#------------------------------------------------------------------------------
#$Date: 2021-02-05 01:11:05 +0200 (Fri, 05 Feb 2021) $
#$Revision: 261652 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/63/7706322.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_7706322
loop_
_publ_author_name
'Deorukhkar, Neel'
'Besnard, Céline'
'Guénée, Laure'
'Piguet, Claude'
_publ_section_title
;
 Tuning spin-crossover transition temperatures in non-symmetrical
 homoleptic meridional/facial [Fe(didentate)₃]²⁺
 complexes: what for and who cares about it?
;
_journal_issue                   4
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1206
_journal_page_last               1223
_journal_paper_doi               10.1039/d0dt03828h
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety         'C12 H10 N4'
_chemical_formula_sum            'C12 H10 N4'
_chemical_formula_weight         210.24
_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2019-04-11
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2020-10-30 deposited with the CCDC.	2020-12-15 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   16.9371(3)
_cell_length_b                   9.58870(10)
_cell_length_c                   25.1582(4)
_cell_measurement_reflns_used    5754
_cell_measurement_temperature    180.01(10)
_cell_measurement_theta_max      70.6520
_cell_measurement_theta_min      4.3670
_cell_volume                     4085.81(11)
_computing_cell_refinement       'CrysAlisPro 1.171.40.43a (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.43a (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.43a (Rigaku OD, 2019)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      180.01(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 10.4670
_diffrn_detector_type            Atlas
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω   -115.00 -17.00   1.00   10.00    --  -41.71 -38.00  90.00   98
  2  ω     23.00  75.00   1.00   10.00    --   41.71-125.00 -60.00   52
  3  ω      2.00  29.00   1.00   10.00    --   41.71 -99.00 -30.00   27
  4  ω    119.00 173.00   1.00   40.00    --  100.00 125.00 -30.00   54
  5  ω     28.00 129.00   1.00   40.00    --  100.00 -61.00   0.00  101
  6  ω    119.00 171.00   1.00   40.00    --  100.00 125.00 -90.00   52
  7  ω     65.00 118.00   1.00   40.00    --  100.00 -45.00-150.00   53
  8  ω     38.00 106.00   1.00   40.00    --  100.00-125.00  30.00   68
  9  ω    151.00 176.00   1.00   40.00    --  100.00 114.00 -65.00   25
 10  ω     95.00 173.00   1.00   40.00    --  100.00  15.00 -90.00   78
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at home/near, Atlas'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0323581000
_diffrn_orient_matrix_UB_12      0.0613515000
_diffrn_orient_matrix_UB_13      -0.0522825000
_diffrn_orient_matrix_UB_21      0.0834563000
_diffrn_orient_matrix_UB_22      0.0049252000
_diffrn_orient_matrix_UB_23      0.0242579000
_diffrn_orient_matrix_UB_31      0.0160853000
_diffrn_orient_matrix_UB_32      -0.1483782000
_diffrn_orient_matrix_UB_33      -0.0207391000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0259
_diffrn_reflns_av_unetI/netI     0.0180
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            15128
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         70.689
_diffrn_reflns_theta_min         3.514
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Cu) X-ray Source'
_exptl_absorpt_coefficient_mu    0.696
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.838
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.40.43a (Rigaku Oxford Diffraction, 2019)
Numerical absorption correction based on gaussian integration over
			a multifaceted crystal model
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.367
_exptl_crystal_description       plate
_exptl_crystal_F_000             1760
_exptl_crystal_size_max          0.192
_exptl_crystal_size_mid          0.085
_exptl_crystal_size_min          0.018
_refine_diff_density_max         0.136
_refine_diff_density_min         -0.236
_refine_diff_density_rms         0.044
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     291
_refine_ls_number_reflns         3894
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.063
_refine_ls_R_factor_all          0.0518
_refine_ls_R_factor_gt           0.0402
_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)+(0.0528P)²+0.6927P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0964
_refine_ls_wR_factor_ref         0.1061
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3150
_reflns_number_total             3894
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0dt03828h2.cif
_cod_data_source_block           L6
_cod_depositor_comments
'Adding full bibliography for 7706322--7706338.cif.'
_cod_database_code               7706322
_shelx_shelxl_version_number     2017/1
_chemical_oxdiff_formula         'C12 H10 N4'
_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.
;
_reflns_odcompleteness_completeness 99.93
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C6(H6), C7(H7), C9(H9), C16(H16), C14(H14), C8(H8), C15(H15), C36(H36),
 C26(H26), C27(H27), C29(H29), C34(H34), C28(H28), C35(H35)
2.b Idealised Me refined as rotating group:
 C11(H11A,H11B,H11C), C31(H31A,H31B,H31C)
;
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.709
_oxdiff_exptl_absorpt_empirical_full_min 0.796
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x-1/2, y-1/2, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C11 C 0.56721(8) 0.74883(15) 0.52103(6) 0.0452(3) Uani 1 1 d . . . . .
H11A H 0.601462 0.824974 0.509050 0.068 Uiso 1 1 calc GR . . . .
H11B H 0.572853 0.669112 0.496947 0.068 Uiso 1 1 calc GR . . . .
H11C H 0.582365 0.720876 0.557081 0.068 Uiso 1 1 calc GR . . . .
N1 N 0.37512(7) 0.92144(12) 0.53568(5) 0.0399(3) Uani 1 1 d . . . . .
C12 C 0.45083(8) 0.90725(13) 0.54654(5) 0.0353(3) Uani 1 1 d . . . . .
C5 C 0.35758(8) 0.81318(14) 0.50179(6) 0.0387(3) Uani 1 1 d . . . . .
N2 N 0.48500(7) 0.79590(11) 0.52103(4) 0.0365(3) Uani 1 1 d . . . . .
C13 C 0.49264(8) 1.00324(14) 0.58288(5) 0.0386(3) Uani 1 1 d . . . . .
C6 C 0.28593(9) 0.77766(15) 0.47798(6) 0.0471(3) Uani 1 1 d . . . . .
H6 H 0.239791 0.831837 0.483882 0.056 Uiso 1 1 calc R . . . .
C10 C 0.42545(8) 0.73318(13) 0.49207(6) 0.0378(3) Uani 1 1 d . . . . .
N4 N 0.56721(7) 0.97406(14) 0.59539(5) 0.0467(3) Uani 1 1 d . . . . .
N3 N 0.45043(8) 1.11244(14) 0.60013(5) 0.0488(3) Uani 1 1 d . . . . .
C7 C 0.28409(10) 0.66220(16) 0.44582(7) 0.0524(4) Uani 1 1 d . . . . .
H7 H 0.235821 0.635403 0.429521 0.063 Uiso 1 1 calc R . . . .
C9 C 0.42392(9) 0.61712(14) 0.45887(6) 0.0458(3) Uani 1 1 d . . . . .
H9 H 0.470092 0.563913 0.451896 0.055 Uiso 1 1 calc R . . . .
C16 C 0.60278(10) 1.06387(19) 0.62812(6) 0.0554(4) Uani 1 1 d . . . . .
H16 H 0.655931 1.046466 0.638207 0.067 Uiso 1 1 calc R . . . .
C14 C 0.48827(12) 1.20038(19) 0.63242(7) 0.0599(4) Uani 1 1 d . . . . .
H14 H 0.460960 1.279967 0.645362 0.072 Uiso 1 1 calc R . . . .
C8 C 0.35222(10) 0.58330(16) 0.43665(7) 0.0517(4) Uani 1 1 d . . . . .
H8 H 0.348855 0.503634 0.414312 0.062 Uiso 1 1 calc R . . . .
C15 C 0.56597(12) 1.1797(2) 0.64772(7) 0.0610(5) Uani 1 1 d . . . . .
H15 H 0.592350 1.242988 0.670709 0.073 Uiso 1 1 calc R . . . .
C36 C 0.73373(10) 0.3227(2) 0.36215(8) 0.0723(6) Uani 1 1 d . . . . .
H36 H 0.781033 0.278212 0.351037 0.087 Uiso 1 1 calc R . . . .
N21 N 0.45978(7) 0.38047(14) 0.34033(5) 0.0456(3) Uani 1 1 d . . . . .
C32 C 0.52496(8) 0.30836(15) 0.33236(5) 0.0382(3) Uani 1 1 d . . . . .
C25 C 0.40279(9) 0.31175(17) 0.31104(5) 0.0452(3) Uani 1 1 d . . . . .
N22 N 0.51445(7) 0.19589(12) 0.29913(4) 0.0402(3) Uani 1 1 d . . . . .
C33 C 0.60149(8) 0.34788(15) 0.35647(5) 0.0384(3) Uani 1 1 d . . . . .
C26 C 0.32272(10) 0.3431(2) 0.30479(7) 0.0613(5) Uani 1 1 d . . . . .
H26 H 0.299648 0.421651 0.321787 0.074 Uiso 1 1 calc R . . . .
C30 C 0.43570(9) 0.19729(16) 0.28510(5) 0.0426(3) Uani 1 1 d . . . . .
C31 C 0.56990(10) 0.08819(17) 0.28212(7) 0.0541(4) Uani 1 1 d . . . . .
H31A H 0.604090 0.125424 0.254088 0.081 Uiso 1 1 calc GR . . . .
H31B H 0.540545 0.007774 0.268424 0.081 Uiso 1 1 calc GR . . . .
H31C H 0.602267 0.059066 0.312442 0.081 Uiso 1 1 calc GR . . . .
N24 N 0.66547(8) 0.28322(18) 0.33952(6) 0.0668(4) Uani 1 1 d . . . . .
N23 N 0.59922(8) 0.44718(17) 0.39277(6) 0.0621(4) Uani 1 1 d . . . . .
C27 C 0.27859(11) 0.2560(2) 0.27306(7) 0.0680(5) Uani 1 1 d . . . . .
H27 H 0.223942 0.274583 0.268353 0.082 Uiso 1 1 calc R . . . .
C29 C 0.39108(10) 0.10916(19) 0.25282(6) 0.0550(4) Uani 1 1 d . . . . .
H29 H 0.413895 0.031216 0.235286 0.066 Uiso 1 1 calc R . . . .
C34 C 0.66892(10) 0.4823(2) 0.41354(8) 0.0701(5) Uani 1 1 d . . . . .
H34 H 0.670006 0.553867 0.439642 0.084 Uiso 1 1 calc R . . . .
C28 C 0.31199(11) 0.1412(2) 0.24770(7) 0.0642(5) Uani 1 1 d . . . . .
H28 H 0.279445 0.083342 0.226269 0.077 Uiso 1 1 calc R . . . .
C35 C 0.73850(10) 0.42175(19) 0.39958(6) 0.0547(4) Uani 1 1 d . . . . .
H35 H 0.787279 0.447928 0.415329 0.066 Uiso 1 1 calc R . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1 0 0 0.0143
-1 0 0 0.0033
0 -1 0 0.0736
0 0 -1 0.0426
0 0 1 0.0426
0 1 -2 0.0685
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
N2 C11 H11A 109.5 . . ?
N2 C11 H11B 109.5 . . ?
N2 C11 H11C 109.5 . . ?
C12 N1 C5 105.11(11) . . ?
N1 C12 N2 113.16(12) . . ?
N1 C12 C13 122.01(12) . . ?
N2 C12 C13 124.83(12) . . ?
N1 C5 C6 129.64(13) . . ?
N1 C5 C10 110.08(12) . . ?
C6 C5 C10 120.27(13) . . ?
C12 N2 C11 129.84(12) . . ?
C12 N2 C10 106.08(11) . . ?
C10 N2 C11 124.06(11) . . ?
N4 C13 C12 118.02(12) . . ?
N4 C13 N3 126.43(13) . . ?
N3 C13 C12 115.55(13) . . ?
C5 C6 H6 121.0 . . ?
C7 C6 C5 118.03(14) . . ?
C7 C6 H6 121.0 . . ?
N2 C10 C5 105.55(12) . . ?
N2 C10 C9 132.68(13) . . ?
C9 C10 C5 121.76(13) . . ?
C13 N4 C16 116.00(14) . . ?
C14 N3 C13 115.75(14) . . ?
C6 C7 H7 119.5 . . ?
C6 C7 C8 121.00(15) . . ?
C8 C7 H7 119.5 . . ?
C10 C9 H9 121.7 . . ?
C8 C9 C10 116.66(14) . . ?
C8 C9 H9 121.7 . . ?
N4 C16 H16 118.6 . . ?
N4 C16 C15 122.76(16) . . ?
C15 C16 H16 118.6 . . ?
N3 C14 H14 118.8 . . ?
N3 C14 C15 122.34(17) . . ?
C15 C14 H14 118.8 . . ?
C7 C8 H8 118.9 . . ?
C9 C8 C7 122.25(14) . . ?
C9 C8 H8 118.9 . . ?
C16 C15 C14 116.73(15) . . ?
C16 C15 H15 121.6 . . ?
C14 C15 H15 121.6 . . ?
N24 C36 H36 118.3 . . ?
C35 C36 H36 118.3 . . ?
C35 C36 N24 123.36(17) . . ?
C32 N21 C25 104.70(12) . . ?
N21 C32 N22 113.28(12) . . ?
N21 C32 C33 122.46(13) . . ?
N22 C32 C33 124.25(12) . . ?
N21 C25 C26 129.43(15) . . ?
N21 C25 C30 110.25(13) . . ?
C30 C25 C26 120.32(14) . . ?
C32 N22 C30 105.83(12) . . ?
C32 N22 C31 130.48(12) . . ?
C30 N22 C31 123.62(12) . . ?
N24 C33 C32 117.80(13) . . ?
N24 C33 N23 125.92(14) . . ?
N23 C33 C32 116.28(13) . . ?
C25 C26 H26 121.3 . . ?
C27 C26 C25 117.48(18) . . ?
C27 C26 H26 121.3 . . ?
C25 C30 C29 122.23(15) . . ?
N22 C30 C25 105.94(12) . . ?
N22 C30 C29 131.83(15) . . ?
N22 C31 H31A 109.5 . . ?
N22 C31 H31B 109.5 . . ?
N22 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C33 N24 C36 115.93(15) . . ?
C33 N23 C34 115.30(15) . . ?
C26 C27 H27 119.2 . . ?
C26 C27 C28 121.67(17) . . ?
C28 C27 H27 119.2 . . ?
C30 C29 H29 121.8 . . ?
C28 C29 C30 116.44(17) . . ?
C28 C29 H29 121.8 . . ?
N23 C34 H34 118.0 . . ?
N23 C34 C35 123.91(16) . . ?
C35 C34 H34 118.0 . . ?
C27 C28 H28 119.1 . . ?
C29 C28 C27 121.85(16) . . ?
C29 C28 H28 119.1 . . ?
C36 C35 C34 115.58(15) . . ?
C36 C35 H35 122.2 . . ?
C34 C35 H35 122.2 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C11 N2 1.4637(17) . ?
N1 C12 1.3180(18) . ?
N1 C5 1.3758(18) . ?
C12 N2 1.3736(17) . ?
C12 C13 1.4781(19) . ?
C5 C6 1.395(2) . ?
C5 C10 1.4035(19) . ?
N2 C10 1.3821(18) . ?
C13 N4 1.3313(19) . ?
C13 N3 1.3401(19) . ?
C6 H6 0.9500 . ?
C6 C7 1.372(2) . ?
C10 C9 1.392(2) . ?
N4 C16 1.335(2) . ?
N3 C14 1.335(2) . ?
C7 H7 0.9500 . ?
C7 C8 1.399(2) . ?
C9 H9 0.9500 . ?
C9 C8 1.376(2) . ?
C16 H16 0.9500 . ?
C16 C15 1.366(3) . ?
C14 H14 0.9500 . ?
C14 C15 1.385(3) . ?
C8 H8 0.9500 . ?
C15 H15 0.9500 . ?
C36 H36 0.9500 . ?
C36 N24 1.343(2) . ?
C36 C35 1.340(2) . ?
N21 C32 1.3180(19) . ?
N21 C25 1.3815(19) . ?
C32 N22 1.3761(18) . ?
C32 C33 1.4804(19) . ?
C25 C26 1.398(2) . ?
C25 C30 1.393(2) . ?
N22 C30 1.3798(19) . ?
N22 C31 1.460(2) . ?
C33 N24 1.319(2) . ?
C33 N23 1.320(2) . ?
C26 H26 0.9500 . ?
C26 C27 1.376(3) . ?
C30 C29 1.395(2) . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
N23 C34 1.334(2) . ?
C27 H27 0.9500 . ?
C27 C28 1.392(3) . ?
C29 H29 0.9500 . ?
C29 C28 1.380(3) . ?
C34 H34 0.9500 . ?
C34 C35 1.360(3) . ?
C28 H28 0.9500 . ?
C35 H35 0.9500 . ?
loop_
_exptl_oxdiff_crystal_face_indexfrac_h
_exptl_oxdiff_crystal_face_indexfrac_k
_exptl_oxdiff_crystal_face_indexfrac_l
_exptl_oxdiff_crystal_face_x
_exptl_oxdiff_crystal_face_y
_exptl_oxdiff_crystal_face_z
0.9982 -0.0003 0.0006 0.0322 0.0833 0.0161
-0.9982 0.0003 -0.0006 -0.0322 -0.0833 -0.0161
0.0011 -0.9994 -0.0000 -0.0613 -0.0048 0.1483
-0.0000 0.0002 -0.9983 0.0522 -0.0242 0.0207
0.0000 -0.0002 0.9983 -0.0522 0.0242 -0.0207
-0.0011 0.9997 -1.9966 0.1657 -0.0436 -0.1069
