#------------------------------------------------------------------------------
#$Date: 2019-06-05 06:55:19 +0300 (Wed, 05 Jun 2019) $
#$Revision: 215708 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/28/7232866.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_7232866
loop_
_publ_author_name
'Dong, Jun-Liang'
'Zhu, Peng-Yin'
'Du, Jia-Qiang'
'Xie, Fei'
'Lan, Hai-Ming'
'Yang, Ru-Xia'
'Yang, Li-Zheng'
'Wang, Duo-Zhi'
_publ_section_title
;
 Syntheses, structures, and magnetic properties of mixed-ligand complexes
 based on 3,6-bis(benzimidazol-1-yl)pyridazine
;
_journal_issue                   31
_journal_name_full               'RSC Advances'
_journal_page_first              17560
_journal_paper_doi               10.1039/C9RA03082D
_journal_volume                  9
_journal_year                    2019
_chemical_formula_moiety         'C25 H17 Mn N7 O5'
_chemical_formula_sum            'C25 H17 Mn N7 O5'
_chemical_formula_weight         550.40
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_audit_creation_date             2017-07-24
_audit_creation_method
;
Olex2 1.2
(compiled 2017.03.28 svn.r3405 for OlexSys, GUI svn.r5337)
;
_audit_update_record
;
2018-10-18 deposited with the CCDC.    2019-05-27 downloaded from the CCDC.
;
_cell_angle_alpha                66.724(9)
_cell_angle_beta                 68.005(8)
_cell_angle_gamma                77.863(7)
_cell_formula_units_Z            2
_cell_length_a                   9.3365(7)
_cell_length_b                   11.9034(11)
_cell_length_c                   11.9507(11)
_cell_measurement_reflns_used    4801
_cell_measurement_temperature    100.00(10)
_cell_measurement_theta_max      28.8500
_cell_measurement_theta_min      3.7370
_cell_volume                     1128.23(19)
_computing_cell_refinement       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_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      100.00(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 5.2684
_diffrn_detector_type            AtlasS2
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.839
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω     -9.00  85.00   1.00    2.33    --   11.74  37.00 -30.00   94
  2  ω    -10.00  38.00   1.00    2.33    --   11.74  37.00  90.00   48
  3  ω    -15.00  28.00   1.00    2.33    --  -11.59 -99.00 120.00   43
  4  ω    -65.00  30.00   1.00    2.33    --   11.74 -19.00 150.00   95
  5  ω     39.00  98.00   1.00    2.33    --   11.74-178.00-180.00   59
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0175698000
_diffrn_orient_matrix_UB_12      -0.0435504000
_diffrn_orient_matrix_UB_13      0.0634975000
_diffrn_orient_matrix_UB_21      0.0236251000
_diffrn_orient_matrix_UB_22      0.0398289000
_diffrn_orient_matrix_UB_23      0.0199616000
_diffrn_orient_matrix_UB_31      -0.0766966000
_diffrn_orient_matrix_UB_32      0.0273381000
_diffrn_orient_matrix_UB_33      0.0153463000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0278
_diffrn_reflns_av_unetI/netI     0.0493
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.839
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            10282
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.839
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.506
_diffrn_reflns_theta_min         3.525
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    0.641
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.80324
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.43f (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    1.620
_exptl_crystal_description       block
_exptl_crystal_F_000             562
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.526
_refine_diff_density_min         -0.591
_refine_diff_density_rms         0.073
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     344
_refine_ls_number_reflns         5286
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.042
_refine_ls_R_factor_all          0.0474
_refine_ls_R_factor_gt           0.0403
_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)+(0.0350P)²+0.9070P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0924
_refine_ls_wR_factor_ref         0.0982
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4590
_reflns_number_total             5286
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9ra03082d2.cif
_cod_data_source_block           0721-01
_cod_original_cell_volume        1128.2(2)
_cod_database_code               7232866
_shelx_shelxl_version_number     2017/1
_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_max   0.927
_shelx_estimated_absorpt_t_min   0.893
_reflns_odcompleteness_completeness 99.78
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All O(H,H) groups
2.a Rotating group:
 O1S(H1SA,H1SB)
2.b Aromatic/amide H refined with riding coordinates:
 C22(H22), C3(H3), C18(H18), C16(H16), C1(H1), C10(H10), C00V(H00V), C23(H23),
 C9(H9), C15(H15), C4(H4), C6(H6), C13(H13), C5(H5), C14(H14)
;
_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
- Detector area scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.227
_oxdiff_exptl_absorpt_empirical_full_min 0.741
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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
Mn1 Mn 0.94923(3) 0.36669(3) 0.66257(3) 0.01100(9) Uani 1 1 d .
O1 O 0.87086(16) 0.47581(13) 0.48564(12) 0.0128(3) Uani 1 1 d .
O1S O 1.12323(17) 0.33289(14) 0.75185(13) 0.0176(3) Uani 1 1 d .
H1SA H 1.082232 0.306004 0.834420 0.026 Uiso 1 1 d GR
H1SB H 1.165749 0.399648 0.728673 0.026 Uiso 1 1 d GR
O4 O 0.87207(17) 0.20107(13) 0.86320(13) 0.0164(3) Uani 1 1 d .
O3 O 0.70983(17) 0.05137(14) 0.98575(13) 0.0190(3) Uani 1 1 d .
O2 O 0.70998(17) 0.48008(14) 0.38311(13) 0.0185(3) Uani 1 1 d .
N7 N 0.73490(19) 0.28932(15) 0.68779(15) 0.0114(3) Uani 1 1 d .
N6 N 0.78559(19) 0.50091(15) 0.75546(15) 0.0128(3) Uani 1 1 d .
N3 N 0.41307(19) 0.88421(16) 0.56459(16) 0.0142(4) Uani 1 1 d .
N2 N 0.21130(19) 1.03439(15) 0.59053(15) 0.0126(3) Uani 1 1 d .
N1 N 0.07491(19) 1.21641(15) 0.57241(15) 0.0136(4) Uani 1 1 d .
N4 N 0.50981(19) 0.79147(15) 0.61106(16) 0.0140(4) Uani 1 1 d .
N5 N 0.60046(19) 0.65311(15) 0.77397(15) 0.0124(3) Uani 1 1 d .
C21 C 0.6705(2) 0.19535(18) 0.79313(18) 0.0122(4) Uani 1 1 d .
C17 C 0.7575(2) 0.51648(18) 0.87238(18) 0.0123(4) Uani 1 1 d .
C19 C 0.7568(2) 0.43970(18) 0.47770(19) 0.0131(4) Uani 1 1 d .
C2 C 0.0916(2) 1.18426(18) 0.46689(18) 0.0124(4) Uani 1 1 d .
C20 C 0.6721(2) 0.33719(18) 0.59327(18) 0.0126(4) Uani 1 1 d .
C24 C 0.7570(2) 0.14443(19) 0.88992(19) 0.0142(4) Uani 1 1 d .
C12 C 0.6423(2) 0.61159(19) 0.88573(18) 0.0133(4) Uani 1 1 d .
C22 C 0.5387(2) 0.14712(19) 0.80888(19) 0.0152(4) Uani 1 1 d .
H22 H 0.494994 0.082672 0.883150 0.018 Uiso 1 1 calc R
C11 C 0.4906(2) 0.74851(18) 0.73578(18) 0.0124(4) Uani 1 1 d .
C7 C 0.1781(2) 1.07141(18) 0.47620(18) 0.0130(4) Uani 1 1 d .
C8 C 0.3015(2) 0.93037(18) 0.64569(18) 0.0124(4) Uani 1 1 d .
C3 C 0.0360(2) 1.24618(19) 0.36298(19) 0.0142(4) Uani 1 1 d .
H3 H -0.022714 1.320661 0.355927 0.017 Uiso 1 1 calc R
C18 C 0.6911(2) 0.58339(18) 0.70164(18) 0.0135(4) Uani 1 1 d .
H18 H 0.686068 0.593611 0.621885 0.016 Uiso 1 1 calc R
C16 C 0.8285(2) 0.45467(19) 0.96630(19) 0.0159(4) Uani 1 1 d .
H16 H 0.906144 0.392424 0.957283 0.019 Uiso 1 1 calc R
C1 C 0.1462(2) 1.12521(19) 0.64192(19) 0.0144(4) Uani 1 1 d .
H1 H 0.152149 1.122131 0.719038 0.017 Uiso 1 1 calc R
C10 C 0.3679(2) 0.78881(19) 0.82569(19) 0.0165(4) Uani 1 1 d .
H10 H 0.353259 0.752856 0.913487 0.020 Uiso 1 1 calc R
C00V C 0.5413(2) 0.29377(19) 0.60122(19) 0.0147(4) Uani 1 1 d .
H00V H 0.499403 0.328293 0.534476 0.018 Uiso 1 1 calc R
C23 C 0.4735(2) 0.19746(19) 0.7110(2) 0.0165(4) Uani 1 1 d .
H23 H 0.385091 0.166924 0.718743 0.020 Uiso 1 1 calc R
C9 C 0.2709(2) 0.88319(19) 0.77875(19) 0.0164(4) Uani 1 1 d .
H9 H 0.187438 0.914984 0.833224 0.020 Uiso 1 1 calc R
C15 C 0.7795(3) 0.4891(2) 1.0735(2) 0.0188(5) Uani 1 1 d .
H15 H 0.822809 0.447787 1.138830 0.023 Uiso 1 1 calc R
C4 C 0.0714(2) 1.1928(2) 0.27102(19) 0.0171(4) Uani 1 1 d .
H4 H 0.036407 1.232475 0.200595 0.021 Uiso 1 1 calc R
C6 C 0.2139(2) 1.01670(19) 0.38467(19) 0.0168(4) Uani 1 1 d .
H6 H 0.271495 0.941736 0.392048 0.020 Uiso 1 1 calc R
C13 C 0.5964(2) 0.6491(2) 0.99134(19) 0.0169(4) Uani 1 1 d .
H13 H 0.522575 0.714085 0.998634 0.020 Uiso 1 1 calc R
C5 C 0.1590(3) 1.07995(19) 0.2818(2) 0.0179(4) Uani 1 1 d .
H5 H 0.180736 1.046728 0.218117 0.022 Uiso 1 1 calc R
C14 C 0.6658(3) 0.5851(2) 1.0850(2) 0.0198(5) Uani 1 1 d .
H14 H 0.635865 0.606530 1.157892 0.024 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 0.0033 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'
Mn Mn 0.3368 0.7283 '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 Mn1 O1 71.25(6) . 2_766
O1 Mn1 O4 139.90(5) . .
O1 Mn1 N1 90.01(5) . 1_645
O1S Mn1 O1 147.26(6) . .
O1S Mn1 O1 76.22(5) . 2_766
O1S Mn1 O4 72.73(5) . .
O1S Mn1 N7 141.04(6) . .
O1S Mn1 N6 98.23(6) . .
O1S Mn1 N1 90.04(6) . 1_645
O4 Mn1 O1 148.84(5) . 2_766
N7 Mn1 O1 71.34(6) . .
N7 Mn1 O1 142.59(5) . 2_766
N7 Mn1 O4 68.57(6) . .
N7 Mn1 N6 86.36(6) . .
N7 Mn1 N1 83.21(6) . 1_645
N6 Mn1 O1 86.47(5) . .
N6 Mn1 O1 91.64(5) . 2_766
N6 Mn1 O4 90.19(5) . .
N6 Mn1 N1 169.57(7) . 1_645
N1 Mn1 O1 96.53(5) 1_645 2_766
N1 Mn1 O4 86.18(5) 1_645 .
Mn1 O1 Mn1 108.75(6) . 2_766
C19 O1 Mn1 118.00(12) . .
C19 O1 Mn1 132.97(12) . 2_766
Mn1 O1S H1SA 110.2 . .
Mn1 O1S H1SB 110.1 . .
H1SA O1S H1SB 108.8 . .
C24 O4 Mn1 119.35(13) . .
C21 N7 Mn1 121.99(13) . .
C20 N7 Mn1 118.64(13) . .
C20 N7 C21 119.36(18) . .
C17 N6 Mn1 132.28(12) . .
C18 N6 Mn1 122.66(13) . .
C18 N6 C17 105.05(16) . .
C8 N3 N4 118.62(16) . .
C7 N2 C8 130.13(16) . .
C1 N2 C7 106.34(16) . .
C1 N2 C8 123.41(17) . .
C2 N1 Mn1 140.13(13) . 1_465
C1 N1 Mn1 114.87(13) . 1_465
C1 N1 C2 104.77(16) . .
C11 N4 N3 119.55(16) . .
C12 N5 C11 129.52(16) . .
C18 N5 C12 106.39(16) . .
C18 N5 C11 124.08(16) . .
N7 C21 C24 114.48(18) . .
N7 C21 C22 122.17(19) . .
C22 C21 C24 123.31(18) . .
N6 C17 C12 109.90(17) . .
C16 C17 N6 129.30(17) . .
C16 C17 C12 120.78(18) . .
O1 C19 C20 116.81(17) . .
O2 C19 O1 126.18(19) . .
O2 C19 C20 117.01(19) . .
C7 C2 N1 109.88(17) . .
C3 C2 N1 130.04(18) . .
C3 C2 C7 120.08(18) . .
N7 C20 C19 114.85(18) . .
N7 C20 C00V 122.00(19) . .
C00V C20 C19 123.13(18) . .
O4 C24 C21 115.45(18) . .
O3 C24 O4 126.7(2) . .
O3 C24 C21 117.84(19) . .
C17 C12 N5 105.02(16) . .
C13 C12 N5 133.27(18) . .
C13 C12 C17 121.66(18) . .
C21 C22 H22 120.9 . .
C21 C22 C23 118.25(19) . .
C23 C22 H22 120.9 . .
N4 C11 N5 114.97(16) . .
N4 C11 C10 123.52(18) . .
C10 C11 N5 121.45(17) . .
N2 C7 C2 105.24(17) . .
C6 C7 N2 131.99(18) . .
C6 C7 C2 122.76(18) . .
N3 C8 N2 116.36(17) . .
N3 C8 C9 123.79(18) . .
C9 C8 N2 119.84(17) . .
C2 C3 H3 121.2 . .
C4 C3 C2 117.66(18) . .
C4 C3 H3 121.2 . .
N6 C18 N5 113.63(17) . .
N6 C18 H18 123.2 . .
N5 C18 H18 123.2 . .
C17 C16 H16 121.2 . .
C15 C16 C17 117.69(18) . .
C15 C16 H16 121.2 . .
N2 C1 H1 123.1 . .
N1 C1 N2 113.75(18) . .
N1 C1 H1 123.1 . .
C11 C10 H10 121.6 . .
C9 C10 C11 116.85(18) . .
C9 C10 H10 121.6 . .
C20 C00V H00V 120.7 . .
C20 C00V C23 118.63(19) . .
C23 C00V H00V 120.7 . .
C22 C23 C00V 119.6(2) . .
C22 C23 H23 120.2 . .
C00V C23 H23 120.2 . .
C8 C9 H9 121.3 . .
C10 C9 C8 117.38(18) . .
C10 C9 H9 121.3 . .
C16 C15 H15 119.5 . .
C16 C15 C14 121.01(19) . .
C14 C15 H15 119.5 . .
C3 C4 H4 119.3 . .
C3 C4 C5 121.36(19) . .
C5 C4 H4 119.3 . .
C7 C6 H6 121.8 . .
C5 C6 C7 116.32(18) . .
C5 C6 H6 121.8 . .
C12 C13 H13 121.6 . .
C14 C13 C12 116.81(19) . .
C14 C13 H13 121.6 . .
C4 C5 H5 119.1 . .
C6 C5 C4 121.81(19) . .
C6 C5 H5 119.1 . .
C15 C14 H14 119.0 . .
C13 C14 C15 122.00(19) . .
C13 C14 H14 119.0 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mn1 O1 2.2982(14) .
Mn1 O1 2.4382(15) 2_766
Mn1 O1S 2.1503(15) .
Mn1 O4 2.3921(15) .
Mn1 N7 2.2466(18) .
Mn1 N6 2.2856(16) .
Mn1 N1 2.3306(17) 1_645
O1 C19 1.276(3) .
O1S H1SA 0.8612 .
O1S H1SB 0.8615 .
O4 C24 1.260(3) .
O3 C24 1.248(2) .
O2 C19 1.246(2) .
N7 C21 1.342(3) .
N7 C20 1.338(3) .
N6 C17 1.402(2) .
N6 C18 1.311(2) .
N3 N4 1.347(2) .
N3 C8 1.323(2) .
N2 C7 1.393(2) .
N2 C8 1.418(2) .
N2 C1 1.373(3) .
N1 C2 1.403(3) .
N1 C1 1.307(2) .
N4 C11 1.323(2) .
N5 C12 1.403(2) .
N5 C11 1.415(2) .
N5 C18 1.370(2) .
C21 C24 1.516(3) .
C21 C22 1.385(3) .
C17 C12 1.402(3) .
C17 C16 1.393(3) .
C19 C20 1.509(3) .
C2 C7 1.401(3) .
C2 C3 1.398(3) .
C20 C00V 1.381(3) .
C12 C13 1.391(3) .
C22 H22 0.9300 .
C22 C23 1.387(3) .
C11 C10 1.397(3) .
C7 C6 1.389(3) .
C8 C9 1.395(3) .
C3 H3 0.9300 .
C3 C4 1.383(3) .
C18 H18 0.9300 .
C16 H16 0.9300 .
C16 C15 1.384(3) .
C1 H1 0.9300 .
C10 H10 0.9300 .
C10 C9 1.361(3) .
C00V H00V 0.9300 .
C00V C23 1.389(3) .
C23 H23 0.9300 .
C9 H9 0.9300 .
C15 H15 0.9300 .
C15 C14 1.399(3) .
C4 H4 0.9300 .
C4 C5 1.403(3) .
C6 H6 0.9300 .
C6 C5 1.385(3) .
C13 H13 0.9300 .
C13 C14 1.384(3) .
C5 H5 0.9300 .
C14 H14 0.9300 .
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
1 0.105 0.160 0.026 13.4 8.0
2 -0.105 0.840 -0.026 13.4 7.9
