#------------------------------------------------------------------------------
#$Date: 2025-08-23 00:12:46 +0300 (Sat, 23 Aug 2025) $
#$Revision: 301866 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/70/7237020.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_7237020
loop_
_publ_author_name
'Hang, Hao'
'Fei, Bin'
'Chen, Xiu Qin'
'Tong, Ming Liang'
'Ksenofontov, Vadim'
'Gural'skiy, Il’ya A.'
'Bao, Xin'
_publ_section_title
;
 Multiple spin phases in a switchable Fe(ii) complex: polymorphism and
 symmetry breaking effects
;
_journal_issue                   13
_journal_name_full               'Journal of Materials Chemistry C'
_journal_page_first              3352
_journal_paper_doi               10.1039/C7TC05111E
_journal_volume                  6
_journal_year                    2018
_chemical_formula_sum            'C18 H16 Br2 Fe N10'
_chemical_formula_weight         588.08
_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_Hall           '-P 2yac'
_space_group_name_H-M_alt        'P 1 2/n 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2017-10-30 deposited with the CCDC.
2018-02-21 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 97.229(3)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.3304(5)
_cell_length_b                   7.7934(5)
_cell_length_c                   18.5912(14)
_cell_measurement_reflns_used    2908
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      25.4646
_cell_measurement_theta_min      2.8788
_cell_volume                     1053.65(13)
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'PHOTON100 CMOS detector'
_diffrn_measurement_method       'omega scan'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71076
_diffrn_reflns_av_R_equivalents  0.0696
_diffrn_reflns_av_unetI/netI     0.0590
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            7090
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        25.243
_diffrn_reflns_theta_max         25.327
_diffrn_reflns_theta_min         2.838
_exptl_absorpt_coefficient_mu    4.537
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5433
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2014)'
_exptl_crystal_density_diffrn    1.854
_exptl_crystal_description       prism
_exptl_crystal_F_000             580
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.482
_refine_diff_density_min         -0.518
_refine_diff_density_rms         0.124
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.074
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     141
_refine_ls_number_reflns         1924
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.074
_refine_ls_R_factor_all          0.0638
_refine_ls_R_factor_gt           0.0401
_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/[σ²(Fo²)+(0.0036P)²+2.2833P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0592
_refine_ls_wR_factor_ref         0.0653
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1524
_reflns_number_total             1924
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7tc05111e2.cif
_cod_data_source_block           gamma-123K
_cod_original_sg_symbol_H-M      'P 2/n'
_cod_database_code               7237020
_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.
;
_shelxl_version_number           2014-3
_shelx_res_file
;
TITL
CELL 0.71076 7.3304 7.7934 18.5912 90 97.2289 90
ZERR 2 0.0005 0.0005 0.0014 0 0.0027 0
LATT 1
SYMM 0.5-X,+Y,0.5-Z
SFAC C H Br Fe N
UNIT 36 32 4 2 20

L.S. 4
PLAN  20
TEMP -150.15
fmap 2
acta
REM <olex2.extras>
REM <HklSrc "%.\\d161014c_0m.hkl">
REM </olex2.extras>

WGHT    0.003600    2.283300
FVAR       0.42441
BR1   3    0.312901    0.641850    0.515247    11.00000    0.01527    0.02506 =
         0.01863    0.00080   -0.00369    0.00278
FE1   4   -0.250000    0.706640    0.250000    10.50000    0.01229    0.00993 =
         0.01191    0.00000   -0.00039    0.00000
N4    5   -0.658006    0.384537    0.348210    11.00000    0.02275    0.01821 =
         0.01974   -0.00355    0.00922   -0.00198
N2    5   -0.403411    0.925119    0.290521    11.00000    0.00890    0.01624 =
         0.01335    0.00042    0.00001   -0.00107
AFIX  13
H2    2   -0.524664    0.939610    0.259872    11.00000   -1.20000
AFIX   0
C4    1   -0.211068    0.841405    0.480137    11.00000    0.01275    0.01742 =
         0.01674   -0.00221    0.00865   -0.00065
AFIX  43
H4    2   -0.295307    0.896439    0.507472    11.00000   -1.20000
AFIX   0
N3    5   -0.458969    0.537450    0.273093    11.00000    0.02047    0.01319 =
         0.02464    0.00092   -0.00030   -0.00245
N1    5   -0.142225    0.733621    0.366286    11.00000    0.01185    0.01270 =
         0.01305    0.00018    0.00137    0.00108
C6    1   -0.431378    0.886416    0.365541    11.00000    0.01401    0.01704 =
         0.01871   -0.00066    0.00272    0.00570
AFIX  23
H6A   2   -0.530774    0.800556    0.365957    11.00000   -1.20000
H6B   2   -0.468657    0.991878    0.389548    11.00000   -1.20000
AFIX   0
C8    1   -0.554557    0.457134    0.305162    11.00000    0.01534    0.01364 =
         0.01376   -0.00307   -0.00689    0.00218
C1    1    0.021604    0.679594    0.399026    11.00000    0.01506    0.00868 =
         0.01981   -0.00002    0.00302    0.00161
AFIX  43
H1    2    0.103012    0.622129    0.371178    11.00000   -1.20000
AFIX   0
C9    1   -0.739516    0.235340    0.334733    11.00000    0.00889    0.02421 =
         0.00677    0.00226    0.00306    0.00941
N5    5   -0.816655    0.105809    0.329776    11.00000    0.02022    0.02598 =
         0.01850   -0.00157    0.00406   -0.00565
C5    1   -0.255758    0.817315    0.406146    11.00000    0.01173    0.01061 =
         0.01557    0.00073    0.00089    0.00069
C3    1   -0.042563    0.784610    0.513954    11.00000    0.01779    0.01839 =
         0.01110    0.00166   -0.00097   -0.00368
AFIX  43
H3    2   -0.008871    0.799857    0.564580    11.00000   -1.20000
AFIX   0
C2    1    0.074402    0.705493    0.471981    11.00000    0.01218    0.01763 =
         0.01285    0.00526   -0.00100   -0.00103
C7    1   -0.288459    1.079508    0.285455    11.00000    0.02017    0.01111 =
         0.02063   -0.00449   -0.00049    0.00008
AFIX  23
H7A   2   -0.186760    1.080341    0.325900    11.00000   -1.20000
H7B   2   -0.363569    1.183911    0.289283    11.00000   -1.20000
AFIX   0
HKLF 4

REM
REM R1 =  0.0401 for    1524 Fo > 4sig(Fo)  and  0.0638 for all    1924 data
REM    141 parameters refined using      0 restraints

END

WGHT      0.0036      2.2830

REM Highest difference peak  0.482,  deepest hole -0.518,  1-sigma level  0.124
Q1    1   0.3822  0.7819  0.5077  11.00000  0.05    0.48
Q2    1  -0.8159  0.2117  0.3103  11.00000  0.05    0.47
Q3    1  -0.1357  0.9884  0.5662  11.00000  0.05    0.43
Q4    1   0.2757  0.6352  0.4521  11.00000  0.05    0.42
Q5    1  -0.7774  0.2710  0.4166  11.00000  0.05    0.40
Q6    1  -0.5657  0.5930  0.3694  11.00000  0.05    0.40
Q7    1  -0.2085  0.4563  0.3797  11.00000  0.05    0.40
Q8    1  -0.1765  0.6242  0.3390  11.00000  0.05    0.40
Q9    1   0.3012  0.4413  0.5418  11.00000  0.05    0.39
Q10   1  -0.5308  0.9120  0.3825  11.00000  0.05    0.38
Q11   1  -0.5403  0.7453  0.3587  11.00000  0.05    0.38
Q12   1  -0.4605  0.5640  0.3007  11.00000  0.05    0.38
Q13   1   0.1625  0.6573  0.3268  11.00000  0.05    0.38
Q14   1  -0.2790  0.5825  0.3680  11.00000  0.05    0.38
Q15   1  -0.2464  0.7177  0.3679  11.00000  0.05    0.38
Q16   1  -0.6122  0.7146  0.4078  11.00000  0.05    0.38
Q17   1  -0.6365  0.8520  0.3453  11.00000  0.05    0.37
Q18   1  -0.3714  0.9170  0.5334  11.00000  0.05    0.37
Q19   1  -0.4975  1.1265  0.4033  11.00000  0.05    0.37
Q20   1  -0.0350  0.6945  0.4974  11.00000  0.05    0.37
;
_shelx_res_checksum              31216
_shelx_hkl_file
;
   2   0   0 2681.42 60.3388   1
  -2   0   0 2721.21 60.2043   1
   3   0   0  -2.466 6.68231   1
  -3   0   0 -4.3199 6.53166   1
   4   0   0 514.396 31.2198   1
  -4   0   0 458.635 29.6142   1
   5   0   0 -1.5735 12.2334   1
  -5   0   0 -1.3362 11.8185   1
   6   0   0 46.1422 17.8529   1
  -6   0   0 35.3681 17.5398   1
  -7   0   0 14.2215 21.4513   1
   7   0   0 -22.952 20.7422   1
  -8   0   0 273.271 48.2799   1
   1  -1   0 535.083 14.8601   1
  -1  -1   0 536.435 19.7001   1
   1   1   0 537.995 19.6795   1
  -1   1   0 534.542 14.5879   1
   1   1   0 524.705 9.62421   1
  -2  -1   0 25.0085 8.56276   1
   2  -1   0 19.7174 6.17825   1
  -2   1   0 15.6126 5.63003   1
   2   1   0 25.0665  8.0576   1
  -3  -1   0 74.8738 14.8558   1
   3  -1   0  63.071 12.6571   1
  -3   1   0  73.866 12.8293   1
   3   1   0 82.8096 14.5701   1
  -4  -1   0  5.7157 10.2976   1
   4  -1   0 9.80732 9.05358   1
  -4   1   0 22.5933  9.6666   1
   4   1   0 4.26271 10.0129   1
   5  -1   0 511.447 34.8297   1
  -5  -1   0 539.058 37.7808   1
  -5   1   0 539.823 34.7418   1
   5   1   0 556.633  37.659   1
  -6  -1   0  200.32 32.4352   1
   6  -1   0 175.517 42.1986   1
   6   1   0 223.645 34.8638   1
   7  -1   0 732.367 53.7056   1
  -7  -1   0 693.491 52.0976   1
   7   1   0 726.444 86.6641   1
  -7   1   0 685.588 49.3276   1
  -8  -1   0 148.015  35.164   1
   8  -1   0 144.763 34.7813   1
  -8   1   0 106.526 29.5054   1
   8   1   0 252.934 49.5186   1
   0  -2   0 1674.86 37.0235   1
   0   2   0 1682.12 37.8594   1
   1  -2   0 2508.58 45.0178   1
  -1  -2   0 2485.62 57.1976   1
   1  -2   0 2577.10 45.7152   1
   1   2   0 2503.14 57.1047   1
  -2  -2   0 938.167 36.6918   1
   2  -2   0 941.122 27.1181   1
   2   2   0 937.871 17.0563   1
   2   2   0 934.165 35.8858   1
  -2   2   0 909.679 26.2512   1
  -3  -2   0 12.8565 2.02361   1
  -3  -2   0 8.97678 9.40012   1
   3  -2   0 19.9035  7.2641   1
   3   2   0 7.70836 8.56466   1
  -3   2   0 14.7574 6.69166   1
  -4  -2   0 213.192 7.17576   1
   4  -2   0  210.05 20.4005   1
  -4  -2   0 218.766 25.7654   1
   4   2   0 199.155 23.8036   1
  -4   2   0 220.066 19.0874   1
   5  -2   0 77.5328  17.024   1
  -5  -2   0 76.7061 19.3764   1
  -5  -2   0 59.2994 5.03984   1
   5   2   0 72.5656  18.522   1
  -5   2   0 85.7907 16.4826   1
  -6  -2   0 14.0575 19.6624   1
  -6  -2   0 22.7191 3.70084   1
   6  -2   0 16.7166 16.1548   1
   6   2   0 41.2481 20.3354   1
  -6   2   0 44.6829 17.7373   1
   7  -2   0 561.275 47.2966   1
  -7  -2   0 503.132 51.1713   1
  -7  -2   0 481.368 15.2841   1
   7   2   0  602.85 51.4234   1
  -7   2   0 507.942 42.7056   1
   8  -2   0 108.963 32.1501   1
  -8  -2   0 60.1657  8.6111   1
  -8  -2   0 42.4533 35.2873   1
  -8   2   0 58.5888 26.9551   1
   8   2   0   67.98 36.4346   1
   0  -3   0 1320.69 34.9449   1
   0   3   0 1317.75 36.2634   1
   1  -3   0 683.773 19.8433   1
  -1  -3   0 666.012 28.4623   1
   1   3   0 681.397 28.6021   1
   2  -3   0 886.567 25.5119   1
  -2  -3   0 874.291 38.5385   1
   2   3   0 891.111  19.073   1
   2   3   0 881.774 37.2343   1
  -3  -3   0 1272.98 51.8117   1
   3  -3   0 1164.51 37.0686   1
  -3   3   0 1251.67 36.5597   1
   3   3   0 1308.94 50.8611   1
   4  -3   0 6.75974 8.50387   1
  -4  -3   0 17.8731 13.1079   1
   4   3   0 8.62657 12.2092   1
  -4   3   0 -0.9984 7.30974   1
   5  -3   0 17.1374 12.7479   1
  -5  -3   0 26.7167 17.9742   1
  -5   3   0 -1.8336 9.77474   1
   5   3   0 18.5391  16.654   1
  -6  -3   0 214.027 34.8069   1
   6  -3   0 234.573 31.7656   1
  -6   3   0 170.127 25.4458   1
   6   3   0 217.404 35.8096   1
   7  -3   0 -24.784 22.1604   1
  -7  -3   0 37.2337 29.0781   1
   7   3   0 3.67988 25.6623   1
  -7   3   0 11.3219 19.0737   1
   8  -3   0 127.132 31.8283   1
  -8  -3   0 76.0984 39.0792   1
  -8   3   0 51.7591  27.043   1
   8   3   0 28.0073 37.0335   1
   0  -4   0 961.301 31.4927   1
   0   4   0 975.649 32.8393   1
  -1  -4   0 176.558 17.5974   1
   1  -4   0 193.992 12.5988   1
   1   4   0 163.644 17.8759   1
   2  -4   0 628.598 20.7348   1
  -2  -4   0 633.064 34.4522   1
   2  -4   0 643.848   20.61   1
   2   4   0 648.721 34.3811   1
   3  -4   0  12.589 6.88869   1
  -3  -4   0 15.7001 12.9172   1
   3   4   0 14.2007 3.51707   1
   3   4   0 -2.1211 9.75964   1
  -4  -4   0 87.2322 19.6004   1
   4  -4   0 57.6398 11.5186   1
   4   4   0 45.2643 16.8562   1
   5  -4   0 15.7552 12.5846   1
  -5  -4   0 -15.725 19.7862   1
   5   4   0 -32.109 18.3524   1
  -5   4   0 -5.0934 9.84604   1
  -6  -4   0 454.429 46.8372   1
   6  -4   0 467.191 36.2125   1
  -6   4   0 400.238 32.4084   1
   6   4   0 417.521 52.2323   1
  -7  -4   0 411.667 55.5933   1
   7  -4   0 338.367 41.2321   1
   7   4   0  352.18 49.8763   1
  -7   4   0 383.379 37.1877   1
   0  -5   0 238.331 18.2541   1
   0   5   0 235.758 17.6612   1
  -1  -5   0 959.538 39.4707   1
   1  -5   0 955.192 28.9299   1
   1   5   0 964.658 40.5062   1
  -2  -5   0 -14.197 11.1985   1
   2  -5   0  10.822  5.9406   1
   2   5   0 -15.941 10.0418   1
   3  -5   0 3.99537 6.50593   1
   3  -5   0 -6.3469 6.15413   1
  -3  -5   0   16.53   13.77   1
   3   5   0 0.99297 13.3484   1
   3   5   0 -2.6789 4.21638   1
  -4  -5   0 27.6524 23.1064   1
   4  -5   0 30.6475 9.20028   1
   4  -5   0 33.9924 9.61731   1
   4   5   0 -5.3631  17.442   1
  -5  -5   0 -31.013 22.2996   1
   5  -5   0 -0.2513 12.1543   1
   5   5   0 15.2477 21.6911   1
  -6  -5   0 111.996  29.318   1
   6  -5   0  125.05  20.767   1
   6   5   0 130.828 31.4185   1
   7  -5   0 251.044 39.1657   1
   0  -6   0 80.8076 14.9022   1
   0   6   0 81.7322 14.9198   1
  -1  -6   0 928.333 41.2293   1
   1  -6   0 954.759 29.5323   1
   1   6   0 961.333 41.9079   1
  -2  -6   0 69.1489 17.4395   1
   2  -6   0 66.0807 7.62075   1
   2  -6   0 62.3338  9.0942   1
   2   6   0 46.5316 15.9409   1
   3  -6   0 214.921 11.9975   1
  -3  -6   0 270.591 32.5235   1
   3  -6   0 231.068 14.0511   1
   3   6   0 157.595 28.8888   1
   3   6   0 243.716 13.4426   1
  -4  -6   0 17.1725 21.8487   1
   4  -6   0 23.3371 9.23715   1
   4   6   0 31.5199 20.1228   1
   5  -6   0 5.33905 12.4181   1
   5  -6   0 17.9479 11.4173   1
   6  -6   0 48.3978 17.9631   1
  -6  -6   0 130.949 35.6057   1
   6  -6   0 81.1505 16.8853   1
   6   6   0 85.8082 32.6071   1
   0  -7   0 279.073  23.843   1
   0   7   0 292.728 22.0975   1
   1  -7   0 3.89878 7.65769   1
  -1  -7   0 -8.3552 12.9351   1
   1   7   0 -2.3241 12.5275   1
  -2  -7   0 75.5978 19.0679   1
   2   7   0 81.4536 18.0747   1
  -3  -7   0 49.6095 26.5313   1
   3   7   0 54.8743 9.87589   1
   3   7   0 77.2465 21.5371   1
  -4  -7   0 8.39049 26.3428   1
   4   7   0 25.1481 7.53032   1
   4   7   0 10.8486 24.6198   1
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   3  -1   2 9.23507 7.91175   1
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   5  -1   2 42.1648 15.1489   1
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   6  -1   2 243.266 39.6402   1
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   7  -1   2 26.0003  24.364   1
   7   1   2 36.4688 25.8828   1
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   8  -1   2 136.225  37.494   1
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   7  -2  -2 363.292 39.9716   1
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   4   3  -2 139.699 20.9877   1
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   2  -3   2 11.2494 4.05831   1
   2   3   2 19.4112 10.1417   1
   2   3   2 2.45416   3.217   1
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   5  -3   2 194.979  24.916   1
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   6  -3   2 777.459 47.4221   1
   6   3   2 645.511 52.4877   1
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   7  -3   2 246.188 42.3335   1
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   7   3   2 264.959 41.2773   1
   8  -3   2  626.14 59.0798   1
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   7  -4  -2 23.5629 22.7915   1
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   5   4  -2 68.5881 20.1532   1
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   3  -4  -2 68.4371 13.2517   1
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   2   4   2 292.977 26.2334   1
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   3  -4   2 179.474 13.2596   1
   3   4   2 178.765 23.2876   1
   3   4   2 173.454 9.91091   1
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   4   4   2 29.7955 17.3573   1
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   6   4   2 128.021 30.0575   1
   7  -4   2 36.0853 25.1179   1
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   4  -5  -2 247.744  20.901   1
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   4  -5  -2 248.338  21.712   1
   3  -5  -2 162.071 16.3306   1
   3  -5  -2 153.215 16.8977   1
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   3   5  -2 152.205 23.6575   1
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   2  -5  -2 118.469 14.1352   1
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   2   5   2  631.32 39.7873   1
   2   5   2 614.542 21.8153   1
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   3   5   2 95.9182 9.92757   1
   3   5   2  84.521 18.6398   1
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   4  -5   2 125.987 14.5781   1
   4   5   2 92.8429 24.3365   1
   5  -5   2 402.352 27.8787   1
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   5   5   2 353.548 46.9863   1
   6  -5   2 56.4143 18.4075   1
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   6   5   2 88.3656 28.6618   1
   7  -5   2  360.76 42.2174   1
   7   5   2 383.947 54.7637   1
  -7   5  -2 318.022 37.2935   1
   6  -6  -2 73.0433 18.7362   1
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   6  -6  -2 38.2837 18.4776   1
   6   6  -2 -6.7543 30.2215   1
   5  -6  -2 246.503 25.7926   1
  -5  -6   2 361.665 49.3237   1
   5  -6  -2 251.593  26.124   1
   5   6  -2  207.96 34.1387   1
   4  -6  -2 27.8708 11.2378   1
   4  -6  -2 12.6151  10.189   1
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   3  -6  -2 158.169 16.0158   1
   3  -6  -2 102.275 17.7102   1
   3   6  -2 137.421  25.694   1
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   2  -6  -2 316.096  20.128   1
   2  -6  -2 340.968 23.6119   1
   2   6  -2 329.952   27.70   1
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   1  -6  -2 41.8892  10.955   1
   1   6  -2 27.8442   10.44   1
   0  -6   2 724.956 25.7595   1
   0  -6  -2  687.22 35.1666   1
   0   6  -2 728.041 26.0321   1
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   1   6   2 38.5144 13.0116   1
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   2   6   2  120.08  20.916   1
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   3   6   2 -5.8496 6.28882   1
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   4   6   2 28.3313 22.6832   1
   5  -6   2 626.265 25.3219   1
   5  -6   2 504.488 24.5635   1
  -5  -6  -2 577.377 54.8828   1
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   3   5 -18 122.908 33.8354   1
   3   5 -18 144.818 20.8541   1
   2  -5 -18  169.50 41.5117   1
   2   5 -18 108.614  29.374   1
   1  -5 -18 -7.1642 39.2822   1
  -1   5  18 19.3331 17.4054   1
   1   5 -18 -11.533 13.6614   1
   1   5 -18  13.888 20.6726   1
   1   5 -18 -28.641 26.6653   1
   0  -5 -18 46.7895 45.3203   1
   0   5 -18 19.2885 19.9699   1
   0   5  18 83.0516 40.6264   1
   0   5  18 51.6292 20.0497   1
   0   5 -18  51.462 13.7479   1
  -1   5 -18 70.5199 28.6341   1
   5   0 -19 101.671 31.4758   1
   5   0 -19 44.8283 34.8117   1
   4   0 -19 50.5017 30.6861   1
   4   0 -19 41.2392  25.611   1
   3   0 -19 99.7719 25.7966   1
   3   0 -19  58.442 29.7788   1
   2   0 -19 -34.256 26.1606   1
   2   0 -19 -7.9773 10.6755   1
   2   0 -19 -5.5979 21.6483   1
   1   0 -19 38.4597 29.6482   1
   1   0 -19 60.2359 11.1732   1
   0   0 -19 46.5381 31.7076   1
  -1   0 -19 111.319 40.3326   1
  -1   0 -19 103.017 17.3598   1
  -2   0 -19 12.6783 12.2704   1
   2   0  19 38.3048 25.7261   1
  -2   0 -19 20.4172  39.154   1
  -3   0 -19 12.9468  43.208   1
  -3   0 -19 -15.763 13.4838   1
   3   0  19 -7.6106 32.5906   1
   5  -1 -19 -27.301 34.7247   1
   5   1 -19 9.15142 32.7072   1
  -5   1  19 35.6222 14.5348   1
   5   1 -19 29.1552 30.8833   1
   4  -1 -19  354.86 56.5721   1
   4   1 -19 309.108 51.0366   1
  -4   1  19 313.546 24.7867   1
   4   1 -19 265.889 40.4773   1
   3  -1 -19 10.5389 25.2857   1
   3   1 -19 -7.5164 25.5945   1
   3   1 -19 25.5837 21.9942   1
   2  -1 -19 522.395 54.6955   1
   2   1 -19 479.819 41.0226   1
   2   1 -19 530.096 32.1429   1
   2   1 -19 508.965 51.3471   1
   1  -1 -19 250.622 42.8151   1
   1  -1 -19  211.71 21.8516   1
   1   1 -19 273.149 44.3149   1
   1   1 -19 244.195 21.8666   1
   0  -1 -19 816.201 72.0656   1
   0  -1 -19 808.042 34.7056   1
   0   1 -19 846.662  35.738   1
   0   1 -19 790.283 67.8824   1
  -1  -1 -19 84.9619 14.2957   1
  -1  -1 -19 190.616 46.2812   1
   1   1  19 34.1352  26.031   1
  -1   1 -19  95.088 35.2742   1
  -1   1 -19 96.0649 14.8974   1
  -2  -1 -19 204.824 21.2701   1
   2  -1  19 181.466 32.0732   1
  -2   1 -19 221.362 21.3723   1
  -2   1 -19  261.83 50.4909   1
   3  -1  19 -42.683 26.6856   1
  -3  -1 -19 10.4666  15.405   1
  -3  -1 -19 13.7412 46.1512   1
  -3   1 -19  -31.21 41.2579   1
  -3   1 -19 -0.9536 15.3435   1
   3   1  19 52.2884 37.2385   1
  -5   2  19 97.6921 20.5369   1
   5   2 -19 80.6701 32.2661   1
   5   2 -19 107.157 35.1589   1
   4  -2 -19 69.3521 36.5085   1
   4  -2 -19 16.8716 30.8514   1
   4   2 -19 114.772 28.1709   1
   4   2 -19 63.1985 31.8845   1
  -4   2  19 91.4712 17.0156   1
   3  -2 -19 81.8969 27.3364   1
   3  -2 -19  58.058 30.3889   1
   3   2 -19 30.8103 12.1658   1
  -3   2  19 31.0105 14.3846   1
   3   2 -19 45.5341  29.105   1
   3   2 -19 46.9605 21.9622   1
   2  -2 -19 264.312 48.3924   1
   2   2 -19  308.99  39.488   1
  -2   2  19 310.006 25.2167   1
   2   2 -19 304.939 46.4486   1
   2   2 -19 298.021 34.2224   1
   1  -2 -19 47.5689 31.7671   1
   1   2 -19 70.9404 13.2409   1
   1   2 -19  27.144 29.6851   1
   1   2 -19 80.4402 20.1435   1
   0  -2 -19 254.319 21.8255   1
   0  -2 -19 247.318 46.4554   1
   0   2 -19 220.933 22.3703   1
   0   2  19 314.537 52.3131   1
   0   2 -19  260.19 51.9352   1
  -1  -2 -19 41.3202  12.041   1
  -1  -2 -19 29.1425  40.338   1
   1   2  19  -15.09 28.8014   1
  -1   2 -19 61.2589 37.0055   1
  -1   2 -19  13.914 12.8321   1
  -2  -2 -19 164.338 48.0786   1
  -2  -2 -19  94.223 13.9422   1
  -2   2 -19 117.001 16.2145   1
  -2   2 -19 188.864 43.7977   1
   2   2  19 139.772   37.38   1
  -3  -2 -19  19.488 15.7304   1
   3  -2  19 -5.0394 26.0211   1
  -3  -2 -19 7.06421 46.4509   1
  -3   2 -19 44.4352 36.7382   1
   3   2  19 89.2303 40.1827   1
   4  -3 -19 27.6056 36.1133   1
   4  -3 -19 117.902  37.012   1
   4   3 -19  76.714  33.319   1
   4   3 -19 66.4141 26.9943   1
  -4   3  19 24.8592 17.1995   1
   3  -3 -19 6.05799 33.4245   1
   3   3 -19 -6.1373 12.0542   1
   3   3 -19 -0.5041 29.3581   1
  -3   3  19 3.24485 14.5751   1
   3   3 -19 45.4491 23.8835   1
   2  -3 -19 -61.289 33.3526   1
   2   3 -19 28.0518 14.0472   1
   2   3 -19 20.2688 28.6353   1
  -2   3  19  12.953  15.122   1
   1  -3 -19 115.305 36.9345   1
   1   3 -19 75.0389 13.6898   1
   1   3 -19 64.4303  31.088   1
   1   3 -19 111.816 24.6484   1
  -1   3  19 95.1546 19.6081   1
   0  -3 -19 57.3654 38.3449   1
   0   3 -19 5.39317 21.6512   1
   0   3  19 -23.986   32.42   1
   0   3 -19 23.5202 31.3814   1
   0   3 -19 -24.888 12.1315   1
  -1  -3 -19 157.259 45.6347   1
  -1   3 -19 145.757 34.8143   1
   1   3  19 138.868 36.2971   1
  -1   3 -19 135.356 19.2455   1
  -2  -3 -19 117.996   47.60   1
  -2  -3 -19 -11.268 15.2568   1
  -2   3 -19  17.134 31.9201   1
   2   3  19 46.9763  38.494   1
   3  -4 -19 83.4807 39.1269   1
   3  -4 -19 218.674 45.2021   1
   3   4 -19 150.403 30.0668   1
   3   4 -19 203.049 21.6505   1
  -3   4  19  166.55 26.9836   1
   2  -4 -19 81.7927 39.8217   1
   2   4 -19 97.7698 15.3642   1
  -2   4  19 104.214  19.522   1
   2   4 -19 78.4087 25.8473   1
   2   4 -19  95.116 30.2161   1
   1  -4 -19  413.62  62.704   1
   1   4 -19  439.69 27.7072   1
  -1   4  19 477.829 32.4128   1
   1   4 -19 444.254   41.83   1
   1   4 -19 402.275 54.5074   1
   0  -4 -19 189.869 52.6903   1
   0   4  19 174.581 40.6546   1
   0   4 -19 182.765 36.8507   1
   0   4 -19 216.018 25.6996   1
   0   4 -19  176.51 36.1564   1
  -1   4 -19 184.844 23.3002   1
  -1   4 -19 235.229 40.5338   1
   4   0 -20 237.863 45.3604   1
   3   0 -20 -10.814 32.9255   1
   3   0 -20 -43.883 27.2751   1
   2   0 -20 271.019 45.4888   1
   2   0 -20 294.649 24.4063   1
   2   0 -20 255.508 48.8227   1
   1   0 -20 -4.1922  11.283   1
   1   0 -20 -46.226 31.5629   1
   0   0 -20 -2.5003 12.1917   1
   0   0 -20 4.79084 33.9095   1
  -1   0 -20 35.1491  14.018   1
  -1   0 -20 77.4686 42.1829   1
   1   0  20  41.086 27.2629   1
   2   0  20 174.323 35.5813   1
  -2   0 -20 243.435 25.4086   1
  -2   0 -20 327.264 59.4474   1
   4  -1 -20  13.317 37.1543   1
   4   1 -20 44.0596 33.4213   1
   4   1 -20 82.2273 27.4886   1
   3  -1 -20 67.5615 29.1371   1
   3  -1 -20 49.7441 30.5386   1
   3   1 -20 71.9578 26.4961   1
   3   1 -20 66.3803  32.168   1
   2  -1 -20 5.07699 33.0826   1
   2   1 -20 50.5262 25.4771   1
   2   1 -20 35.3711 29.5003   1
   1  -1 -20  89.651 15.1485   1
   1  -1 -20  121.41 36.5242   1
   1   1 -20 78.4444 13.6099   1
   1   1 -20 32.1941 32.2024   1
   0  -1 -20 4.54434 39.9492   1
   0   1 -20 31.7096 34.3496   1
   0   1 -20 50.0563 12.1547   1
  -1  -1 -20 137.638 19.7608   1
  -1  -1 -20 242.644 49.0903   1
  -1   1 -20 155.393 40.8741   1
  -1   1 -20 161.222 22.2259   1
   1   1  20 250.662 45.2672   1
  -2  -1 -20 31.7319 14.4398   1
  -2  -1 -20 128.536 48.7938   1
   2   1  20 39.5124 35.0211   1
  -2   1 -20 47.1538 15.1294   1
  -2   1 -20 35.3527  42.421   1
   4   2 -20  99.579 37.2372   1
   4   2 -20 96.4237 31.6378   1
   3  -2 -20 131.023  38.313   1
   3  -2 -20 129.472  32.447   1
   3   2 -20 96.3164 14.4136   1
  -3   2  20  157.66 23.6313   1
   3   2 -20 81.8058 24.8947   1
   2  -2 -20  -36.33   31.60   1
   2   2 -20 -24.721 28.3425   1
   2   2 -20 -11.161 24.7525   1
   2   2 -20 35.3796 12.6257   1
   1  -2 -20 38.3429 34.3483   1
   1   2 -20 54.7256 23.7491   1
   1   2 -20 46.5902 12.8663   1
   1   2 -20 -3.3384 31.4722   1
   0  -2 -20 -0.4952 37.8201   1
   0   2 -20 7.07815 13.3364   1
   0   2 -20 -0.5832 34.5569   1
  -1  -2 -20 399.332 78.5277   1
  -1  -2 -20 341.159 24.0151   1
  -1   2 -20 248.571  25.797   1
   1   2  20 257.713 51.0793   1
  -2  -2 -20 -4.1417 17.3077   1
  -2  -2 -20 38.9397 51.1774   1
  -2   2 -20 -44.573 39.9059   1
   3  -3 -20 23.3845  54.729   1
   3   3 -20 66.9403 36.3134   1
  -3   3  20 105.428  21.267   1
   3   3 -20 90.9989 15.0662   1
   2  -3 -20 124.865 39.4678   1
   2   3 -20 155.827 20.4107   1
   2   3 -20 111.342 33.4613   1
  -2   3  20 184.781  26.016   1
   2   3 -20 147.951 26.5143   1
   1  -3 -20 68.0474 42.8844   1
   1   3 -20 11.1295 28.2591   1
   1   3 -20 -7.6437  32.823   1
   0  -3 -20 10.9324 42.3815   1
   0   3 -20 -19.522 23.9062   1
   0   3 -20 58.4732  34.287   1
   0   3 -20 12.9796 14.3202   1
   0   3  20 9.56661 37.5663   1
  -1  -3 -20 74.7725 76.5487   1
  -1   3 -20 40.4828 37.9153   1
   2   4 -20 -23.457 27.7956   1
   2   4 -20 -33.017 32.3895   1
   2   4 -20 -17.642 14.3234   1
   1   4 -20 6.22171 33.4408   1
   1   4 -20 -0.0138 14.8592   1
   1   4 -20 62.8113 26.8699   1
   0   4 -20 28.6986 16.1699   1
   0   4 -20 25.7536  25.319   1
   3   0 -21 425.523 66.2395   1
   3   0 -21 395.176 50.7912   1
   2   0 -21 10.1094 27.7201   1
   1   0 -21 315.102 25.5109   1
   0   0 -21 13.4985 14.9616   1
   0   0 -21 -49.405 40.8957   1
  -1   0 -21 455.649 79.3664   1
  -1   0 -21 349.244 25.2566   1
   3  -1 -21 41.5431 31.7745   1
   3  -1 -21   53.19  37.383   1
   3   1 -21 64.6288 34.0388   1
   3   1 -21 88.8316 31.4449   1
   2  -1 -21 65.3735 31.2258   1
   2  -1 -21  -57.05 34.6015   1
   2   1 -21 -9.1503 25.2183   1
   2   1 -21 -3.7807 35.4438   1
   2   1 -21 -1.9634 13.4887   1
   1  -1 -21  113.27 42.0881   1
   1  -1 -21 56.0272 14.6075   1
   1   1 -21 21.1872 14.0373   1
   1   1 -21 74.5984  27.326   1
   1   1 -21 41.8762 39.0034   1
   0  -1 -21  26.726  45.469   1
   0  -1 -21 101.115 16.4463   1
   0   1 -21  64.552 42.0679   1
   0   1 -21 161.172 23.6339   1
  -1  -1 -21 59.6662 49.2386   1
  -1  -1 -21 72.8605 17.4531   1
  -1   1 -21 163.373 46.7193   1
   1   1  21 107.684 37.1922   1
  -1   1 -21 88.9945 15.8928   1
   3   2 -21 84.2574 38.2408   1
   3   2 -21  70.554 28.0054   1
   2  -2 -21  148.90 42.4445   1
   2   2 -21 139.881 31.8058   1
   2   2 -21 157.205  19.424   1
   1  -2 -21  124.72 42.4564   1
   1   2 -21  -18.64 35.7584   1
   1   2 -21 70.5405  15.526   1
   1   2 -21 27.9211 25.6255   1
   0  -2 -21 235.197 51.6028   1
   0   2 -21  166.16 45.4189   1
   0   2 -21 263.109 23.7897   1
  -1   2 -21 165.289 45.4326   1
   2   3 -21 262.577 25.6549   1
   2   3 -21 147.263 38.4316   1
   2   3 -21 193.442  33.557   1
   1   3 -21 427.297 27.8786   1
   1   3 -21  388.53 47.2049   1
   1   3 -21 360.982 65.0091   1
   0   3 -21  29.074 42.9771   1
   0   3 -21 53.7555 27.0087   1
   2   0 -22 58.2466 43.6477   1
   2   0 -22 38.0362 32.4247   1
   1   0 -22 68.2459 43.9899   1
   1   0 -22 -12.599 14.6696   1
   0   0 -22 221.373 57.9056   1
   2   1 -22 7.98729 31.9216   1
   1  -1 -22 55.9675 50.7563   1
   1   1 -22  116.42 42.8801   1
   1   1 -22 -10.671 29.7991   1
   0   1 -22 -5.1669 43.7226   1
   0   0   0    0.00    0.00   1

 _exptl_absorpt_process_details 'SADABS 2014/5'
 _exptl_absorpt_correction_type   multi-scan
 _exptl_absorpt_correction_T_max  0.7452
 _exptl_absorpt_correction_T_min  0.5433
 _exptl_special_details
;
_shelx_hkl_checksum              34486
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y, -z+1/2'
'-x, -y, -z'
'x-1/2, -y, 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
Br1 Br 0.31290(6) 0.64185(6) 0.51525(2) 0.02015(13) Uani 1 1 d . . .
Fe1 Fe -0.2500 0.70664(11) 0.2500 0.0115(2) Uani 1 2 d S T P
N4 N -0.6580(5) 0.3845(5) 0.34821(18) 0.0197(8) Uani 1 1 d . . .
N2 N -0.4034(4) 0.9251(4) 0.29052(17) 0.0129(8) Uani 1 1 d . . .
H2 H -0.5247 0.9396 0.2599 0.016 Uiso 1 1 calc R U .
C4 C -0.2111(5) 0.8414(5) 0.4801(2) 0.0151(9) Uani 1 1 d . . .
H4 H -0.2953 0.8964 0.5075 0.018 Uiso 1 1 calc R U .
N3 N -0.4590(5) 0.5374(4) 0.27309(19) 0.0197(9) Uani 1 1 d . . .
N1 N -0.1422(5) 0.7336(4) 0.36629(17) 0.0126(8) Uani 1 1 d . . .
C6 C -0.4314(6) 0.8864(6) 0.3655(2) 0.0165(10) Uani 1 1 d . . .
H6A H -0.5308 0.8006 0.3660 0.020 Uiso 1 1 calc R U .
H6B H -0.4687 0.9919 0.3895 0.020 Uiso 1 1 calc R U .
C8 C -0.5546(6) 0.4571(5) 0.3052(2) 0.0150(10) Uani 1 1 d . . .
C1 C 0.0216(6) 0.6796(5) 0.3990(2) 0.0144(10) Uani 1 1 d . . .
H1 H 0.1030 0.6221 0.3712 0.017 Uiso 1 1 calc R U .
C9 C -0.7395(6) 0.2353(6) 0.3347(2) 0.0131(9) Uani 1 1 d . . .
N5 N -0.8167(5) 0.1058(5) 0.32978(18) 0.0214(9) Uani 1 1 d . . .
C5 C -0.2558(5) 0.8173(5) 0.4061(2) 0.0127(9) Uani 1 1 d . . .
C3 C -0.0426(6) 0.7846(5) 0.5140(2) 0.0160(10) Uani 1 1 d . . .
H3 H -0.0089 0.7999 0.5646 0.019 Uiso 1 1 calc R U .
C2 C 0.0744(6) 0.7055(5) 0.4720(2) 0.0144(9) Uani 1 1 d . . .
C7 C -0.2885(6) 1.0795(5) 0.2855(2) 0.0176(10) Uani 1 1 d . . .
H7A H -0.1868 1.0803 0.3259 0.021 Uiso 1 1 calc R U .
H7B H -0.3636 1.1839 0.2893 0.021 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
Br1 0.0153(2) 0.0251(3) 0.0186(2) 0.0008(2) -0.00369(16) 0.0028(2)
Fe1 0.0123(5) 0.0099(5) 0.0119(4) 0.000 -0.0004(3) 0.000
N4 0.023(2) 0.018(2) 0.0197(19) -0.0036(17) 0.0092(16) -0.0020(18)
N2 0.0089(18) 0.0162(19) 0.0133(18) 0.0004(15) 0.0000(14) -0.0011(15)
C4 0.013(2) 0.017(2) 0.017(2) -0.0022(19) 0.0087(17) -0.0006(19)
N3 0.020(2) 0.013(2) 0.025(2) 0.0009(17) -0.0003(17) -0.0025(17)
N1 0.0119(19) 0.0127(19) 0.0131(18) 0.0002(15) 0.0014(15) 0.0011(15)
C6 0.014(2) 0.017(3) 0.019(2) -0.0007(19) 0.0027(17) 0.0057(19)
C8 0.015(2) 0.014(2) 0.014(2) -0.0031(19) -0.0069(19) 0.0022(19)
C1 0.015(2) 0.009(2) 0.020(2) 0.0000(18) 0.0030(18) 0.0016(17)
C9 0.009(2) 0.024(3) 0.007(2) 0.0023(18) 0.0031(16) 0.009(2)
N5 0.020(2) 0.026(2) 0.019(2) -0.0016(17) 0.0041(16) -0.0057(19)
C5 0.012(2) 0.011(2) 0.016(2) 0.0007(17) 0.0009(17) 0.0007(17)
C3 0.018(2) 0.018(2) 0.011(2) 0.0017(18) -0.0010(18) -0.004(2)
C2 0.012(2) 0.018(2) 0.013(2) 0.0053(18) -0.0010(17) -0.0010(19)
C7 0.020(3) 0.011(2) 0.021(2) -0.0045(18) -0.0005(19) 0.0001(19)
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'
Br Br -0.2901 2.4595 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Fe Fe 0.3463 0.8444 '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'
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
N3 Fe1 N3 102.47(19) 2_455 .
N3 Fe1 N1 92.28(13) 2_455 2_455
N3 Fe1 N1 94.54(13) . 2_455
N3 Fe1 N1 94.54(13) 2_455 .
N3 Fe1 N1 92.27(13) . .
N1 Fe1 N1 169.11(18) 2_455 .
N3 Fe1 N2 89.92(12) 2_455 2_455
N3 Fe1 N2 163.81(13) . 2_455
N1 Fe1 N2 74.35(12) 2_455 2_455
N1 Fe1 N2 97.15(12) . 2_455
N3 Fe1 N2 163.81(13) 2_455 .
N3 Fe1 N2 89.92(12) . .
N1 Fe1 N2 97.15(12) 2_455 .
N1 Fe1 N2 74.35(12) . .
N2 Fe1 N2 80.06(17) 2_455 .
C8 N4 C9 123.6(3) . .
C6 N2 C7 112.1(3) . .
C6 N2 Fe1 107.6(2) . .
C7 N2 Fe1 106.6(2) . .
C5 C4 C3 119.5(4) . .
C8 N3 Fe1 161.0(3) . .
C1 N1 C5 118.7(3) . .
C1 N1 Fe1 126.9(3) . .
C5 N1 Fe1 114.4(3) . .
N2 C6 C5 109.7(3) . .
N3 C8 N4 171.7(4) . .
N1 C1 C2 121.6(4) . .
N5 C9 N4 173.1(4) . .
N1 C5 C4 121.7(4) . .
N1 C5 C6 116.4(3) . .
C4 C5 C6 121.9(4) . .
C2 C3 C4 118.0(4) . .
C3 C2 C1 120.4(4) . .
C3 C2 Br1 118.9(3) . .
C1 C2 Br1 120.6(3) . .
N2 C7 C7 109.7(3) . 2_455
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Br1 C2 1.896(4) .
Fe1 N3 2.106(4) 2_455
Fe1 N3 2.106(4) .
Fe1 N1 2.216(3) 2_455
Fe1 N1 2.216(3) .
Fe1 N2 2.224(3) 2_455
Fe1 N2 2.224(3) .
N4 C8 1.299(5) .
N4 C9 1.317(6) .
N2 C6 1.466(5) .
N2 C7 1.479(5) .
C4 C5 1.386(5) .
C4 C3 1.386(6) .
N3 C8 1.159(5) .
N1 C1 1.344(5) .
N1 C5 1.350(5) .
C6 C5 1.508(5) .
C1 C2 1.378(5) .
C9 N5 1.155(5) .
C3 C2 1.376(6) .
C7 C7 1.498(8) 2_455
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 168339882
