18) 177(2) yes
N4 H04B O2 3_656 0.83(2) 1.97(2) 2.7912(18) 166(2) yes
C7 H7C O2 1_565 0.98 2.63 3.445(2) 140.4 yes
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
C6 N1 C2 N2 . . . . -168.87(13) ?
C6 N1 C2 N3 . . . . 10.2(2) ?
N2 C2 N3 C4 . . . . 174.90(14) ?
N1 C2 N3 C4 . . . . -4.1(2) ?
C2 N3 C4 N5 . . . . -2.5(2) ?
C2 N3 C4 S1 . . . . 177.57(10) ?
N3 C4 N5 C6 . . . . 2.6(2) ?
S1 C4 N5 C6 . . . . -177.41(11) ?
C4 N5 C6 N4 . . . . -176.47(13) ?
C4 N5 C6 N1 . . . . 3.8(2) ?
C2 N1 C6 N4 . . . . 170.22(14) ?
C2 N1 C6 N5 . . . . -10.1(2) ?
N3 C2 N2 S2 . . . . -0.3(2) y
N1 C2 N2 S2 . . . . 178.74(10) ?
N3 C4 S1 C7 . . . . -6.77(14) y
N5 C4 S1 C7 . . . . 173.26(12) ?
C2 N2 S2 O1 . . . . 60.06(13) ?
C2 N2 S2 O2 . . . . -172.04(11) ?
C2 N2 S2 C8 . . . . -59.77(13) ?
O1 S2 C8 C13 . . . . 7.00(14) y
O2 S2 C8 C13 . . . . -117.95(13) ?
N2 S2 C8 C13 . . . . 130.67(12) ?
O1 S2 C8 C9 . . . . -175.82(12) ?
O2 S2 C8 C9 . . . . 59.23(14) ?
N2 S2 C8 C9 . . . . -52.15(14) ?
C13 C8 C9 C10 . . . . 0.4(2) ?
S2 C8 C9 C10 . . . . -176.69(13) ?
C8 C9 C10 C11 . . . . -0.3(3) ?
C9 C10 C11 C12 . . . . -0.1(3) ?
C10 C11 C12 C13 . . . . 0.3(3) ?
C9 C8 C13 C12 . . . . -0.2(2) ?
S2 C8 C13 C12 . . . . 176.96(13) ?
C11 C12 C13 C8 . . . . -0.2(3) ?