#------------------------------------------------------------------------------
#$Date: 2016-12-18 16:16:23 +0200 (Sun, 18 Dec 2016) $
#$Revision: 189195 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/06/47/4064769.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_4064769
loop_
_publ_author_name
'Gao, Jing'
'Liu, Yanyan'
'Zhao, Yanxia'
'Yang, Xiao-Juan'
'Sui, Yunxia'
_publ_section_title
;
 Syntheses and Structures of Magnesium Complexes with Reduced α-Diimine
 Ligands
;
_journal_issue                   22
_journal_name_full               Organometallics
_journal_page_first              6071
_journal_paper_doi               10.1021/om2003199
_journal_volume                  30
_journal_year                    2011
_chemical_formula_sum            'C60 H88 Mg N4 O'
_chemical_formula_weight         905.65
_chemical_name_systematic        ?
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 125.462(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   13.4746(17)
_cell_length_b                   12.1227(15)
_cell_length_c                   20.8669(19)
_cell_measurement_temperature    293(2)
_cell_volume                     2776.3(6)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART APEX II'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  'Bruker APEX II area detector'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0461
_diffrn_reflns_av_sigmaI/netI    0.0493
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            17776
_diffrn_reflns_theta_full        24.77
_diffrn_reflns_theta_max         24.77
_diffrn_reflns_theta_min         1.68
_exptl_absorpt_coefficient_mu    0.074
_exptl_absorpt_correction_T_max  0.9854
_exptl_absorpt_correction_T_min  0.9818
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.083
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             992
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.518
_refine_diff_density_min         -0.271
_refine_diff_density_rms         0.047
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     309
_refine_ls_number_reflns         4726
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.034
_refine_ls_R_factor_all          0.1248
_refine_ls_R_factor_gt           0.0668
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1167P)²+1.0080P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1862
_refine_ls_wR_factor_ref         0.2294
_reflns_number_gt                2663
_reflns_number_total             4726
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om2003199_si_002.cif
_cod_data_source_block           MgiPrL2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P2/c
_cod_database_code               4064769
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_attached_hydrogens
Mg1 Mg 0.0000 0.69935(11) 0.7500 0.0424(4) Uani 1 2 d S 0
N1 N 0.1667(2) 0.6249(2) 0.83141(13) 0.0436(6) Uani 1 1 d . 0
N2 N 0.0223(2) 0.7530(2) 0.85296(14) 0.0507(7) Uani 1 1 d . 0
C1 C 0.1810(3) 0.6208(3) 0.90136(17) 0.0461(8) Uani 1 1 d . 0
C2 C 0.1117(3) 0.6910(3) 0.91442(17) 0.0478(8) Uani 1 1 d . 0
C3 C 0.2699(3) 0.5428(3) 0.9653(2) 0.0713(11) Uani 1 1 d . 0
H3A H 0.3026 0.4942 0.9455 0.107 Uiso 1 1 calc R 0
H3B H 0.2290 0.5002 0.9822 0.107 Uiso 1 1 calc R 0
H3C H 0.3349 0.5840 1.0089 0.107 Uiso 1 1 calc R 0
C4 C 0.1380(4) 0.6974(4) 0.9949(2) 0.0810(13) Uani 1 1 d . 0
H4A H 0.1011 0.7626 0.9985 0.121 Uiso 1 1 calc R 0
H4B H 0.2246 0.7003 1.0339 0.121 Uiso 1 1 calc R 0
H4C H 0.1053 0.6335 1.0036 0.121 Uiso 1 1 calc R 0
C5 C 0.2650(3) 0.5852(3) 0.82981(17) 0.0478(8) Uani 1 1 d . 0
C6 C 0.3804(3) 0.6376(3) 0.8755(2) 0.0567(9) Uani 1 1 d . 0
C7 C 0.4734(3) 0.5980(4) 0.8714(2) 0.0715(11) Uani 1 1 d . 0
H7 H 0.5498 0.6310 0.9024 0.086 Uiso 1 1 calc R 0
C8 C 0.4565(4) 0.5120(4) 0.8232(3) 0.0781(12) Uani 1 1 d . 0
H8 H 0.5201 0.4873 0.8214 0.094 Uiso 1 1 calc R 0
C9 C 0.3440(4) 0.4634(3) 0.7779(2) 0.0716(11) Uani 1 1 d . 0
H9 H 0.3316 0.4060 0.7444 0.086 Uiso 1 1 calc R 0
C10 C 0.2474(3) 0.4974(3) 0.78044(19) 0.0567(9) Uani 1 1 d . 0
C11 C 0.4076(3) 0.7370(3) 0.9271(2) 0.0657(10) Uani 1 1 d . 0
H11 H 0.3383 0.7475 0.9301 0.079 Uiso 1 1 calc R 0
C12 C 0.4187(5) 0.8407(4) 0.8899(3) 0.0978(15) Uani 1 1 d . 0
H12A H 0.4825 0.8307 0.8829 0.147 Uiso 1 1 calc R 0
H12B H 0.4376 0.9028 0.9238 0.147 Uiso 1 1 calc R 0
H12C H 0.3430 0.8538 0.8398 0.147 Uiso 1 1 calc R 0
C13 C 0.5223(4) 0.7233(5) 1.0114(3) 0.1041(16) Uani 1 1 d . 0
H13A H 0.5165 0.6563 1.0335 0.156 Uiso 1 1 calc R 0
H13B H 0.5294 0.7849 1.0428 0.156 Uiso 1 1 calc R 0
H13C H 0.5928 0.7203 1.0106 0.156 Uiso 1 1 calc R 0
C14 C 0.1303(4) 0.4312(3) 0.7350(2) 0.0721(11) Uani 1 1 d . 0
H14 H 0.0712 0.4694 0.7401 0.087 Uiso 1 1 calc R 0
C15 C 0.0744(5) 0.4219(5) 0.6477(3) 0.1155(18) Uani 1 1 d . 0
H15A H 0.1332 0.3913 0.6407 0.173 Uiso 1 1 calc R 0
H15B H 0.0504 0.4937 0.6241 0.173 Uiso 1 1 calc R 0
H15C H 0.0042 0.3747 0.6232 0.173 Uiso 1 1 calc R 0
C16 C 0.1504(6) 0.3167(5) 0.7710(4) 0.138(2) Uani 1 1 d . 0
H16A H 0.2105 0.2780 0.7688 0.207 Uiso 1 1 calc R 0
H16B H 0.0751 0.2763 0.7421 0.207 Uiso 1 1 calc R 0
H16C H 0.1781 0.3237 0.8249 0.207 Uiso 1 1 calc R 0
C17 C -0.0220(3) 0.8501(3) 0.86871(17) 0.0499(8) Uani 1 1 d . 0
C18 C 0.0419(3) 0.9493(3) 0.88317(19) 0.0578(9) Uani 1 1 d . 0
C19 C -0.0035(4) 1.0447(3) 0.8931(2) 0.0763(12) Uani 1 1 d . 0
H19 H 0.0380 1.1107 0.9025 0.092 Uiso 1 1 calc R 0
C20 C -0.1079(4) 1.0443(4) 0.8895(3) 0.0865(14) Uani 1 1 d . 0
H20 H -0.1377 1.1097 0.8956 0.104 Uiso 1 1 calc R 0
C21 C -0.1687(4) 0.9470(4) 0.8769(2) 0.0783(12) Uani 1 1 d . 0
H21 H -0.2389 0.9475 0.8756 0.094 Uiso 1 1 calc R 0
C22 C -0.1289(3) 0.8479(3) 0.8662(2) 0.0590(9) Uani 1 1 d . 0
C23 C 0.1627(3) 0.9541(3) 0.8933(2) 0.0681(10) Uani 1 1 d . 0
H23 H 0.1744 0.8818 0.8776 0.082 Uiso 1 1 calc R 0
C24 C 0.2669(4) 0.9694(6) 0.9792(3) 0.121(2) Uani 1 1 d . 0
H24A H 0.2588 1.0394 0.9972 0.182 Uiso 1 1 calc R 0
H24B H 0.3430 0.9670 0.9850 0.182 Uiso 1 1 calc R 0
H24C H 0.2650 0.9114 1.0098 0.182 Uiso 1 1 calc R 0
C25 C 0.1667(5) 1.0383(5) 0.8415(4) 0.127(2) Uani 1 1 d . 0
H25A H 0.1075 1.0196 0.7873 0.191 Uiso 1 1 calc R 0
H25B H 0.2465 1.0388 0.8525 0.191 Uiso 1 1 calc R 0
H25C H 0.1488 1.1101 0.8518 0.191 Uiso 1 1 calc R 0
C26 C -0.1980(4) 0.7430(4) 0.8552(3) 0.0861(13) Uani 1 1 d . 0
H26 H -0.1788 0.6884 0.8293 0.103 Uiso 1 1 calc R 0
C27 C -0.3341(5) 0.7580(5) 0.8063(3) 0.126(2) Uani 1 1 d . 0
H27A H -0.3552 0.8054 0.8335 0.189 Uiso 1 1 calc R 0
H27B H -0.3726 0.6875 0.7975 0.189 Uiso 1 1 calc R 0
H27C H -0.3613 0.7905 0.7567 0.189 Uiso 1 1 calc R 0
C28 C -0.1637(6) 0.6945(7) 0.9331(5) 0.189(4) Uani 1 1 d . 0
H28A H -0.0789 0.6748 0.9648 0.284 Uiso 1 1 calc R 0
H28B H -0.2121 0.6300 0.9231 0.284 Uiso 1 1 calc R 0
H28C H -0.1784 0.7482 0.9605 0.284 Uiso 1 1 calc R 0
O1 O 0.5000 0.7619(13) 0.2500 0.61(3) Uani 1 2 d S 0
C29 C 0.5234(18) 0.8131(13) 0.3123(7) 0.296(9) Uani 1 1 d . 2
C30 C 0.4777(13) 0.9131(12) 0.2790(6) 0.264(7) Uani 1 1 d . 2
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'
Mg Mg 0.0486 0.0363 '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
N1 Mg1 N1 128.53(15) 2_556 .
N1 Mg1 N2 81.53(9) 2_556 2_556
N1 Mg1 N2 114.67(10) . 2_556
N1 Mg1 N2 114.67(10) 2_556 .
N1 Mg1 N2 81.52(9) . .
N2 Mg1 N2 143.78(16) 2_556 .
N1 Mg1 C1 126.40(10) 2_556 .
N1 Mg1 C1 27.41(10) . .
N2 Mg1 C1 140.67(10) 2_556 .
N2 Mg1 C1 55.75(9) . .
N1 Mg1 C1 27.41(10) 2_556 2_556
N1 Mg1 C1 126.40(10) . 2_556
N2 Mg1 C1 55.75(9) 2_556 2_556
N2 Mg1 C1 140.67(10) . 2_556
C1 Mg1 C1 140.38(14) . 2_556
N1 Mg1 C2 55.45(9) 2_556 2_556
N1 Mg1 C2 122.42(10) . 2_556
N2 Mg1 C2 27.19(9) 2_556 2_556
N2 Mg1 C2 155.74(10) . 2_556
C1 Mg1 C2 148.50(10) . 2_556
C1 Mg1 C2 28.74(9) 2_556 2_556
N1 Mg1 C2 122.42(10) 2_556 .
N1 Mg1 C2 55.45(9) . .
N2 Mg1 C2 155.74(10) 2_556 .
N2 Mg1 C2 27.19(9) . .
C1 Mg1 C2 28.74(9) . .
C1 Mg1 C2 148.50(10) 2_556 .
C2 Mg1 C2 175.90(14) 2_556 .
C1 N1 C5 117.3(2) . .
C1 N1 Mg1 107.81(19) . .
C5 N1 Mg1 134.82(19) . .
C2 N2 C17 119.4(2) . .
C2 N2 Mg1 108.41(19) . .
C17 N2 Mg1 131.00(19) . .
N1 C1 C2 119.5(3) . .
N1 C1 C3 121.3(3) . .
C2 C1 C3 119.2(3) . .
N1 C1 Mg1 44.78(13) . .
C2 C1 Mg1 76.79(17) . .
C3 C1 Mg1 159.5(2) . .
N2 C2 C1 118.4(3) . .
N2 C2 C4 121.9(3) . .
C1 C2 C4 119.8(3) . .
N2 C2 Mg1 44.40(14) . .
C1 C2 Mg1 74.47(17) . .
C4 C2 Mg1 164.7(2) . .
C1 C3 H3A 109.5 . .
C1 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
C1 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
C2 C4 H4A 109.5 . .
C2 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
C2 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
C10 C5 C6 119.0(3) . .
C10 C5 N1 120.7(3) . .
C6 C5 N1 120.3(3) . .
C7 C6 C5 118.8(3) . .
C7 C6 C11 117.6(3) . .
C5 C6 C11 123.6(3) . .
C8 C7 C6 122.3(4) . .
C8 C7 H7 118.8 . .
C6 C7 H7 118.8 . .
C9 C8 C7 118.6(4) . .
C9 C8 H8 120.7 . .
C7 C8 H8 120.7 . .
C8 C9 C10 122.0(4) . .
C8 C9 H9 119.0 . .
C10 C9 H9 119.0 . .
C9 C10 C5 119.3(3) . .
C9 C10 C14 118.3(3) . .
C5 C10 C14 122.2(3) . .
C6 C11 C12 110.4(3) . .
C6 C11 C13 113.4(3) . .
C12 C11 C13 109.9(4) . .
C6 C11 H11 107.7 . .
C12 C11 H11 107.7 . .
C13 C11 H11 107.7 . .
C11 C12 H12A 109.5 . .
C11 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C11 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C11 C13 H13A 109.5 . .
C11 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C11 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C10 C14 C15 113.8(4) . .
C10 C14 C16 110.5(4) . .
C15 C14 C16 110.2(4) . .
C10 C14 H14 107.3 . .
C15 C14 H14 107.3 . .
C16 C14 H14 107.3 . .
C14 C15 H15A 109.5 . .
C14 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C14 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
C14 C16 H16A 109.5 . .
C14 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C14 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C18 C17 C22 120.6(3) . .
C18 C17 N2 117.7(3) . .
C22 C17 N2 121.7(3) . .
C19 C18 C17 118.7(4) . .
C19 C18 C23 118.7(3) . .
C17 C18 C23 122.5(3) . .
C20 C19 C18 121.5(4) . .
C20 C19 H19 119.3 . .
C18 C19 H19 119.3 . .
C19 C20 C21 119.7(4) . .
C19 C20 H20 120.2 . .
C21 C20 H20 120.2 . .
C20 C21 C22 122.1(4) . .
C20 C21 H21 118.9 . .
C22 C21 H21 118.9 . .
C21 C22 C17 117.5(4) . .
C21 C22 C26 119.4(4) . .
C17 C22 C26 123.1(3) . .
C25 C23 C24 111.8(4) . .
C25 C23 C18 114.1(4) . .
C24 C23 C18 110.6(4) . .
C25 C23 H23 106.6 . .
C24 C23 H23 106.6 . .
C18 C23 H23 106.6 . .
C23 C24 H24A 109.5 . .
C23 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C23 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
C23 C25 H25A 109.5 . .
C23 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
C23 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
C27 C26 C22 113.7(4) . .
C27 C26 C28 105.4(4) . .
C22 C26 C28 112.6(4) . .
C27 C26 H26 108.3 . .
C22 C26 H26 108.3 . .
C28 C26 H26 108.3 . .
C26 C27 H27A 109.5 . .
C26 C27 H27B 109.5 . .
H27A C27 H27B 109.5 . .
C26 C27 H27C 109.5 . .
H27A C27 H27C 109.5 . .
H27B C27 H27C 109.5 . .
C26 C28 H28A 109.5 . .
C26 C28 H28B 109.5 . .
H28A C28 H28B 109.5 . .
C26 C28 H28C 109.5 . .
H28A C28 H28C 109.5 . .
H28B C28 H28C 109.5 . .
C29 O1 C29 123.1(19) . 2_655
O1 C29 C30 98.1(12) . .
C29 C30 C30 97.2(11) . 2_655
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mg1 N1 2.078(2) 2_556
Mg1 N1 2.078(2) .
Mg1 N2 2.093(3) 2_556
Mg1 N2 2.093(3) .
Mg1 C1 2.809(3) .
Mg1 C1 2.809(3) 2_556
Mg1 C2 2.838(3) 2_556
Mg1 C2 2.838(3) .
N1 C1 1.358(4) .
N1 C5 1.427(4) .
N2 C2 1.367(4) .
N2 C17 1.441(4) .
C1 C2 1.402(4) .
C1 C3 1.502(4) .
C2 C4 1.503(4) .
C3 H3A 0.9600 .
C3 H3B 0.9600 .
C3 H3C 0.9600 .
C4 H4A 0.9600 .
C4 H4B 0.9600 .
C4 H4C 0.9600 .
C5 C10 1.402(5) .
C5 C6 1.418(5) .
C6 C7 1.389(5) .
C6 C11 1.513(5) .
C7 C8 1.373(6) .
C7 H7 0.9300 .
C8 C9 1.369(6) .
C8 H8 0.9300 .
C9 C10 1.395(5) .
C9 H9 0.9300 .
C10 C14 1.516(5) .
C11 C12 1.530(6) .
C11 C13 1.535(6) .
C11 H11 0.9800 .
C12 H12A 0.9600 .
C12 H12B 0.9600 .
C12 H12C 0.9600 .
C13 H13A 0.9600 .
C13 H13B 0.9600 .
C13 H13C 0.9600 .
C14 C15 1.517(6) .
C14 C16 1.528(7) .
C14 H14 0.9800 .
C15 H15A 0.9600 .
C15 H15B 0.9600 .
C15 H15C 0.9600 .
C16 H16A 0.9600 .
C16 H16B 0.9600 .
C16 H16C 0.9600 .
C17 C18 1.406(5) .
C17 C22 1.411(5) .
C18 C19 1.379(5) .
C18 C23 1.517(5) .
C19 C20 1.365(6) .
C19 H19 0.9300 .
C20 C21 1.373(6) .
C20 H20 0.9300 .
C21 C22 1.385(5) .
C21 H21 0.9300 .
C22 C26 1.513(5) .
C23 C25 1.510(6) .
C23 C24 1.516(6) .
C23 H23 0.9800 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
C25 H25A 0.9600 .
C25 H25B 0.9600 .
C25 H25C 0.9600 .
C26 C27 1.506(7) .
C26 C28 1.526(8) .
C26 H26 0.9800 .
C27 H27A 0.9600 .
C27 H27B 0.9600 .
C27 H27C 0.9600 .
C28 H28A 0.9600 .
C28 H28B 0.9600 .
C28 H28C 0.9600 .
O1 C29 1.303(14) .
O1 C29 1.303(14) 2_655
C29 C30 1.355(15) .
C30 C30 1.64(2) 2_655
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_4
N1 Mg1 N1 C1 -96.4(2) 2_556 .
N2 Mg1 N1 C1 164.44(19) 2_556 .
N2 Mg1 N1 C1 18.4(2) . .
C1 Mg1 N1 C1 -131.1(2) 2_556 .
C2 Mg1 N1 C1 -165.77(19) 2_556 .
C2 Mg1 N1 C1 10.04(18) . .
N1 Mg1 N1 C5 87.2(3) 2_556 .
N2 Mg1 N1 C5 -11.9(3) 2_556 .
N2 Mg1 N1 C5 -157.9(3) . .
C1 Mg1 N1 C5 -176.4(4) . .
C1 Mg1 N1 C5 52.6(3) 2_556 .
C2 Mg1 N1 C5 17.9(3) 2_556 .
C2 Mg1 N1 C5 -166.3(3) . .
N1 Mg1 N2 C2 113.4(2) 2_556 .
N1 Mg1 N2 C2 -15.3(2) . .
N2 Mg1 N2 C2 -136.0(2) 2_556 .
C1 Mg1 N2 C2 -5.11(19) . .
C1 Mg1 N2 C2 124.6(2) 2_556 .
C2 Mg1 N2 C2 173.4(2) 2_556 .
N1 Mg1 N2 C17 -79.3(3) 2_556 .
N1 Mg1 N2 C17 152.0(3) . .
N2 Mg1 N2 C17 31.3(3) 2_556 .
C1 Mg1 N2 C17 162.2(3) . .
C1 Mg1 N2 C17 -68.1(4) 2_556 .
C2 Mg1 N2 C17 -19.3(5) 2_556 .
C2 Mg1 N2 C17 167.3(4) . .
C5 N1 C1 C2 157.6(3) . .
Mg1 N1 C1 C2 -19.5(3) . .
C5 N1 C1 C3 -22.2(4) . .
Mg1 N1 C1 C3 160.7(3) . .
C5 N1 C1 Mg1 177.1(3) . .
N1 Mg1 C1 N1 105.0(3) 2_556 .
N2 Mg1 C1 N1 -22.6(3) 2_556 .
N2 Mg1 C1 N1 -157.8(2) . .
C1 Mg1 C1 N1 72.06(19) 2_556 .
C2 Mg1 C1 N1 23.4(3) 2_556 .
C2 Mg1 C1 N1 -162.6(3) . .
N1 Mg1 C1 C2 -92.3(2) 2_556 .
N1 Mg1 C1 C2 162.6(3) . .
N2 Mg1 C1 C2 140.0(2) 2_556 .
N2 Mg1 C1 C2 4.86(18) . .
C1 Mg1 C1 C2 -125.30(19) 2_556 .
C2 Mg1 C1 C2 -174.0(2) 2_556 .
N1 Mg1 C1 C3 51.2(7) 2_556 .
N1 Mg1 C1 C3 -53.8(7) . .
N2 Mg1 C1 C3 -76.4(7) 2_556 .
N2 Mg1 C1 C3 148.4(7) . .
C1 Mg1 C1 C3 18.2(7) 2_556 .
C2 Mg1 C1 C3 -30.4(8) 2_556 .
C2 Mg1 C1 C3 143.5(8) . .
C17 N2 C2 C1 -159.3(3) . .
Mg1 N2 C2 C1 9.7(4) . .
C17 N2 C2 C4 19.8(5) . .
Mg1 N2 C2 C4 -171.2(3) . .
C17 N2 C2 Mg1 -169.0(4) . .
N1 C1 C2 N2 7.0(5) . .
C3 C1 C2 N2 -173.2(3) . .
Mg1 C1 C2 N2 -7.0(3) . .
N1 C1 C2 C4 -172.2(3) . .
C3 C1 C2 C4 7.6(5) . .
Mg1 C1 C2 C4 173.8(3) . .
N1 C1 C2 Mg1 14.0(2) . .
C3 C1 C2 Mg1 -166.2(3) . .
N1 Mg1 C2 N2 -81.1(2) 2_556 .
N1 Mg1 C2 N2 161.6(3) . .
N2 Mg1 C2 N2 88.7(4) 2_556 .
C1 Mg1 C2 N2 171.2(3) . .
C1 Mg1 C2 N2 -93.6(3) 2_556 .
C2 Mg1 C2 N2 -138.6(2) 2_556 .
N1 Mg1 C2 C1 107.7(2) 2_556 .
N1 Mg1 C2 C1 -9.60(18) . .
N2 Mg1 C2 C1 -82.5(3) 2_556 .
N2 Mg1 C2 C1 -171.2(3) . .
C1 Mg1 C2 C1 95.2(3) 2_556 .
C2 Mg1 C2 C1 50.20(18) 2_556 .
N1 Mg1 C2 C4 -51.6(11) 2_556 .
N1 Mg1 C2 C4 -168.9(11) . .
N2 Mg1 C2 C4 118.2(10) 2_556 .
N2 Mg1 C2 C4 29.5(10) . .
C1 Mg1 C2 C4 -159.3(11) . .
C1 Mg1 C2 C4 -64.2(11) 2_556 .
C2 Mg1 C2 C4 -109.1(10) 2_556 .
C1 N1 C5 C10 120.4(3) . .
Mg1 N1 C5 C10 -63.5(4) . .
C1 N1 C5 C6 -62.6(4) . .
Mg1 N1 C5 C6 113.5(3) . .
C10 C5 C6 C7 -1.8(5) . .
N1 C5 C6 C7 -178.8(3) . .
C10 C5 C6 C11 176.3(3) . .
N1 C5 C6 C11 -0.7(5) . .
C5 C6 C7 C8 1.7(6) . .
C11 C6 C7 C8 -176.5(4) . .
C6 C7 C8 C9 -0.3(6) . .
C7 C8 C9 C10 -1.1(6) . .
C8 C9 C10 C5 1.0(6) . .
C8 C9 C10 C14 -173.6(4) . .
C6 C5 C10 C9 0.4(5) . .
N1 C5 C10 C9 177.5(3) . .
C6 C5 C10 C14 174.9(3) . .
N1 C5 C10 C14 -8.1(5) . .
C7 C6 C11 C12 71.3(4) . .
C5 C6 C11 C12 -106.9(4) . .
C7 C6 C11 C13 -52.4(5) . .
C5 C6 C11 C13 129.4(4) . .
C9 C10 C14 C15 -57.4(5) . .
C5 C10 C14 C15 128.1(4) . .
C9 C10 C14 C16 67.2(5) . .
C5 C10 C14 C16 -107.2(5) . .
C2 N2 C17 C18 85.9(4) . .
Mg1 N2 C17 C18 -80.2(4) . .
C2 N2 C17 C22 -97.1(4) . .
Mg1 N2 C17 C22 96.8(4) . .
C22 C17 C18 C19 -1.4(5) . .
N2 C17 C18 C19 175.7(3) . .
C22 C17 C18 C23 174.7(3) . .
N2 C17 C18 C23 -8.2(5) . .
C17 C18 C19 C20 0.2(6) . .
C23 C18 C19 C20 -176.0(4) . .
C18 C19 C20 C21 1.0(7) . .
C19 C20 C21 C22 -1.2(7) . .
C20 C21 C22 C17 0.1(6) . .
C20 C21 C22 C26 178.0(4) . .
C18 C17 C22 C21 1.2(5) . .
N2 C17 C22 C21 -175.8(3) . .
C18 C17 C22 C26 -176.6(4) . .
N2 C17 C22 C26 6.4(5) . .
C19 C18 C23 C25 -55.6(5) . .
C17 C18 C23 C25 128.3(4) . .
C19 C18 C23 C24 71.3(5) . .
C17 C18 C23 C24 -104.7(5) . .
C21 C22 C26 C27 38.4(6) . .
C17 C22 C26 C27 -143.9(4) . .
C21 C22 C26 C28 -81.4(6) . .
C17 C22 C26 C28 96.4(6) . .
C29 O1 C29 C30 18.0(9) 2_655 .
O1 C29 C30 C30 -37.8(16) . 2_655
