#------------------------------------------------------------------------------
#$Date: 2021-07-13 12:36:38 +0300 (Tue, 13 Jul 2021) $
#$Revision: 267503 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/41/1564131.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1564131
loop_
_publ_author_name
'Basu Baul, Tushar S.'
'Addepalli, Maheswara Rao'
'Lyčka, Antonin'
'van Terwingen, Steven'
'Fátima C. Guedes da Silva, M.'
_publ_section_title
;
 Synthesis and structural characterization of diorganotin(IV) complexes
 with heteroditopic pyridyl-ONO′-ligands
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              119892
_journal_paper_doi               10.1016/j.ica.2020.119892
_journal_volume                  512
_journal_year                    2020
_chemical_formula_moiety         'C14  H14  N4  O2'
_chemical_formula_sum            'C14 H14 N4 O2'
_chemical_formula_weight         270.29
_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   geom
_cell_angle_alpha                90
_cell_angle_beta                 99.778(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.3732(5)
_cell_length_b                   8.3763(3)
_cell_length_c                   13.0947(6)
_cell_measurement_reflns_used    1798
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      29.0300
_cell_measurement_theta_min      4.5250
_cell_volume                     1337.44(10)
_computing_cell_refinement       'CrysAlisPro 1.171.39.46e (Rigaku OD, 2018)'
_computing_data_collection       'CrysAlisPro 1.171.39.46e (Rigaku OD, 2018)'
_computing_data_reduction        'CrysAlisPro 1.171.39.46e (Rigaku OD, 2018)'
_computing_molecular_graphics    'Ortep for Windows (Farrugia, 2012)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.859
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0134
_diffrn_reflns_av_unetI/netI     0.0219
_diffrn_reflns_Laue_measured_fraction_full 0.993
_diffrn_reflns_Laue_measured_fraction_max 0.859
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -3
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            5149
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.859
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.927
_diffrn_reflns_theta_min         3.987
_diffrn_source                   'fine-focus sealed X-ray tube'
_exptl_absorpt_coefficient_mu    0.094
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.85411
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.46e (Rigaku Oxford Diffraction, 2018)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.342
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             568
_exptl_crystal_size_max          0.360
_exptl_crystal_size_mid          0.230
_exptl_crystal_size_min          0.230
_refine_diff_density_max         0.577
_refine_diff_density_min         -0.470
_refine_diff_density_rms         0.044
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     183
_refine_ls_number_reflns         3033
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0624
_refine_ls_R_factor_gt           0.0495
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0720P)²+0.4781P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1341
_refine_ls_wR_factor_ref         0.1460
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                2434
_reflns_number_total             3033
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            H2L1.cif
_cod_data_source_block           H2L1
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               1564131
_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   0.967
_shelx_estimated_absorpt_t_max   0.979
_shelx_res_file
;
TITL SIR97 run in space group P 21/n
    shelx.res
    created by SHELXL-2018/3 at 15:54:51 on 01-Aug-2019
CELL  0.71073  12.3732   8.3763  13.0947   90.000   99.778   90.000
ZERR     4.00   0.0005   0.0003   0.0006    0.000    0.004    0.000
LATT   1
SYMM  1/2 - X, 1/2 + Y, 1/2 - Z
SFAC  C    H    N    O
UNIT  56 56 16 8
MERG   2
FMAP   2
PLAN   25
SIZE     0.230   0.230   0.360
ACTA
BOND   $H
CONF
L.S.  10
TEMP    25.00
WGHT    0.072000    0.478100
FVAR       8.04619
C1    1    0.982816    0.084245   -0.219465    11.00000    0.03723    0.04229 =
         0.03870   -0.00222    0.00314    0.00848
AFIX  23
H1A   2    0.911017    0.043458   -0.212640    11.00000   -1.20000
H1B   2    0.999262    0.051367   -0.286182    11.00000   -1.20000
AFIX   0
C2    1    0.984733    0.262639   -0.210902    11.00000    0.04946    0.04109 =
         0.03946    0.00506    0.01832    0.00799
AFIX  23
H2A   2    1.058509    0.301328   -0.211527    11.00000   -1.20000
H2B   2    0.936705    0.308489   -0.269863    11.00000   -1.20000
AFIX   0
C3    1    0.866696    0.407699   -0.112475    11.00000    0.03810    0.03289 =
         0.03143    0.00544    0.00581    0.00247
AFIX  43
H3    2    0.833542    0.453952   -0.174501    11.00000   -1.20000
AFIX   0
C4    1    0.824057    0.445906   -0.021567    11.00000    0.03383    0.02921 =
         0.02803    0.00265    0.00497    0.00080
C5    1    0.869904    0.376438    0.077237    11.00000    0.03216    0.02951 =
         0.02990    0.00136   -0.00010   -0.00053
C6    1    0.814246    0.413792    0.161627    11.00000    0.04180    0.04463 =
         0.02647    0.00563    0.00141    0.00253
AFIX  43
H6    2    0.840467    0.370836    0.226603    11.00000   -1.20000
AFIX   0
C7    1    0.724459    0.509816    0.150052    11.00000    0.03827    0.04247 =
         0.02875   -0.00138    0.00700   -0.00114
AFIX  43
H7    2    0.690954    0.531470    0.206955    11.00000   -1.20000
AFIX   0
C8    1    0.681014    0.577688    0.052019    11.00000    0.03218    0.03258 =
         0.03274   -0.00024    0.00409    0.00004
C9    1    0.732020    0.544284   -0.030842    11.00000    0.03675    0.03646 =
         0.02742    0.00451    0.00216    0.00460
AFIX  43
H9    2    0.704325    0.588629   -0.095072    11.00000   -1.20000
AFIX   0
C10   1    0.445205    0.799371    0.082359    11.00000    0.02974    0.03155 =
         0.03434   -0.00324    0.00328   -0.00321
C11   1    0.399811    0.853904   -0.015982    11.00000    0.03879    0.05033 =
         0.03406    0.00078    0.00828    0.00135
AFIX  43
H11   2    0.432176    0.829497   -0.073174    11.00000   -1.20000
AFIX   0
C12   1    0.306436    0.944283   -0.026562    11.00000    0.04067    0.05512 =
         0.03686    0.00540    0.00014    0.00302
AFIX  43
H12   2    0.274507    0.982809   -0.091290    11.00000   -1.20000
AFIX   0
C13   1    0.260133    0.977685    0.059729    11.00000    0.03532    0.04626 =
         0.04552   -0.00617   -0.00087    0.00601
AFIX  43
H13   2    0.196550    1.038949    0.051206    11.00000   -1.20000
AFIX   0
C14   1    0.393423    0.838991    0.164191    11.00000    0.03987    0.04783 =
         0.03028   -0.00561    0.00215    0.00527
AFIX  43
H14   2    0.423962    0.802621    0.229870    11.00000   -1.20000
AFIX   0
N1    3    0.948691    0.312717   -0.114768    11.00000    0.03976    0.03187 =
         0.03695    0.00151    0.01098    0.00392
N2    3    0.586628    0.673942    0.030635    11.00000    0.03494    0.03737 =
         0.03414   -0.00074    0.00645    0.00193
N3    3    0.541604    0.704537    0.107318    11.00000    0.03417    0.03715 =
         0.03225   -0.00166    0.00635    0.00134
N4    3    0.301815    0.926688    0.154696    11.00000    0.04188    0.05887 =
         0.03867   -0.01347    0.00280    0.01027
O1    4    1.062627    0.025877   -0.139181    11.00000    0.05845    0.04344 =
         0.06434    0.00464   -0.01478    0.00977
AFIX 147
H1    2    1.048928   -0.067368   -0.127203    11.00000   -1.50000
AFIX   0
O2    4    0.954030    0.286722    0.087999    11.00000    0.04281    0.04777 =
         0.03434    0.00587    0.00244    0.01229
AFIX 147
H2    2    0.973207    0.274026    0.031608    11.00000   -1.50000
AFIX   0
HKLF    4




REM  SIR97 run in space group P 21/n
REM wR2 = 0.1460, GooF = S = 1.035, Restrained GooF = 1.035 for all data
REM R1 = 0.0495 for 2434 Fo > 4sig(Fo) and 0.0624 for all 3033 data
REM 183 parameters refined using 0 restraints

END

WGHT      0.0710      0.4819

REM Highest difference peak  0.577,  deepest hole -0.470,  1-sigma level  0.044
Q1    1   0.9812  0.2665 -0.0512  11.00000  0.05    0.58
Q2    1   0.8367  0.4098  0.0222  11.00000  0.05    0.24
Q3    1   0.7037  0.5492  0.0978  11.00000  0.05    0.24
Q4    1   0.4342  0.8516  0.0410  11.00000  0.05    0.20
Q5    1   0.8604  0.4493 -0.0571  11.00000  0.05    0.19
Q6    1   0.9973  0.0197 -0.1102  11.00000  0.05    0.19
Q7    1   0.4160  0.8085  0.1195  11.00000  0.05    0.19
Q8    1   0.7271  0.5880  0.0226  11.00000  0.05    0.18
Q9    1   0.9885  0.1739 -0.2134  11.00000  0.05    0.17
Q10   1   0.7989  0.5241 -0.0190  11.00000  0.05    0.16
Q11   1   0.6832  0.5178  0.0064  11.00000  0.05    0.16
Q12   1   0.3026  0.9901  0.0215  11.00000  0.05    0.15
Q13   1   0.2722  0.9298  0.0158  11.00000  0.05    0.14
Q14   1   0.4019  0.7819  0.0289  11.00000  0.05    0.13
Q15   1   0.9279  0.3628 -0.1001  11.00000  0.05    0.13
Q16   1   0.8398  0.4109  0.1205  11.00000  0.05    0.13
Q17   1   0.4198  0.7218  0.2394  11.00000  0.05    0.12
Q18   1   0.7517  0.4169  0.1404  11.00000  0.05    0.12
Q19   1   0.4966  0.7893  0.0955  11.00000  0.05    0.12
Q20   1   0.2669  0.9816  0.2058  11.00000  0.05    0.11
Q21   1   1.0126  0.2767  0.1421  11.00000  0.05    0.11
Q22   1   0.9879  0.2966 -0.1512  11.00000  0.05    0.11
Q23   1   0.7975  0.5104  0.1551  11.00000  0.05    0.11
Q24   1   0.6682  0.5357 -0.1075  11.00000  0.05    0.11
Q25   1   0.5251  0.6922 -0.0318  11.00000  0.05    0.11
;
_shelx_res_checksum              7227
_shelx_hkl_file
;
   0   0   3-28.5200 22.6284   2
   0   0   3-9.02672 11.9277   1
   0   0   4 157945. 927.020   2
   0   0  -4 157349. 609.266   1
   0   0   5-20.1799 36.7357   2
   0   0  -5 26.8599 20.8662   1
   0   0   5 1.26652 15.3505   1
   0   0   6 429.615 65.0629   2
   0   0   6 575.398 53.9872   1
   0   0   7-40.6806 49.8280   2
   0   0   7-5.92664 23.1269   1
   0   0   8 2812.80 182.920   2
   0   0   9-16.6738 66.5980   2
   0   0  10 1565.90 168.602   2
   0   0  11 39.5327 87.5185   2
   0   0  12 29.4270 89.2133   2
   0   0  13 8.84716 84.8248   2
   0   0  14 236.445 109.039   2
   0   0  15-46.0283 98.4111   2
   0   0  16 24232.1 838.341   2
   0   1   2 365749. 1098.28   2
   0   1   3 27573.9 356.410   2
   0   1   4 30042.8 412.771   2
   0  -1   4 29892.5 410.019   2
   0   1   5 15047.0 251.327   1
   0   1  -5 15046.5 231.734   1
   0  -1   5 15794.6 340.000   2
   0   1   5 15441.2 332.890   2
   0   1  -6 1736.83 83.1995   1
   0  -1   6 1618.19 128.617   2
   0   1   6 1719.46 93.2500   1
   0   1   6 1692.65 128.023   2
   0   1  -7 839.722 62.1149   1
   0   1   7 734.733 91.2888   2
   0   1   7 673.536 62.4417   1
   0  -1   7 837.536 103.496   2
   0   1   8 894.894 110.993   2
   0   1  -8 900.003 67.8415   1
   0  -1   8 854.791 112.909   2
   0   1   9 449.654 89.2570   2
   0   1  -9 408.147 54.7500   1
   0  -1   9 294.262 90.1810   2
   0   1  10 21860.0 575.748   2
   0  -1  10 20307.4 567.779   2
   0   1  11 1391.04 175.056   2
   0  -1  11 1313.62 181.437   2
   0   1  12 626.766 142.161   2
   0  -1  12 646.527 130.915   2
   0   1  13 6698.21 383.899   2
   0   1  14 2211.55 240.422   2
   0   1  15 2734.29 282.457   2
   0   1  16 4733.85 386.329   2
   0   2   0 119862. 696.942   2
   0   2   1 99864.2 656.846   2
   0   2   2 10003.0 221.934   2
   0   2   3 48763.3 533.772   2
   0   2   4 7214.25 221.341   2
   0   2   4 6751.74 91.7439   3
   0   2   5 58084.6 690.180   2
   0   2   6 171734. 1284.91   2
   0   2   7 213.892 86.9670   2
   0   2  -7 40.8383 37.1255   1
   0   2  -8 746.533 69.9687   1
   0   2   8 695.723 107.108   2
   0   2  -9 31241.5 437.869   1
   0   2   9 31278.4 671.752   2
   0   2 -10 70008.7 665.011   1
   0   2  10 69856.9 1062.19   2
   0   2  11 79567.7 1203.06   2
   0   2  12 2590.19 256.908   2
   0   2  13 315.789 103.112   2
   0   2  14 620.001 151.116   2
   0   2  15 10554.8 535.888   2
   0   3   0 47.9878 54.2934   2
   0   3   1 110957. 837.444   2
   0   3   2 7689.59 229.549   2
   0   3   3 8149.21 251.888   2
   0   3   4 1499.17 119.146   2
   0   3   5 120003. 1068.36   2
   0   3   5 120068. 492.153   3
   0   3   6 4885.90 231.304   2
   0   3   7 10379.9 366.484   2
   0   3   8 264.044 73.8895   2
   0   3   9 9565.77 380.555   2
   0   3  -9 9568.50 266.720   1
   0   3 -10-5.41846 39.3527   1
   0   3  10-210.068 128.440   2
   0   3  11 1121.93 155.695   2
   0   3  12 6451.38 370.555   2
   0   3  13 6647.72 396.262   2
   0   3  14 1054.24 184.229   2
   0   3  15 507.548 146.644   2
   0   4   0 17989.5 389.919   2
   0   4  -1 53143.7 675.230   2
   0   4   1 53618.9 678.978   2
   0   4   2 617.391 77.1957   2
   0   4   3 4085.19 202.239   2
   0   4   4 8076.32 294.075   2
   0   4   5 21483.5 492.029   2
   0   4   6 2167.65 169.228   2
   0   4   6 1516.59 65.2095   3
   0   4   7 77.4714 61.8529   2
   0   4   8 10.7630 66.9415   2
   0   4   9 13564.5 481.491   2
   0   4  10-84.6112 114.809   2
   0   4  11 3851.76 286.966   2
   0   4  12 1587.92 201.644   2
   0   4  13 1105.95 185.872   2
   0   4  14 843.519 169.369   2
   0   5   0 565.138 86.4372   2
   0   5  -1 259.277 70.0482   2
   0   5   1 160.099 57.1193   2
   0   5   2 14096.3 396.653   2
   0   5   3 2963.64 188.590   2
   0   5   4 1462.08 143.846   2
   0   5   5 2228.27 180.416   2
   0   5   6 396.764 107.771   2
   0   5   7 2163.52 191.188   2
   0   5   8 4894.69 291.692   2
   0   5   9 15472.7 547.706   2
   0   5  10 394.216 121.324   2
   0   5  11 272.031 119.474   2
   0   5  12 4486.70 333.898   2
   0   5  13 1228.82 193.147   2
   0   5  14 242.285 112.388   2
   0   6   0 931.147 122.696   2
   0   6  -1 222.572 78.3678   2
   0   6   1 197.259 70.9628   2
   0   6  -2 6469.62 302.009   2
   0   6   2 6095.24 294.722   2
   0   6   3 1282.77 140.609   2
   0   6   4 3131.33 217.031   2
   0   6   5 2.00979 64.8545   2
   0   6   6 1767.78 182.818   2
   0   6   7 278.649 96.4159   2
   0   6   8 1687.53 190.690   2
   0   6   9 322.734 96.3179   2
   0   6  10 535.878 126.963   2
   0   6  11 2385.12 246.776   2
   0   6  12 305.796 114.622   2
   0   6  13 158.551 84.7101   2
   0   7   0-162.644 90.9096   2
   0   7   1 22555.1 619.784   2
   0   7  -1 22692.8 613.074   2
   0   7  -2 25647.5 665.682   2
   0   7   2 26278.4 659.134   2
   0   7  -3 410.653 81.7842   2
   0   7   3 608.076 132.247   2
   0   7   4 2143.59 205.151   2
   0   7   5 681.698 114.684   2
   0   7   6 4622.35 312.712   2
   0   7   7 509.914 123.139   2
   0   7   8 2149.65 223.458   2
   0   7   9 856.637 151.287   2
   0   7  10 1901.16 222.009   2
   0   7  11 295.023 120.824   2
   0   7  12 217.412 107.012   2
   0   8   0 24754.1 703.370   2
   0   8  -1 246.070 97.3542   2
   0   8   1 597.831 147.008   2
   0   8  -2 7696.54 392.609   2
   0   8   2 8040.94 403.949   2
   0   8  -3 1118.78 163.436   2
   0   8   3 1353.61 173.517   2
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   2   2   1 999999. 2229.66   2
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   2   2   3 4967.92 177.280   2
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   2   2   4 981.220 87.8902   2
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   2   2   7 11134.4 358.398   2
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   2   3   1 48225.9 580.979   2
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   2   3   4 756.243 86.5507   2
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   2   3   6 2392.05 165.980   2
   2   3   7 16054.4 458.080   2
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   2   3  12 194.791 118.968   2
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   2   4   4 1259.87 124.840   2
   2   4   5 756.686 97.3995   2
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   2   4   7 13705.1 449.436   2
   2   4   8 49.3269 65.9059   2
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   2   4  11 44109.3 959.673   2
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   2   5   6 12430.9 429.069   2
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   2   5  10 7825.60 410.370   2
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   2   7   7 8305.75 421.786   2
   2   7   8 4070.03 304.870   2
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   2   8   4 27916.2 792.492   2
   2   8   5 48035.8 1025.00   2
   2   8   6 9985.49 493.244   2
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   2   8   8 157.738 109.496   2
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   2   9   0 6867.24 412.139   2
   2   9   1 1505.17 185.837   2
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   2   9   3 3679.67 302.294   2
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   2   9   4 588.067 145.708   2
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   2   9   5 1288.18 203.775   2
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   2   9   6-39.7579 102.031   2
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   2  10  -5 7567.32 475.023   2
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   2  10  -2 4585.26 358.986   2
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   2  10  -1-37.9170 124.057   2
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   2  10   0 2587.00 276.265   2
   2  10   1 225.483 113.294   2
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   2  10   2 1040.05 182.415   2
   2  10   3 874.896 181.491   2
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   2  10   4 324.658 141.664   2
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   3   0 -13 1367.42 131.097   3
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   3   0 -12 328.797 93.1451   3
   3   0 -11 38101.4 587.461   3
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   3   0 -10 242.514 89.3234   3
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   3   0  -6-84.8319 52.1403   3
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   3   0  -5 9508.56 229.026   3
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   3   0  -4 22.3235 25.9693   3
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   3   0  -3 397209. 1370.12   3
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   3   0  -2 22.1715 20.5897   3
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   3   2   2 1596.66 77.4232   3
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   3   2   7 7219.08 293.179   2
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   3   2   8 3406.66 214.880   2
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   3   2   9 75.6829 66.2120   2
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   3   2  11 8440.43 401.219   2
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   3   2  12 3886.45 290.412   2
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   3   3   1 35179.5 510.503   2
   3   3   2 209167. 1293.74   2
   3   3   3 51336.5 662.020   2
   3   3   4 1228.71 58.9221   3
   3   3   4 1136.50 106.354   2
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   3   3   9 419.501 99.0797   2
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   3   3  12 10558.1 487.368   2
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   3   4   2 32180.0 569.828   2
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   3   4   6 9319.84 354.488   2
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   3   4  11 289.791 131.352   2
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   3   5  -2 12557.3 389.338   2
   3   5  -1 20913.6 505.820   2
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   3   5   6 153.981 74.4302   2
   3   5   6 47.3029 15.7878   3
   3   5   7 5271.31 302.300   2
   3   5   8 1340.61 160.776   2
   3   5   9-97.5347 112.846   2
   3   5  10 281.872 111.910   2
   3   5  11 4691.06 336.521   2
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   3   6   5 2758.77 228.421   2
   3   6   6 8843.06 402.955   2
   3   6   7 23712.7 667.475   2
   3   6   8 774.280 138.726   2
   3   6   9 1164.27 172.059   2
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   3   7   3 596.572 120.862   2
   3   7   4 4352.83 306.482   2
   3   7   5 6135.06 369.473   2
   3   7   6 4415.91 326.603   2
   3   7   7 1257.22 182.537   2
   3   7   8 6117.85 379.197   2
   3   7   9-36.1845 83.2831   2
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   3   8   5 2804.58 269.974   2
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   3   8   6 3034.06 277.760   2
   3   8   7 468.675 139.889   2
   3   8   8 3576.27 310.615   2
   3   8   9 1015.06 189.711   2
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   3   9  -6 7943.66 464.747   2
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   3   9  -5 5499.64 389.169   2
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   3   9   4 4291.56 347.612   2
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   3  10  -4 1714.56 236.246   2
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   3  10  -3 2858.38 286.185   2
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   3  10  -1-149.017 123.233   2
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   4   1   5 40004.5 576.208   2
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   4   1   6 3808.01 197.448   2
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   4   1   7 43982.8 705.331   2
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   4   1   9 4144.94 254.960   2
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   4  -1  10 8196.16 370.445   2
   4   1  10 8402.62 376.401   2
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   4  -1  11 381.258 118.111   2
   4   1  11 232.830 96.9173   2
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   4   1  12 6114.55 361.670   2
   4  -1  12 6678.98 372.675   2
   4   1  13 1103.29 177.785   2
   4   1  14 1751.63 229.769   2
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   4  -2 -11 35689.6 564.555   3
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   4  -2 -10 122553. 1026.95   3
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   4  -2  -9 48586.8 629.750   3
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   4  -2  -7 812.586 78.8153   3
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   4   2  -6 33949.2 258.005   1
   4  -2  -6 34030.7 490.968   3
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   4  -2  -5 7158.99 222.317   3
   4   2  -5 7198.04 143.277   1
   4  -2  -4 2834.88 130.877   2
   4   2  -4 2643.94 98.4979   1
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   4   2  -2 4783.56 152.702   1
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   4   2   1 290.091 50.2384   2
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   4   2   2 65083.5 641.449   2
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   4   2   3-4.66734 44.2585   2
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   4   2   4 15529.2 353.265   2
   4   2   5 103889. 981.503   2
   4   2   6 8714.63 314.037   2
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   4   2   7 3170.35 200.508   2
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   4   2   8 8437.38 344.974   2
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   4   2   9 971.643 134.745   2
   4   2  10 3413.64 248.807   2
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   4   2  11 1595.90 181.625   2
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   4   2  12 2261.16 229.029   2
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   4   2  13 794.708 146.863   2
   4   2  14 1227.88 197.272   2
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   4   3  -8 149.334 22.5256   1
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   4  -3  -3 4141.57 161.615   2
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   4  -3  -2 10552.8 239.464   2
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   4   3  -1 59502.6 672.081   2
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   4   3   0 134363. 1005.87   2
   4   3   1 7025.89 234.690   2
   4   3   2 35133.2 536.228   2
   4   3   2 34757.3 420.140   3
   4   3   3 15337.4 370.467   2
   4   3   3 14920.0 262.099   3
   4   3   4 8932.88 300.274   2
   4   3   4 9034.15 188.695   3
   4   3   5 764.395 103.441   2
   4   3   6 2898.35 193.196   2
   4   3   7 58.0728 59.9633   2
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   4   3   8 1024.83 122.825   2
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   4   3   9 247.764 95.9010   2
   4   3  10 6923.15 368.881   2
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   4   3  11 855.020 155.075   2
   4   3  12 3049.89 277.328   2
   4   3  13 336.679 125.892   2
   4   3  14 3068.80 299.997   2
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   4   4  -1 202437. 1417.89   2
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   4   4   0 148997. 1225.40   2
   4   4   1 583907. 2410.20   2
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   4   4   2 89894.2 969.999   2
   4   4   3 2428.62 175.098   2
   4   4   4 6331.42 178.346   3
   4   4   4 5578.62 256.635   2
   4   4   5 1684.32 158.877   2
   4   4   5 1457.79 73.7106   3
   4   4   6 4083.80 240.485   2
   4   4   7 14.4265 65.3323   2
   4   4   8 212.485 78.5348   2
   4   4   9-2.99986 83.2438   2
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   4   4  10 224.929 104.480   2
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   4   4  11 2080.12 231.899   2
   4   4  12 131.618 115.066   2
   4   4  13 489.736 143.882   2
   4   4  14 5993.68 429.782   2
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  -4   5   8 70.8046 81.8321   2
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   4   5  -2 7238.11 303.557   2
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   4   5  -1 63980.2 890.352   2
   4   5   0 1330.02 143.037   2
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   4   5   1 95.8735 61.7377   2
   4   5   2 2062.48 173.549   2
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   4   5   3 70568.8 966.392   2
   4   5   4 11159.5 403.438   2
   4   5   5 5202.42 273.328   2
   4   5   5 5765.23 166.467   3
   4   5   6 1429.87 180.067   2
   4   5   7 668.627 144.700   2
   4   5   8 1329.26 162.707   2
   4   5   9 202.348 79.4356   2
   4   5  10-18.4240 76.6287   2
   4   5  11 3105.06 289.102   2
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   4   5  12 479.819 159.218   2
   4   5  13 732.471 166.212   2
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  -4   6   7 400.746 103.485   2
  -4   6   6 370.827 102.357   2
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   4   6  -3 2474.61 205.697   2
   4   6  -2 294.552 82.2564   2
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   4   6  -1 3501.85 231.443   2
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   4   6   0 1227.08 138.654   2
   4   6   1 2969.77 217.841   2
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   4   6   2 7008.39 332.442   2
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   4   6   3 44508.7 843.143   2
   4   6   4 98812.6 1269.64   2
   4   6   5 82525.4 1200.84   2
   4   6   6 16821.8 571.145   2
   4   6   7 9390.53 430.355   2
   4   6   8 801.768 148.266   2
   4   6   9 5243.63 347.343   2
   4   6  10 5598.09 379.626   2
   4   6  11 6547.74 418.120   2
   4   6  12 5619.20 407.612   2
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   4   7  -4 1842.86 210.353   2
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   4   7  -3 1303.63 173.980   2
   4   7  -2 2451.13 215.882   2
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   4   7  -1-76.7980 99.2355   2
   4   7   0 83.6547 69.3361   2
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   4   7   1-289.356 126.981   2
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   4   7   2 341.592 84.1943   2
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   4   7   3 612.818 115.318   2
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   4   7   4 67.7308 80.6101   2
  -4   7  -4 212.754 99.1159   2
   4   7   5 769.167 157.384   2
   4   7   6 13382.7 532.990   2
   4   7   7 982.973 162.161   2
   4   7   8 48.0329 100.172   2
   4   7   9-124.080 114.636   2
   4   7  10-51.3567 109.602   2
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  -4   8   5 15195.6 556.981   2
   4   8  -5 15883.7 595.811   2
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   4   8  -4 6693.26 396.206   2
  -4   8   3 971.733 145.327   2
   4   8  -3 923.438 165.815   2
  -4   8   2 4414.80 288.519   2
   4   8  -2 4399.20 309.809   2
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   4   8  -1 1202.58 157.255   2
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   4   8   0 411.389 82.6012   2
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   4   8   1 1649.57 180.856   2
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   4   8   2-191.110 132.336   2
   4   8   3 2807.73 249.121   2
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   4   8   4 2278.00 239.046   2
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   4   8   5 271.575 123.183   2
   4   8   6 1613.84 216.563   2
   4   8   7-42.4873 97.5338   2
   4   8   8 41.5695 105.275   2
   4   8   9 3634.99 330.102   2
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  -4   9   7 120.088 110.502   2
   4   9  -7 120.732 121.328   2
   4   9  -6 966.494 183.925   2
  -4   9   6 1193.53 186.798   2
  -4   9   5 325.164 113.695   2
   4   9  -5 331.350 134.617   2
  -4   9   4 18.2096 77.6232   2
   4   9  -4 2.36707 86.4328   2
  -4   9   3 384.724 116.358   2
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   5   6   4 17381.7 542.092   2
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   5   6   7 10311.8 458.009   2
   5   6   8 2581.98 246.409   2
   5   6   9 77.4701 100.800   2
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   6   4   3 49272.3 769.931   2
   6   4   3 48039.9 614.910   3
   6   4   4 38433.3 527.898   3
   6   4   4 40843.1 731.854   2
   6   4   5 134825. 1382.17   2
   6   4   5 133481. 889.128   3
   6   4   6 7466.41 340.693   2
   6   4   7 46908.5 872.369   2
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   6   4   8 241.514 84.6638   2
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   6   4   9 1184.16 158.100   2
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   6   4  10 95.7489 84.3612   2
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   6   4  11 854.713 166.734   2
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   6   5  -3 534.613 91.8158   2
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   6   5   0 85.9084 73.7856   2
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   6   5   1 27608.3 610.483   2
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   6   5   2 3109.08 207.136   2
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   6   5   3 7685.91 330.820   2
   6   5   3 7897.80 262.658   3
   6   5   4 5304.40 284.933   2
   6   5   4 5112.57 204.922   3
   6   5   5 10036.7 400.053   2
   6   5   5 9570.69 253.595   3
   6   5   6 173.004 84.3849   2
   6   5   7 503.972 120.428   2
   6   5   8 1650.27 189.604   2
   6   5   9 568.412 129.490   2
   6   5  10 2470.74 257.831   2
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   6   5  11 2980.58 297.913   2
   6   5  12 443.414 138.552   2
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   6   6   5 504.236 103.936   2
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   7   0 -14-35.2259 64.3811   3
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   7   0  -8-16.9041 57.4303   3
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   7   0  -7 5770.65 260.210   3
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   7   0  -6 30.1556 49.4015   3
   7   0  -5 19276.7 364.599   2
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   7   0  -5 19819.5 469.849   3
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   7   0  -4 37.8346 54.4933   3
   7   0  -4-7.68382 21.1236   2
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   7   0  -1 85849.8 920.812   3
   7   0  -1 86262.8 383.219   2
   7   0   0 19.1461 17.7480   2
   7   0   0 199.856 94.0821   3
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   7   0   1 165428. 626.260   2
   7   0   2-18.1696 25.4940   2
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   7   0  12-60.2280 88.6739   2
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   7  -1  -8 8756.05 330.569   3
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   7   1  -7 6561.76 281.398   3
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   7   1  -4 3112.38 186.513   3
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   7  -1   6 322.257 65.8942   2
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   7   1   6 381.872 76.7705   2
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   7   2  -8 510.706 95.0961   3
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   7  -2  -7 2184.93 166.569   3
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   7   2  -6 31747.0 618.259   3
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   7   2   0 10766.2 268.050   2
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   7   2   0 10427.3 318.277   3
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   7   2   5 6605.83 268.582   2
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   7   2   6 15525.4 439.309   2
   7   2   7 10206.1 375.522   2
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   7   2   8 9346.35 379.331   2
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   7   2   9 669.971 120.790   2
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   7   2  11-30.1436 70.8511   2
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   7   2  13 1966.93 241.824   2
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   7   3  -4 493.295 107.816   3
   7  -3  -4 446.261 64.6523   2
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   7  -3  -3 631.698 57.7235   2
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   7   3  -1 3671.45 181.187   2
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   7   3   0 9554.19 290.864   2
   7   3   0 9240.79 310.349   3
   7   3   1 12.5257 43.9034   2
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   7   3   1 14.6044 37.3368   3
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   7   3   2 13744.7 362.520   2
   7   3   2 13818.6 360.290   3
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   7   3   3 10793.2 338.376   2
   7   3   3 10360.9 303.369   3
   7   3   4 35020.3 629.875   2
   7   3   4 33079.3 514.076   3
   7   3   5 1329.73 150.160   2
   7   3   6 1976.69 190.772   2
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   7   3   7 12310.5 441.604   2
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   7   3   8 7604.59 361.954   2
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   7   3   9 1080.64 150.682   2
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   7   3  10 728.897 138.085   2
   7   3  11 832.041 150.678   2
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   7   3  12-59.9968 89.7325   2
   7   3  13 343.514 117.468   2
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   7   4  -2 1421.23 128.322   2
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   7   4  -1 3296.58 195.826   2
   7   4  -1 3510.86 199.774   3
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   7   4   0 11342.7 359.128   2
   7   4   0 11068.8 344.241   3
   7   4   1 3341.24 199.185   2
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   7   4   1 3681.85 194.542   3
   7   4   2 2370.51 155.352   3
   7   4   2 2372.75 169.890   2
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   7   4   3 8746.67 286.019   3
   7   4   3 8991.61 339.736   2
   7   4   4-134.234 75.7053   2
   7   4   4 12.8314 41.6623   3
   7   4   5 18701.5 516.301   2
   7   4   5 17798.2 360.665   3
   7   4   6 7550.28 345.373   2
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   7   4  10-25.6658 86.9790   2
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   7   4  12 599.700 146.331   2
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   7   5   1 24507.4 509.210   3
   7   5   2 15843.3 476.120   2
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   7   5   3-38.5946 78.0879   2
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   7   5   4 17184.2 519.731   2
   7   5   4 16749.9 393.134   3
   7   5   5 10654.7 430.763   2
   7   5   6 9875.61 430.869   2
   7   5   7 169.651 90.1955   2
   7   5   8 7801.85 405.958   2
   7   5   9 4306.21 319.713   2
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   7   5  10 9431.22 482.068   2
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   7   5  11 306.279 141.491   2
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   7   6  -3 25037.7 657.018   2
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   7   6  -2 39.9248 78.8801   2
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   7   6   1 417.351 128.210   2
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   7   6   2 5506.79 313.894   2
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   7   6   2 5691.98 257.443   3
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   7   6   4-61.4212 99.9814   2
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   7   6   7 13.2416 77.6496   2
   7   6   8 664.116 150.123   2
   7   6   9 6338.42 404.116   2
   7   6  10 302.116 129.434   2
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   7   7  -5 3271.18 264.009   2
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   7   7  -2 19416.7 616.790   2
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   7   7  -1 13012.9 511.949   2
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   7   7   0 5081.00 332.586   2
   7   7   1 162.627 108.502   2
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   7   7   2 21715.0 657.081   2
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   7   7   2 21459.9 511.040   3
   7   7   3 7104.18 385.366   2
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   7   7   4 3181.06 262.927   2
   7   7   5 495.322 107.592   2
   7   7   6 430.442 115.764   2
   7   7   7 812.945 137.471   2
   7   7   8 221.466 96.7477   2
   7   7   9 185.622 113.877   2
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   7   8  -6-203.226 130.575   2
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   7   8  -5-4.07921 85.5109   2
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   7   8  -4 798.143 148.818   2
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   7   8  -3 890.922 168.364   2
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   7   8  -2 2117.50 236.871   2
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   7   8  -1 181.771 133.434   2
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   7   8   0 11411.5 513.623   2
   7   8   1 419.670 150.840   2
   7   8   2 2409.30 244.031   2
   7   8   3 2025.66 225.092   2
   7   8   4 43.7259 116.086   2
   7   8   5 788.553 145.854   2
   7   8   6-160.458 131.326   2
   7   8   7 71.3418 94.1758   2
   7   9  -6-9.48905 110.566   2
   7   9  -5 118.117 90.9577   2
   7   9  -4 2564.33 273.083   2
   7   9  -3 2914.16 293.642   2
   7   9  -2 2487.33 276.790   2
   7   9  -1 195.707 127.021   2
   7   9   0 300.801 133.437   2
   7   9   1 5376.76 389.058   2
   7   9   2 93.9811 112.095   2
   7   9   3 322.812 137.938   2
   7   9   4 225.171 116.225   2
   8   0 -14 206.927 80.8039   3
   8   0 -13-30.9864 62.7418   3
   8   0 -12 968.678 135.881   3
   8   0 -11-7.58242 64.6668   3
   8   0 -10 7819.29 344.742   3
   8   0  -9 30.0071 55.3637   3
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   8   0  -8 13081.2 427.010   3
   8   0  -7 29.0542 62.0971   3
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   8   0  -6 4407.76 245.637   3
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   8   0  -5-26.3423 45.1405   3
   8   0  -5-13.4757 29.2674   2
   8   0  -4 1654.65 97.5579   2
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   8   0  -4 1721.06 153.929   3
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   8   0  -3-25.5387 51.1731   3
   8   0  -3 5.36116 18.6117   2
   8   0  -2 1225.54 56.4978   2
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   8   0  -2 1223.05 56.2099   2
   8   0  -2 1189.50 124.675   3
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   8   0  -1 100.429 76.9322   3
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   8   0   0 74854.0 927.120   3
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   8   0   1 28.6775 17.3572   2
   8   0   2 34804.8 350.685   2
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   8   0   3 8.67954 29.6259   2
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   8   0   4 41040.4 518.402   2
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   8   0   5-53.3810 50.2222   2
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   8   0   6 3128.01 177.049   2
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   8   0   7-9.86959 61.5274   2
   8   0   8 685.765 110.996   2
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   8   0   9 49.5493 68.0861   2
   8   0  10 64.7566 68.9031   2
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   8   0  11-12.5564 77.2299   2
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   8   1 -15 918.951 146.223   3
   8  -1 -14 56.4282 71.7452   3
   8   1 -14-17.1011 71.2372   3
   8  -1 -13 2412.79 212.121   3
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   8   1 -12 999.331 138.837   3
   8  -1 -12 1280.93 155.639   3
   8  -1 -11 11084.3 419.384   3
   8   1 -11 10480.1 410.553   3
   8   1 -10 7813.15 345.573   3
   8  -1 -10 8186.70 357.742   3
   8   1  -9 1645.73 164.159   3
   8  -1  -9 1716.20 168.730   3
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   8  -1  -8 3094.55 216.148   3
   8   1  -8 2900.71 208.212   3
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   8  -1  -7 4327.84 243.654   3
   8   1  -7 4116.73 242.292   3
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   8   1  -6 5515.07 272.526   3
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   8  -1  -6 5507.14 273.735   3
   8  -1  -5 307.824 48.1673   2
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   8  -1  -5 188.615 68.5040   3
   8   1  -5 266.483 68.8042   3
   8  -1  -4 1068.98 70.4121   2
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   8  -1  -4 1133.62 128.328   3
   8   1  -4 1079.40 94.7236   2
   8   1  -4 1012.51 120.070   3
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   8  -1  -3 208.040 26.5444   2
   8   1  -3 215.098 44.7119   2
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   8  -1  -3 60.8190 49.5866   3
   8   1  -3 117.962 44.9726   3
   8   1  -2 1026.13 74.0225   2
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   8  -1  -2 992.318 118.255   3
   8   1  -2 971.494 112.096   3
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   8   1  -1 3625.94 128.388   2
   8   1  -1 3649.47 210.731   3
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   8   1   0 74242.7 575.951   2
   8   1   0 74120.3 905.484   3
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   8   1   1 10237.1 224.043   2
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   8   1   1 10797.4 343.784   3
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   8   1   2 6909.15 200.685   2
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   8   1   3 13656.8 305.116   2
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   8   1   4 40817.1 570.061   2
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   8   1   5 19068.7 430.733   2
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   8   1   6 131.684 71.1990   2
   8   1   7 5564.75 266.873   2
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   8   1   8 561.672 101.816   2
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   8   1   9-70.7956 64.5490   2
   8   1  10 1311.76 167.190   2
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   8   1  11 8470.69 415.837   2
   8   1  12 30.4891 87.7792   2
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   8   2 -16 1616.96 205.951   3
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   8   2 -15 228.718 98.1323   3
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   8   2 -14 2.42381 69.0292   3
   8  -2 -13 1623.99 173.757   3
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   8   2 -13 1597.29 189.278   3
   8  -2 -12 1064.88 139.000   3
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   8   2 -12 999.148 145.721   3
   8  -2 -11 6671.35 321.761   3
   8   2 -11 6240.07 326.230   3
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   8  -2 -10 4114.61 250.515   3
   8   2 -10 4292.87 262.773   3
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   8  -2  -9 4368.90 251.740   3
   8   2  -9 4555.35 266.989   3
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   8  -2  -8 1523.36 154.411   3
   8   2  -8 1617.84 161.804   3
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   8   2  -7 258.850 68.6960   3
   8  -2  -7 348.211 95.3287   3
   8  -2  -6 7556.56 320.003   3
   8   2  -6 7937.69 333.437   3
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   8  -2  -5 64.6551 31.8015   2
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   8   2  -5 149.778 74.7622   3
   8  -2  -4 5648.04 160.582   2
   8   2  -4 5752.85 266.677   3
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   8  -2  -3 15.3264 16.1309   2
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   8   2  -3 22.7635 45.7415   3
   8   2  -2 3112.46 154.913   2
   8   2  -2 2962.30 190.334   3
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   8   2  -1 794.571 79.7048   2
   8   2  -1 797.794 101.031   3
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   8   2   0 267.638 50.6759   2
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   8   2   0 252.200 48.6131   3
   8   2   1 1909.35 121.790   2
   8   2   1 1851.21 146.719   3
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   8   2   2 5118.39 200.290   2
   8   2   2 5230.86 237.228   3
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   8   2   3 6343.44 235.659   2
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   8   2   3 6557.81 261.831   3
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   8   2   4 32361.2 566.607   2
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  -8   2  -5 102031. 1293.98   1
   8   2   5 100542. 1065.54   2
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   8   2   6 78592.3 1001.48   2
  -8   2  -6 78528.8 1162.79   1
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   8   2   7 12551.7 424.188   2
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   8   2   8 1781.11 175.102   2
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   8   2   9 429.030 109.698   2
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   8   2  10 3101.75 248.764   2
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   8   2  11-112.654 100.878   2
   8   2  12-43.2329 106.533   2
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   8   2  13 10.2823 101.211   2
   8   3 -16 2324.44 248.199   3
   8   3 -15 1959.85 223.546   3
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   8   3 -14 321.481 109.019   3
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   8   3 -13-76.1975 72.8671   3
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   8   3 -12 196.364 82.5737   3
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   8   3 -11 859.760 131.716   3
   8   3 -10 3789.07 262.912   3
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  -8   3   9 1787.66 157.303   2
   8   3  -9 1969.72 191.274   3
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   8   3  -8 2396.90 201.077   3
  -8   3   7 55382.2 771.177   2
   8   3  -7 55477.6 915.052   3
  -8   3   6 20927.4 435.050   2
   8   3  -6 22758.8 576.590   3
  -8   3   5 7487.65 237.131   2
   8   3  -5 7764.67 336.203   3
  -8   3   4 6427.86 197.171   2
   8   3  -4 6596.09 296.140   3
  -8   3   3 13263.7 237.127   2
   8   3  -3 13154.2 408.558   3
  -8   3   2 821.304 47.5972   2
   8   3  -2 857.605 98.2342   2
   8   3  -2 824.665 110.629   3
   8   3  -1 2731.94 161.644   2
   8   3  -1 2749.47 182.591   3
   8   3   0 2519.78 151.711   2
   8   3   0 2627.94 175.015   3
   8   3   1 7241.53 290.938   3
   8   3   1 7542.84 269.295   2
   8   3   2 15.4335 37.6702   2
  -8   3  -2 86.3848 23.1676   2
   8   3   2 37.1370 42.5933   3
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   8   3   3 4855.66 222.918   2
   8   3   3 5100.11 233.460   3
   8   3   4-38.7505 65.3639   2
   8   3   4-22.0991 47.1575   3
   8   3   5 2383.51 182.481   2
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   8   3   6 274.082 77.1129   2
  -8   3  -6 198.983 105.349   1
  -8   3  -7 3249.80 259.057   1
   8   3   7 3255.13 228.327   2
   8   3   8 1311.71 167.783   2
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  -8   3  -9 526.912 127.139   1
   8   3   9 474.773 111.769   2
  -8   3 -10-5.75897 93.0715   1
   8   3  10 123.033 80.1130   2
  -8   3 -11 866.885 149.669   1
   8   3  11 825.879 153.447   2
  -8   3 -12 628.173 141.633   1
   8   3  12 472.898 124.986   2
   8   3  13 2364.81 263.951   2
   8   4 -15 2171.59 249.531   3
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  -8   4   5 133323. 1099.18   2
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   8   4  -4 18054.0 506.526   3
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   8   4  -3 11886.7 389.380   2
   8   4  -3 11518.0 394.895   3
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   8   4  -2 4686.62 248.730   3
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   8   4  -1 10295.9 346.590   2
   8   4  -1 10413.1 361.639   3
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   8   4   0 6859.66 290.314   3
   8   4   1 33.4555 47.3081   2
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   8   4   1-38.5799 62.2382   3
   8   4   2 275.085 67.0968   2
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   8   4   2 80.5911 56.4999   3
   8   4   3 3380.18 217.829   2
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   8   4   3 3507.80 198.230   3
   8   4   4 9.04976 82.7624   2
   8   4   4 191.389 63.7436   3
   8   4   5 18125.5 527.688   2
   8   4   6 557.578 115.605   2
   8   4   7 530.023 109.815   2
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   8   4   8 2026.60 206.671   2
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   8   4   9 426.094 122.753   2
   8   4  10 7322.89 414.830   2
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   8   4  11 754.149 169.384   2
   8   4  12 4158.62 342.705   2
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   8   5   1 3706.69 238.993   2
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   8   5   2-15.3904 45.1542   3
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   8   5   3 247.752 53.0430   3
   8   5   4 4393.93 271.134   2
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   8   5   5 9438.05 411.643   2
   8   5   6 6.23340 67.7431   2
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   8   5   9 341.001 120.311   2
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   8   5  10 577.561 149.798   2
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   8   6  -4 75.3742 99.2569   2
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   8   6  -3 157.140 81.3908   2
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   8   6  -2 171.059 103.799   2
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   8   6   0 388.530 107.978   2
   8   6   0 350.100 93.0588   3
   8   6   1 4291.65 279.489   2
   8   6   1 4107.47 234.854   3
   8   6   2 6285.08 340.473   2
   8   6   2 6233.39 286.496   3
   8   6   3 187.409 74.2375   2
   8   6   3 405.616 76.3444   3
   8   6   4-12.5588 74.9386   2
   8   6   5 4506.30 303.407   2
   8   6   6 8762.86 436.129   2
   8   6   7 3002.38 263.536   2
   8   6   8 1353.75 204.537   2
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   8   6   9 1031.94 174.970   2
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   8   6  10 335.150 111.192   2
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   8   7  -6 1223.53 174.785   2
   8   7  -5 243.555 92.2345   2
   8   7  -4 3129.09 264.151   2
   8   7  -3 3091.40 260.575   2
   8   7  -2 4707.23 316.545   2
   8   7  -1 111.797 101.722   2
   8   7   0 939.946 165.283   2
   8   7   0 1024.65 142.880   3
   8   7   1 2205.86 186.852   3
   8   7   1 2272.19 232.328   2
   8   7   2 4971.20 327.301   2
   8   7   2 4446.04 252.957   3
   8   7   3 976.598 162.600   2
   8   7   4 268.254 93.5480   2
   8   7   5 534.750 126.128   2
   8   7   6 492.737 119.959   2
   8   7   7-147.988 123.972   2
   8   7   8 96.8032 110.832   2
   8   8  -7 183.341 106.500   2
   8   8  -6 42.3581 94.2903   2
   8   8  -5 687.915 136.030   2
   8   8  -4 81.7134 98.0016   2
   8   8  -3 558.787 136.874   2
   8   8  -2 447.631 159.299   2
   8   8  -1 3018.44 290.181   2
   8   8   0 14870.3 589.812   2
   8   8   1 11443.4 524.525   2
   8   8   1 10515.8 400.019   3
   8   8   2 7061.09 418.002   2
   8   8   3 2107.40 240.595   2
   8   8   4 373.750 112.274   2
   8   8   5-55.7215 110.734   2
   8   8   6 2009.14 248.580   2
   8   9  -5-60.6479 106.660   2
   8   9  -4-53.9262 99.0202   2
   8   9  -3 583.577 166.136   2
   8   9  -2 350.399 148.440   2
   8   9  -1 839.082 183.342   2
   8   9   0 1067.62 187.635   2
   8   9   1 220.027 114.557   2
   8   9   2 392.963 137.709   2
   8   9   3 259.415 122.290   2
   9   0 -15 1075.99 158.049   3
   9   0 -14 13.2370 79.5365   3
   9   0 -13 1782.61 191.120   3
   9   0 -12-0.60012 76.1145   3
   9   0 -11 11642.2 454.560   3
   9   0 -10 344.059 126.297   3
   9   0  -9 21032.9 598.706   3
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   9   0  -8-70.5605 84.0303   3
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   9   0  -7 8222.30 353.911   3
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   9   0  -6 43.0994 64.4036   3
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   9   0  -4-46.9178 68.0279   3
   9   0  -4 27.9670 28.7093   2
   9   0  -3 2651.93 97.3040   2
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   9   0  -3 2729.14 197.014   3
   9   0  -2-0.38013 12.9367   2
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   9   0  -2 19.1369 56.1166   3
   9   0  -2-14.1923 15.0874   2
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   9   0  -1 16721.3 471.587   3
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   9   0   2-3.97735 20.3386   2
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   9   0   3 1247.09 80.6474   2
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   9   0   4 14.1546 38.4184   2
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   9   0   5 25838.5 455.433   2
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   9   0   6 3.73171 54.0098   2
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   9   1 -15 173.928 76.6870   3
   9  -1 -14 69.9875 74.3942   3
   9   1 -14 51.9331 67.1846   3
   9  -1 -13 175.919 89.1151   3
   9   1 -13 183.211 78.2514   3
   9  -1 -12 28.4266 73.1993   3
   9   1 -12-8.68692 73.6615   3
   9  -1 -11 2774.28 225.207   3
   9   1 -11 2606.23 224.163   3
   9  -1 -10 507.753 119.926   3
   9   1 -10 420.292 104.610   3
   9   1  -9 9302.09 392.708   3
   9  -1  -9 8986.47 384.140   3
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   9  -1  -8 817.671 125.822   3
   9   1  -8 926.198 127.976   3
   9  -1  -7 7815.06 344.190   3
   9   1  -7 7389.77 332.392   3
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   9  -1  -6 9831.63 386.264   3
   9   1  -6 8696.71 363.419   3
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   9  -1  -5 18229.6 518.062   3
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   9   1  -5 17543.5 504.507   3
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   9  -1  -4 16262.2 482.513   3
   9   1  -4 15343.0 472.871   3
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   9  -1  -3 1574.07 156.052   3
   9   1  -3 1419.33 149.450   3
   9   1  -3 1353.07 94.2662   2
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   9   1  -2 1974.43 167.124   3
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   9   1  -2 1965.59 101.818   2
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   9   1  -1 206.733 34.6148   2
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   9   1  -1 210.144 69.2252   3
   9   1   0 625.771 58.8233   2
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   9   1   0 593.409 97.1363   3
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   9   1   1 11080.9 233.428   2
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   9   1   1 11401.1 377.530   3
   9   1   2 364.749 50.1854   2
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   9   1   3 5715.62 197.580   2
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   9   1   4 24.6269 42.4964   2
   9   1   5 2807.28 171.530   2
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   9   1   6 776.846 121.534   2
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   9   1   7 18050.0 484.962   2
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   9   1   8 4838.70 272.940   2
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   9   2 -16 2668.70 267.103   3
   9   2 -15 971.035 161.134   3
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   9   2 -14-14.6768 75.6283   3
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   9  -2 -13 296.111 94.7119   3
   9   2 -13 209.499 102.637   3
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   9  -2 -12 551.224 112.757   3
   9   2 -12 506.187 113.281   3
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   9  -2 -11 339.485 90.8269   3
   9   2 -11 226.941 75.5299   3
   9  -2 -10 1759.22 175.357   3
   9   2 -10 1999.82 191.086   3
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   9  -2  -9-103.784 94.3972   3
   9   2  -9-29.8396 72.3020   3
   9  -2  -8 2179.99 194.571   3
   9   2  -8 2165.15 192.682   3
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   9   2  -7 4432.45 264.845   3
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   9  -2  -6 534.737 136.264   3
   9   2  -6 96.5068 76.6519   3
   9   2  -5 8.26846 60.0357   3
   9   2  -4 770.920 109.919   3
   9   2  -3 16719.5 367.307   2
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   9   2  -2 7003.89 228.615   2
   9   2  -2 6775.22 304.631   3
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   9   2  -1 2380.17 131.662   2
   9   2  -1 2497.48 187.587   3
   9   2   0 24141.6 415.629   2
   9   2   0 24006.3 561.709   3
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   9   2   1 20169.9 392.961   2
   9   2   1 19899.4 500.354   3
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  -9   2  -1 20432.5 564.678   1
   9   2   2 24720.4 450.464   2
   9   2   2 24305.2 545.736   3
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   9   2   3 3516.50 181.869   2
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   9   2   4 2781.04 176.436   2
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   9   2   5 3015.99 187.529   2
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   9   2   6 1526.45 139.040   2
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   9   2   7 812.054 120.854   2
   9   2   8 1164.57 148.631   2
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   9   2   9 847.762 132.714   2
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  -9   2 -11 740.269 140.484   1
  -9   2 -12 200.423 109.944   1
   9   3 -15 7912.15 445.559   3
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   9   3 -14 351.480 119.508   3
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   9   3 -13 165.080 101.935   3
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   9   3 -12 260.244 96.8018   3
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   9   3 -11 686.498 123.684   3
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   9   3 -10 86.2574 72.9114   3
  -9   3   9 167.856 69.1903   2
   9   3  -9 81.6240 68.9206   3
   9   3  -8 8139.29 373.759   3
  -9   3   8 8468.15 324.797   2
   9   3  -7 16877.6 526.085   3
  -9   3   7 17136.3 420.916   2
   9   3  -6 33111.6 725.643   3
  -9   3   6 34843.6 544.167   2
   9   3  -5 18620.0 537.455   3
  -9   3   5 18886.7 354.562   2
   9   3  -4 3154.15 221.471   3
  -9   3   4 3297.14 127.912   2
   9   3  -3 3563.89 196.767   2
   9   3  -3 3314.22 219.111   3
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   9   3  -2-26.4744 53.3003   2
   9   3  -2-26.0014 60.8518   3
   9   3  -1 355.238 70.8096   2
   9   3  -1 242.792 60.2535   3
   9   3   0 31.6750 40.3184   2
   9   3   0-21.8242 64.0818   3
   9   3   1 2030.41 148.938   2
   9   3   1 1829.12 156.956   3
   9   3   2 50.7407 46.6557   2
   9   3   2 45.1667 44.5045   3
   9   3   3 4753.84 227.905   2
   9   3   3 4610.92 236.408   3
   9   3   4 5045.91 249.792   2
  -9   3  -4 5267.49 316.838   1
   9   3   5 9498.88 359.920   2
  -9   3  -5 9656.16 439.917   1
  -9   3  -6 5526.24 347.902   1
   9   3   6 5398.24 289.068   2
  -9   3  -7 1938.79 213.719   1
   9   3   7 1776.53 187.483   2
   9   3   8 3665.30 259.472   2
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   9   3   9 7209.20 384.880   2
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   9   3  10 2299.66 242.365   2
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  -9   3 -11 20.7562 85.3499   1
  -9   3 -12 483.733 146.772   1
  -9   4  15 115.678 127.293   2
  -9   4  14 337.404 127.713   2
   9   4 -14 599.703 158.031   3
   9   4 -13 2153.45 240.884   3
  -9   4  13 2074.32 240.352   2
  -9   4  12 87.1131 84.9034   2
   9   4 -12 85.1880 78.3115   3
  -9   4  11 40.8984 64.4782   2
   9   4 -11-45.7027 106.147   3
  -9   4  10-88.7194 89.1879   2
   9   4 -10-1.24463 82.4813   3
  -9   4   9 52.5237 63.5506   2
   9   4  -9 201.226 102.854   3
  -9   4   8-19.3648 63.6823   2
   9   4  -8 119.962 88.7066   3
  -9   4   7 1184.72 118.117   2
   9   4  -7 1450.65 173.334   3
  -9   4   6 457.375 72.5582   2
   9   4  -6 518.340 116.138   3
  -9   4   5 6301.11 226.378   2
   9   4  -5 5984.45 323.964   3
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  12   4   1 159.430 79.9954   3
  12   4   2 1765.44 189.142   3
 -12   4  -2 1871.29 224.746   1
 -12   4  -3-207.306 135.727   1
  12   4   3 16.6680 68.9241   3
 -12   4  -4-33.1219 109.703   1
 -12   4  -5 4461.08 366.531   1
 -12   4  -6-14.1165 111.049   1
  12   5  -8 321.500 102.524   3
  12   5  -7 162.929 91.6685   3
  12   5  -6 26.3738 91.7681   3
  12   5  -5 597.304 128.849   3
  12   5  -4-41.2553 87.8784   3
  12   5  -3 1555.10 182.016   3
  12   5  -2 527.604 118.260   3
  12   5  -1 821.260 137.873   3
  12   5   0 2491.87 226.810   3
  12   5   1 187.591 91.6180   3
  12   5   2 309.738 91.2785   3
 -12   5  -3 6416.78 423.661   1
 -12   5  -4 136.720 111.487   1
  12   6  -8-5.22696 135.109   2
  12   6  -7 438.612 122.898   2
  12   6  -7 506.181 120.929   3
  12   6  -6 1079.95 168.526   2
  12   6  -6 768.176 161.265   3
  12   6  -5 139.322 90.4901   3
  12   6  -4 482.031 136.906   3
  12   6  -3 1236.68 177.049   3
  12   6  -2 46.5555 78.5354   3
  12   6  -1 395.974 100.875   3
  12   6   0 96.6153 70.7678   3
  12   7  -7 1732.91 222.415   2
  12   7  -6 3996.55 326.714   2
  12   7  -5 3925.00 328.044   2
  12   7  -4 1150.33 175.528   2
  12   7  -4 1168.75 182.125   3
  12   7  -3 1116.76 172.724   3
  12   7  -2 1076.28 168.231   3
  12   7  -1 118.705 76.1574   3
  13   0 -12 5.34167 84.2291   3
  13   0 -11 126.705 79.4851   3
  13   0 -10-94.6195 90.1776   3
  13   0  -9 158.222 98.9326   3
  13   0  -8 24.2519 82.4583   3
  13   0  -7 525.730 127.884   3
 -13   0   6-21.8072 89.1155   1
  13   0  -6 111.998 112.700   3
 -13   0   5 640.829 98.2669   1
  13   0  -5 804.956 157.840   3
 -13   0   4-57.1759 79.7235   1
  13   0  -4-9.79816 85.8777   3
 -13   0   3 7006.96 353.888   1
 -13   0   2-5.27790 81.5154   1
 -13   0   1-181.764 120.312   1
 -13   0   0-183.297 118.111   1
 -13   0  -1 3785.05 283.023   1
 -13   0  -2-5.05543 86.9921   1
 -13   0  -3 38.2709 82.6785   1
 -13   0  -4-10.0624 86.2478   1
 -13   0  -5-53.9872 100.053   1
 -13   0  -6-149.438 124.844   1
  13  -1 -12 117.695 102.940   3
  13  -1 -11 371.592 129.934   3
  13   1 -11 466.279 146.374   3
  13  -1 -10 395.339 128.082   3
  13   1 -10 398.413 134.641   3
  13  -1  -9 3709.84 308.168   3
  13   1  -9 3517.19 303.512   3
  13  -1  -8-28.9045 86.3465   3
  13   1  -8 239.214 121.282   3
  13  -1  -7 2313.81 249.342   3
  13   1  -7 2260.18 238.728   3
 -13   1   6 7252.66 358.771   1
  13   1  -6 6605.74 401.165   3
 -13  -1   6 7316.49 321.101   1
 -13   1   5 19156.4 581.085   1
  13   1  -5 18359.6 640.974   3
 -13  -1   5 18120.9 520.463   1
 -13   1   4 1043.06 180.114   1
 -13  -1   4 842.135 143.051   1
  13   1  -4 1242.18 209.310   3
 -13   1   3 2749.86 243.088   1
  13   1  -3 2981.29 271.363   3
 -13  -1   3 2802.16 226.326   1
 -13   1   2 2591.46 235.879   1
  13   1  -2 2660.19 250.245   3
 -13  -1   2 2683.48 231.025   1
 -13   1   1 13212.3 523.630   1
 -13  -1   1 12510.8 494.271   1
 -13   1   0 12742.0 524.330   1
 -13  -1   0 12064.7 493.489   1
 -13  -1  -1 219.769 112.747   1
 -13   1  -1 10.9543 89.2784   1
 -13  -1  -2 666.337 144.928   1
 -13   1  -2 730.160 142.110   1
 -13   1  -3 457.182 125.922   1
 -13  -1  -3 622.257 152.185   1
 -13   1  -4-4.29799 102.550   1
 -13  -1  -4 209.480 108.211   1
 -13   1  -5 4277.93 334.723   1
 -13  -1  -5 3732.72 310.890   1
 -13   1  -6 5498.96 381.949   1
 -13  -1  -6 5437.20 380.975   1
  13   2 -11-102.143 115.856   3
  13   2 -10 19.4927 105.079   3
  13   2  -9 2035.20 236.943   3
  13   2  -8 0.87949 98.7462   3
 -13   2   7 153.451 84.4329   1
  13   2  -7 211.759 117.403   3
 -13   2   6 76.2698 101.886   1
  13   2  -6 97.8556 114.738   3
 -13   2   5 214.575 104.050   1
  13   2  -5 199.148 113.773   3
 -13   2   4 1995.25 201.967   1
  13   2  -4 2624.25 249.118   3
 -13   2   3 3556.35 281.103   1
  13   2  -3 3597.33 283.660   3
 -13  -2   3 3168.60 237.556   1
 -13   2   2 2090.14 221.610   1
  13   2  -2 2006.88 222.879   3
 -13  -2   2 1469.07 170.448   1
 -13  -2   1-64.3556 81.8818   1
 -13   2   1 62.9657 103.333   1
  13   2  -1 107.020 106.858   3
 -13   2   0 9421.79 469.938   1
  13   2   0 8789.58 433.742   3
 -13  -2   0 8364.90 399.172   1
 -13  -2  -1 824.529 148.119   1
 -13   2  -1 889.818 168.379   1
 -13  -2  -2 285.774 105.275   1
 -13   2  -2 256.242 104.821   1
 -13  -2  -3 503.218 152.948   1
 -13   2  -3 234.538 112.215   1
 -13   2  -4 2016.92 239.766   1
 -13  -2  -4 2164.27 241.543   1
 -13  -2  -5 639.873 174.707   1
 -13   2  -5 201.936 113.703   1
  13   3  -9 473.560 138.764   3
  13   3  -8 150.690 92.9435   3
 -13   3   7 448.996 98.0064   1
  13   3  -7 651.871 153.117   3
  13   3  -6 2551.03 254.476   3
 -13   3   6 2332.08 217.598   1
 -13   3   5 1208.30 152.499   1
  13   3  -5 1745.38 203.874   3
 -13   3   4 915.745 153.202   1
  13   3  -4 1149.90 168.670   3
 -13   3   3 461.843 108.658   1
  13   3  -3 456.992 118.851   3
 -13   3   2-110.471 120.035   1
  13   3  -2 19.1029 74.1356   3
 -13   3   1-98.2731 112.688   1
  13   3  -1 71.6837 74.7691   3
 -13   3   0 207.712 104.943   1
  13   3   0 204.096 95.3715   3
 -13   3  -1 1162.41 186.601   1
  13   3   1 998.773 149.172   3
 -13   3  -2 1400.85 202.322   1
 -13   3  -3 168.818 111.877   1
 -13   3  -4 2245.02 267.488   1
 -13   3  -5 165.587 118.697   1
  13   4  -8 523.886 154.819   3
  13   4  -7 233.212 114.964   3
  13   4  -6 243.770 116.886   3
  13   4  -5 260.209 91.4647   3
  13   4  -4 162.232 90.7077   3
  13   4  -3 382.824 115.231   3
  13   4  -2 608.146 135.064   3
 -13   4   1 312.612 112.813   1
  13   4  -1 302.819 102.839   3
 -13   4   0-5.22297 95.3730   1
  13   4   0 18.4861 70.2173   3
  13   4   1 2178.95 224.060   3
 -13   4  -1 2348.08 256.544   1
 -13   4  -2 440.290 151.406   1
  13   4   2 346.199 111.569   3
 -13   4  -3 510.413 142.497   1
  13   5  -7 1147.63 188.742   3
  13   5  -6-45.5913 93.8775   3
  13   5  -5-39.6721 86.8220   3
  13   5  -4-5.23101 84.4120   3
  13   5  -3 394.858 105.139   3
  13   5  -2-88.5706 92.8827   3
  13   5  -1 100.677 92.6908   3
  13   5   0 28.0214 78.1360   3
  13   5   1 1146.44 174.703   3
  13   6  -5 2647.46 270.615   3
  13   6  -4 228.354 91.7350   3
  13   6  -3-116.730 111.626   3
  13   6  -2-23.3069 94.6450   3
  13   6  -1 700.758 142.045   3
  13   6   0 897.546 164.177   3
  13   7  -2 152.514 91.6417   3
  13   7  -1 708.907 142.517   3
  14   0 -10 1571.93 222.776   3
  14   0  -9-12.4987 98.7970   3
  14   0  -8 27.7661 88.6617   3
  14   0  -7-130.422 107.205   3
  14   0  -6 655.996 147.313   3
 -14   0   5 9.27710 71.8104   1
  14   0  -5 45.8966 88.6104   3
 -14   0   4 3289.87 250.957   1
 -14   0   3-37.5095 69.5041   1
 -14   0   2 151.576 110.692   1
 -14   0   1 310.786 131.369   1
 -14   0   0 6824.42 404.584   1
 -14   0  -1 259.032 132.502   1
 -14   0  -2 12104.5 541.290   1
 -14   0  -3 52.0255 104.207   1
 -14   0  -4 41.5543 109.138   1
  14  -1 -10 930.031 176.629   3
  14  -1  -9 43.1104 85.6227   3
  14   1  -9-4.95350 88.2690   3
  14  -1  -8 724.988 155.471   3
  14   1  -8 744.192 166.147   3
  14   1  -7 1332.83 205.771   3
  14   1  -6 449.412 135.569   3
 -14   1   6 278.533 101.274   1
 -14  -1   5 227.968 92.1388   1
  14   1  -5 105.800 88.9178   3
 -14   1   5 16.7483 88.6645   1
  14   1  -4 5519.53 370.210   3
 -14  -1   4 5726.29 324.576   1
 -14  -1   3 50.7507 72.9744   1
  14   1  -3 16.2334 91.6642   3
 -14   1   3-26.8828 80.0371   1
 -14  -1   2 59.3431 76.8903   1
 -14   1   2-132.005 107.212   1
 -14  -1   1 889.513 156.078   1
 -14   1   1 914.403 145.864   1
 -14   1   0-177.888 129.248   1
 -14  -1   0-5.63572 85.6118   1
 -14   1  -1 85.8801 98.0225   1
 -14  -1  -1 107.085 77.3823   1
 -14   1  -2 372.548 96.7117   1
 -14  -1  -2 438.383 135.859   1
 -14   1  -3 207.705 96.7118   1
 -14  -1  -3 403.408 129.238   1
 -14   1  -4 2369.79 265.090   1
 -14  -1  -4 2576.85 268.880   1
  14   2  -8 1983.95 235.209   3
  14   2  -7 1328.26 202.398   3
 -14   2   6 8647.58 423.171   1
  14   2  -6 8215.41 460.673   3
 -14   2   5 9744.25 467.859   1
  14   2  -5 12524.6 567.360   3
 -14   2   4 13865.0 557.043   1
  14   2  -4 20278.2 705.337   3
 -14   2   3 8811.03 453.243   1
  14   2  -3 8424.83 462.184   3
 -14  -2   2 706.387 140.711   1
 -14   2   2 1053.85 170.631   1
  14   2  -2 1033.35 181.062   3
 -14   2   1 2493.23 257.036   1
  14   2  -1 2441.78 247.441   3
 -14  -2   1 2394.73 234.950   1
 -14   2   0 316.192 120.877   1
 -14  -2   0 310.829 110.287   1
 -14   2  -1 1197.51 194.502   1
 -14  -2  -1 1137.00 181.203   1
 -14  -2  -2 509.660 132.435   1
 -14   2  -2 242.269 100.487   1
 -14   2  -3 1378.83 201.440   1
 -14  -2  -3 1878.20 231.944   1
  14   3  -7 2957.14 299.926   3
 -14   3   6 7391.92 417.742   1
  14   3  -6 6891.17 428.271   3
 -14   3   5 3830.28 314.614   1
  14   3  -5 4433.07 345.115   3
 -14   3   4 2316.28 250.104   1
  14   3  -4 3561.47 304.272   3
 -14   3   3 15.2138 88.6414   1
  14   3  -3 48.5472 91.3896   3
 -14   3   2-16.7790 85.5333   1
  14   3  -2 141.002 102.542   3
 -14   3   1 99.9723 93.7166   1
  14   3  -1 144.477 88.6829   3
 -14   3   0 269.369 90.1778   1
  14   3   0 442.413 127.265   3
 -14   3  -1 252.127 94.7720   1
 -14   3  -2 111.886 112.728   1
 -14   4   6 73.0127 96.3214   1
  14   4  -6 239.320 120.029   3
 -14   4   5 1287.31 180.187   1
  14   4  -5 1398.49 204.905   3
 -14   4   4 803.765 156.814   1
  14   4  -4 805.275 166.333   3
 -14   4   3 51.8877 89.9267   1
  14   4  -3 105.380 93.4536   3
 -14   4   2 46.7591 95.0211   1
  14   4  -2 149.321 109.140   3
 -14   4   1 106.777 109.440   1
  14   4  -1 109.194 85.3507   3
 -14   4   0-33.9854 106.766   1
  14   4   0 68.8088 79.5966   3
  14   4   1 76.3726 77.1783   3
  14   5  -4 3992.75 328.320   3
  14   5  -3 598.729 157.790   3
  14   5  -2 216.798 107.942   3
  14   5  -1 21.0525 76.5383   3
  14   5   0 2888.08 265.800   3
  14   6  -2-24.0798 83.1028   3
  14   6  -1 105.583 99.3463   3
  15   0  -6-5.43720 105.815   3
 -15   0   5-10.9466 70.4298   1
 -15   0   4 6.78424 68.3843   1
 -15   0   3 1600.94 192.676   1
 -15   0   2-0.26157 80.5517   1
 -15   0   1 8522.75 449.329   1
 -15   0   0 120.230 100.114   1
 -15   0  -1 2197.66 254.198   1
  15   1  -6-21.1225 89.9129   3
 -15   1   5 2874.70 249.738   1
  15   1  -5 2362.44 244.931   3
 -15  -1   4 53.1298 88.6740   1
 -15   1   4 2.15681 78.6308   1
  15   1  -4-131.858 133.313   3
 -15   1   3 269.127 106.576   1
 -15  -1   3 340.297 112.461   1
 -15   1   2 347.293 110.505   1
 -15  -1   2 545.407 136.848   1
 -15   1   1 4519.05 335.123   1
 -15  -1   1 4677.48 332.220   1
 -15   1   0 1316.38 196.672   1
 -15  -1   0 1484.72 208.304   1
 -15   1  -1 1429.03 211.555   1
 -15  -1  -1 1465.17 208.881   1
 -15   2   5 224.272 86.3371   1
  15   2  -5 154.056 118.393   3
 -15   2   4 70.5970 91.8751   1
  15   2  -4 145.954 123.653   3
 -15   2   3 33.7945 91.1135   1
  15   2  -3 72.0372 89.5455   3
 -15   2   2-0.14694 85.4435   1
  15   2  -2-17.2963 90.9992   3
 -15  -2   1 163.019 111.376   1
 -15   2   1 88.6195 83.1531   1
 -15   2   0 384.927 123.161   1
 -15  -2   0 780.046 161.693   1
 -15  -2  -1 418.126 137.280   1
 -15   3   5 663.273 179.966   1
 -15   3   4 1640.69 235.708   1
  15   3  -4 1239.94 208.028   3
 -15   3   3 379.532 152.465   1
  15   3  -3 294.816 123.824   3
 -15   3   2 1138.35 197.248   1
  15   3  -2 1005.16 179.349   3
 -15   3   1 214.910 118.772   1
  15   3  -1 74.3142 87.3530   3
 -15   4   6 695.351 189.387   1
 -15   4   5 449.513 170.386   1
 -15   4   4 3650.59 334.760   1
 -15   4   3 580.570 176.710   1
  15   4  -3 339.311 126.127   3
  15   4  -2 3072.85 296.628   3
  15   4  -1 438.287 127.674   3
  15   4   0 172.863 105.026   3
  15   5  -1 53.8288 103.739   3
 -16   0   4 741.813 151.164   1
 -16   0   3-83.4891 78.0181   1
 -16   0   2 761.097 163.322   1
 -16   0   1 121.240 105.158   1
 -16  -1   4 560.407 135.212   1
 -16   1   4 530.810 134.412   1
 -16  -1   3 105.729 100.433   1
 -16   1   3 34.2490 93.3119   1
 -16  -1   2 411.017 120.111   1
 -16   1   2 151.011 85.1708   1
 -16  -1   1 592.220 148.210   1
 -16   2   5 120.966 94.5936   1
 -16   2   4 748.626 156.612   1
 -16   2   3 181.316 125.801   1
   0   0   0    0.00    0.00   0

TITL TSBB-829 in P2(1)/n
REM P2(1)/n (#14 in standard setting)
CELL 0.71073  12.373147   8.376302  13.094715  90.0000  99.7778  90.0000
ZERR    4.00   0.000504   0.000348   0.000634   0.0000   0.0039   0.0000
LATT  1
SYMM -x+1/2, y+1/2,-z+1/2
SFAC C H N O
UNIT 56.00 56.00 16.00 8.00
TREF
HKLF 4
END

_diffrn_radiation_probe                 x-ray
_diffrn_radiation_wavelength            0.71073
_diffrn_standards_number                0
_diffrn_standards_interval_time         .
_diffrn_standards_interval_count        .
_diffrn_standards_decay_%               ?
_diffrn_reflns_limit_h_min              -16
_diffrn_reflns_limit_h_max              15
_diffrn_reflns_limit_k_min              -3
_diffrn_reflns_limit_k_max              10
_diffrn_reflns_limit_l_min              -16
_diffrn_reflns_limit_l_max              16
_diffrn_reflns_theta_min                3.312
_diffrn_reflns_theta_max                28.927
_diffrn_reflns_av_unetI/netI            0.049467
_diffrn_reflns_number                   5480
_diffrn_reflns_number_extinctions       0
_diffrn_reflns_number_accepted          5480
_diffrn_reflns_number_rejected          0
_diffrn_ambient_temperature             298(2)
_computing_data_collection              ?
_computing_cell_refinement              ?
_computing_data_reduction               ?
_exptl_crystal_description              ?
_exptl_crystal_colour                   ?
_exptl_crystal_size_max                 0
_exptl_crystal_size_mid                 0
_exptl_crystal_size_min                 0
_exptl_crystal_density_method           'not measured'
_exptl_crystal_F000                     564
_cell_length_a                          12.3732(5)
_cell_length_b                          8.3763(4)
_cell_length_c                          13.0947(6)
_cell_angle_alpha                       90
_cell_angle_beta                        99.778(4)
_cell_angle_gamma                       90
_cell_volume                            1337.44(10)
_cell_measurement_temperature           298(2)
_cell_measurement_wavelength            0.71073
_cell_measurement_reflns_used           0
_cell_measurement_theta_max             0
_cell_measurement_theta_min             0
_exptl_absorpt_coefficient_mu           0.092
_exptl_absorpt_correction_type          ?
loop_
    _atom_type_symbol
    _atom_type_number_in_cell
C 56
H 52
N 16
O 8
_cell_formula_units_Z                   4
_chemical_formula_moiety               'C14  H13  N4  O2'
_chemical_formula_sum                  'C14  H13  N4  O2'
_chemical_compound_source               ?
_space_group_crystal_system             monoclinic
_space_group_name_H-M_alt               P21/n
_space_group_name_Hall                 '-P 2yn'
_space_group_IT_number                  14
_computing_structure_solution           ?
_computing_structure_refinement        'SHELXL (Sheldrick, 2015)'
_computing_molecular_graphics          'Ortep for Windows (Farrugia, 2012)'
_computing_publication_material        'WinGX publication routines (Farrugia, 2012)'
_atom_sites_solution_primary            ?
_atom_sites_solution_secondary          ?
_refine_ls_number_constraints           0
_refine_ls_number_restraints            0
;
_shelx_hkl_checksum              4195
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_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.98282(14) 0.0842(2) -0.21946(13) 0.0398(4) Uani 1 1 d . . . . .
H1A H 0.911017 0.043458 -0.212640 0.048 Uiso 1 1 calc R U . . .
H1B H 0.999262 0.051367 -0.286182 0.048 Uiso 1 1 calc R U . . .
C2 C 0.98473(15) 0.2626(2) -0.21090(13) 0.0421(4) Uani 1 1 d . . . . .
H2A H 1.058509 0.301328 -0.211527 0.050 Uiso 1 1 calc R U . . .
H2B H 0.936705 0.308489 -0.269863 0.050 Uiso 1 1 calc R U . . .
C3 C 0.86670(13) 0.40770(19) -0.11248(12) 0.0342(3) Uani 1 1 d . . . . .
H3 H 0.833542 0.453952 -0.174501 0.041 Uiso 1 1 calc R U . . .
C4 C 0.82406(12) 0.44591(18) -0.02157(11) 0.0304(3) Uani 1 1 d . . . . .
C5 C 0.86990(12) 0.37644(18) 0.07724(11) 0.0311(3) Uani 1 1 d . . . . .
C6 C 0.81425(13) 0.4138(2) 0.16163(12) 0.0381(4) Uani 1 1 d . . . . .
H6 H 0.840467 0.370836 0.226603 0.046 Uiso 1 1 calc R U . . .
C7 C 0.72446(13) 0.5098(2) 0.15005(12) 0.0363(4) Uani 1 1 d . . . . .
H7 H 0.690954 0.531470 0.206955 0.044 Uiso 1 1 calc R U . . .
C8 C 0.68101(12) 0.57769(19) 0.05202(12) 0.0327(3) Uani 1 1 d . . . . .
C9 C 0.73202(13) 0.54428(19) -0.03084(12) 0.0339(4) Uani 1 1 d . . . . .
H9 H 0.704325 0.588629 -0.095072 0.041 Uiso 1 1 calc R U . . .
C10 C 0.44521(12) 0.79937(19) 0.08236(12) 0.0321(3) Uani 1 1 d . . . . .
C11 C 0.39981(14) 0.8539(2) -0.01598(13) 0.0408(4) Uani 1 1 d . . . . .
H11 H 0.432176 0.829497 -0.073174 0.049 Uiso 1 1 calc R U . . .
C12 C 0.30644(14) 0.9443(2) -0.02656(14) 0.0450(4) Uani 1 1 d . . . . .
H12 H 0.274507 0.982809 -0.091290 0.054 Uiso 1 1 calc R U . . .
C13 C 0.26013(14) 0.9777(2) 0.05973(14) 0.0433(4) Uani 1 1 d . . . . .
H13 H 0.196550 1.038949 0.051206 0.052 Uiso 1 1 calc R U . . .
C14 C 0.39342(13) 0.8390(2) 0.16419(13) 0.0398(4) Uani 1 1 d . . . . .
H14 H 0.423962 0.802621 0.229870 0.048 Uiso 1 1 calc R U . . .
N1 N 0.94869(11) 0.31272(16) -0.11477(10) 0.0357(3) Uani 1 1 d . . . . .
N2 N 0.58663(11) 0.67394(17) 0.03064(10) 0.0354(3) Uani 1 1 d . . . . .
N3 N 0.54160(10) 0.70454(17) 0.10732(10) 0.0344(3) Uani 1 1 d . . . . .
N4 N 0.30182(12) 0.9267(2) 0.15470(11) 0.0469(4) Uani 1 1 d . . . . .
O1 O 1.06263(12) 0.02588(17) -0.13918(12) 0.0583(4) Uani 1 1 d . . . . .
H1 H 1.048928 -0.067368 -0.127203 0.088 Uiso 1 1 calc R U . . .
O2 O 0.95403(10) 0.28672(16) 0.08800(9) 0.0421(3) Uani 1 1 d . . . . .
H2 H 0.973207 0.274026 0.031608 0.063 Uiso 1 1 calc R U . . .
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
C1 0.0372(8) 0.0423(9) 0.0387(8) -0.0022(7) 0.0031(6) 0.0085(7)
C2 0.0495(10) 0.0411(9) 0.0395(9) 0.0051(7) 0.0183(7) 0.0080(7)
C3 0.0381(8) 0.0329(8) 0.0314(7) 0.0054(6) 0.0058(6) 0.0025(6)
C4 0.0338(8) 0.0292(7) 0.0280(7) 0.0027(6) 0.0050(6) 0.0008(6)
C5 0.0322(7) 0.0295(7) 0.0299(7) 0.0014(6) -0.0001(6) -0.0005(6)
C6 0.0418(9) 0.0446(9) 0.0265(7) 0.0056(7) 0.0014(6) 0.0025(7)
C7 0.0383(8) 0.0425(9) 0.0288(7) -0.0014(7) 0.0070(6) -0.0011(7)
C8 0.0322(8) 0.0326(8) 0.0327(8) -0.0002(6) 0.0041(6) 0.0000(6)
C9 0.0368(8) 0.0365(8) 0.0274(7) 0.0045(6) 0.0022(6) 0.0046(6)
C10 0.0297(7) 0.0315(8) 0.0343(8) -0.0032(6) 0.0033(6) -0.0032(6)
C11 0.0388(8) 0.0503(10) 0.0341(8) 0.0008(7) 0.0083(6) 0.0014(7)
C12 0.0407(9) 0.0551(11) 0.0369(9) 0.0054(8) 0.0001(7) 0.0030(8)
C13 0.0353(8) 0.0463(10) 0.0455(9) -0.0062(8) -0.0009(7) 0.0060(7)
C14 0.0399(9) 0.0478(10) 0.0303(8) -0.0056(7) 0.0021(6) 0.0053(7)
N1 0.0398(7) 0.0319(7) 0.0369(7) 0.0015(6) 0.0110(5) 0.0039(6)
N2 0.0349(7) 0.0374(7) 0.0341(7) -0.0007(6) 0.0065(5) 0.0019(6)
N3 0.0342(7) 0.0372(7) 0.0322(7) -0.0017(6) 0.0064(5) 0.0013(6)
N4 0.0419(8) 0.0589(10) 0.0387(8) -0.0135(7) 0.0028(6) 0.0103(7)
O1 0.0584(8) 0.0434(7) 0.0643(9) 0.0046(7) -0.0148(7) 0.0098(6)
O2 0.0428(7) 0.0478(7) 0.0343(6) 0.0059(5) 0.0024(5) 0.0123(5)
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O1 C1 C2 106.94(15) . .
O1 C1 H1A 110.3 . .
C2 C1 H1A 110.3 . .
O1 C1 H1B 110.3 . .
C2 C1 H1B 110.3 . .
H1A C1 H1B 108.6 . .
N1 C2 C1 110.26(14) . .
N1 C2 H2A 109.6 . .
C1 C2 H2A 109.6 . .
N1 C2 H2B 109.6 . .
C1 C2 H2B 109.6 . .
H2A C2 H2B 108.1 . .
N1 C3 C4 124.28(14) . .
N1 C3 H3 117.9 . .
C4 C3 H3 117.9 . .
C9 C4 C3 118.36(13) . .
C9 C4 C5 120.47(13) . .
C3 C4 C5 121.04(14) . .
O2 C5 C6 122.35(14) . .
O2 C5 C4 121.79(14) . .
C6 C5 C4 115.85(13) . .
C7 C6 C5 122.29(14) . .
C7 C6 H6 118.9 . .
C5 C6 H6 118.9 . .
C6 C7 C8 120.89(14) . .
C6 C7 H7 119.6 . .
C8 C7 H7 119.6 . .
C9 C8 N2 115.88(13) . .
C9 C8 C7 118.51(14) . .
N2 C8 C7 125.57(14) . .
C8 C9 C4 121.99(14) . .
C8 C9 H9 119.0 . .
C4 C9 H9 119.0 . .
C14 C10 C11 118.18(15) . .
C14 C10 N3 115.94(14) . .
C11 C10 N3 125.88(14) . .
C12 C11 C10 118.45(16) . .
C12 C11 H11 120.8 . .
C10 C11 H11 120.8 . .
C11 C12 C13 119.35(16) . .
C11 C12 H12 120.3 . .
C13 C12 H12 120.3 . .
N4 C13 C12 123.39(16) . .
N4 C13 H13 118.3 . .
C12 C13 H13 118.3 . .
N4 C14 C10 123.89(15) . .
N4 C14 H14 118.1 . .
C10 C14 H14 118.1 . .
C3 N1 C2 123.36(14) . .
N3 N2 C8 115.08(13) . .
N2 N3 C10 113.49(13) . .
C13 N4 C14 116.73(15) . .
C1 O1 H1 109.5 . .
C5 O2 H2 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.402(2) .
C1 C2 1.498(3) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
C2 N1 1.466(2) .
C2 H2A 0.9700 .
C2 H2B 0.9700 .
C3 N1 1.294(2) .
C3 C4 1.418(2) .
C3 H3 0.9300 .
C4 C9 1.394(2) .
C4 C5 1.444(2) .
C5 O2 1.2721(18) .
C5 C6 1.432(2) .
C6 C7 1.359(2) .
C6 H6 0.9300 .
C7 C8 1.423(2) .
C7 H7 0.9300 .
C8 C9 1.373(2) .
C8 N2 1.408(2) .
C9 H9 0.9300 .
C10 C14 1.379(2) .
C10 C11 1.392(2) .
C10 N3 1.424(2) .
C11 C12 1.368(2) .
C11 H11 0.9300 .
C12 C13 1.380(3) .
C12 H12 0.9300 .
C13 N4 1.333(2) .
C13 H13 0.9300 .
C14 N4 1.339(2) .
C14 H14 0.9300 .
N2 N3 1.2547(18) .
O1 H1 0.8200 .
O2 H2 0.8200 .
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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
O1 C1 C2 N1 -65.89(18) . . . .
N1 C3 C4 C9 -177.05(15) . . . .
N1 C3 C4 C5 -1.2(2) . . . .
C9 C4 C5 O2 -179.75(15) . . . .
C3 C4 C5 O2 4.4(2) . . . .
C9 C4 C5 C6 0.8(2) . . . .
C3 C4 C5 C6 -175.03(14) . . . .
O2 C5 C6 C7 179.92(16) . . . .
C4 C5 C6 C7 -0.6(2) . . . .
C5 C6 C7 C8 0.3(3) . . . .
C6 C7 C8 C9 -0.1(2) . . . .
C6 C7 C8 N2 177.72(16) . . . .
N2 C8 C9 C4 -177.74(14) . . . .
C7 C8 C9 C4 0.3(2) . . . .
C3 C4 C9 C8 175.26(14) . . . .
C5 C4 C9 C8 -0.7(2) . . . .
C14 C10 C11 C12 0.2(3) . . . .
N3 C10 C11 C12 -179.98(16) . . . .
C10 C11 C12 C13 -0.3(3) . . . .
C11 C12 C13 N4 0.2(3) . . . .
C11 C10 C14 N4 0.1(3) . . . .
N3 C10 C14 N4 -179.74(16) . . . .
C4 C3 N1 C2 173.86(15) . . . .
C1 C2 N1 C3 -122.60(17) . . . .
C9 C8 N2 N3 -179.38(14) . . . .
C7 C8 N2 N3 2.7(2) . . . .
C8 N2 N3 C10 -178.79(13) . . . .
C14 C10 N3 N2 -178.89(14) . . . .
C11 C10 N3 N2 1.3(2) . . . .
C12 C13 N4 C14 0.1(3) . . . .
C10 C14 N4 C13 -0.3(3) . . . .
