#------------------------------------------------------------------------------
#$Date: 2016-03-25 22:57:40 +0200 (Fri, 25 Mar 2016) $
#$Revision: 180020 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/14/7031475.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_7031475
loop_
_publ_author_name
'Francos, J.'
'Fleming, B. J.'
'García-Álvarez, P'
'Kennedy, A. R.'
'Reilly, K.'
'Robertson, G. M.'
'Robertson, S. D.'
'O'Hara, C T'
_publ_section_title
;
 Complexity in seemingly simple sodium magnesiate systems.
;
_journal_issue                   38
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              14424
_journal_page_last               14431
_journal_paper_doi               10.1039/c4dt00921e
_journal_volume                  43
_journal_year                    2014
_chemical_formula_sum            'C30 H83 Mg N7 Na Si6'
_chemical_formula_weight         757.87
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                94.913(7)
_cell_angle_beta                 99.478(7)
_cell_angle_gamma                103.922(8)
_cell_formula_units_Z            2
_cell_length_a                   11.8176(10)
_cell_length_b                   11.9680(11)
_cell_length_c                   18.4164(16)
_cell_measurement_reflns_used    6004
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      31.3125
_cell_measurement_theta_min      2.8284
_cell_volume                     2472.2(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Oxford Diffraction Gemini S'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0438
_diffrn_reflns_av_sigmaI/netI    0.1140
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            24497
_diffrn_reflns_theta_full        29.00
_diffrn_reflns_theta_max         29.00
_diffrn_reflns_theta_min         2.83
_exptl_absorpt_coefficient_mu    0.216
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.98745
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
(compiled Jan  5 2010,16:28:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.018
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       fragment
_exptl_crystal_F_000             838
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.585
_refine_diff_density_min         -0.296
_refine_diff_density_rms         0.056
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.864
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     454
_refine_ls_number_reflns         13120
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.864
_refine_ls_R_factor_all          0.0927
_refine_ls_R_factor_gt           0.0467
_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)+(0.0408P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0944
_refine_ls_wR_factor_ref         0.1015
_reflns_number_gt                7499
_reflns_number_total             13120
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c4dt00921e2.cif
_cod_data_source_block           pgagem40
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'TRICLINIC' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 7031474--7031478.cif.
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7031475
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Mg1 Mg 0.45390(5) 0.54410(5) 0.24328(3) 0.01730(15) Uani 1 1 d . . .
Na1 Na 0.0000 0.0000 0.0000 0.0496(4) Uani 1 2 d S . .
Na2 Na 0.0000 0.0000 0.5000 0.0335(3) Uani 1 2 d S . .
Si1 Si 0.49558(5) 0.30828(5) 0.29650(3) 0.02437(14) Uani 1 1 d . . .
Si2 Si 0.69700(5) 0.46704(5) 0.24776(3) 0.02355(14) Uani 1 1 d . . .
Si3 Si 0.57459(5) 0.75505(5) 0.37415(3) 0.02257(14) Uani 1 1 d . . .
Si4 Si 0.49525(5) 0.81347(5) 0.22329(3) 0.02295(14) Uani 1 1 d . . .
Si5 Si 0.27183(5) 0.42737(5) 0.09120(3) 0.02451(14) Uani 1 1 d . . .
Si6 Si 0.17000(5) 0.49600(5) 0.22152(3) 0.02128(13) Uani 1 1 d . . .
N1 N 0.55755(13) 0.43535(14) 0.26668(9) 0.0199(4) Uani 1 1 d . . .
N2 N 0.51556(13) 0.71511(14) 0.28245(9) 0.0199(4) Uani 1 1 d . . .
N3 N 0.28759(13) 0.48470(14) 0.18133(8) 0.0188(4) Uani 1 1 d . . .
N4 N -0.19005(17) 0.05091(18) 0.02454(11) 0.0378(5) Uani 1 1 d . B .
N5 N -0.02020(16) -0.05112(17) 0.12534(10) 0.0325(4) Uani 1 1 d . . .
N6 N -0.01557(15) 0.19168(15) 0.44734(10) 0.0267(4) Uani 1 1 d . . .
N7 N -0.12235(14) 0.08648(15) 0.57287(9) 0.0245(4) Uani 1 1 d . . .
C1 C 0.37146(19) 0.3209(2) 0.34565(14) 0.0390(6) Uani 1 1 d . . .
H1A H 0.4022 0.3800 0.3893 0.058 Uiso 1 1 calc R . .
H1B H 0.3374 0.2460 0.3614 0.058 Uiso 1 1 calc R . .
H1C H 0.3099 0.3434 0.3119 0.058 Uiso 1 1 calc R . .
C2 C 0.4268(2) 0.18691(19) 0.21898(14) 0.0418(6) Uani 1 1 d . . .
H2A H 0.3605 0.2055 0.1872 0.063 Uiso 1 1 calc R . .
H2B H 0.3974 0.1150 0.2396 0.063 Uiso 1 1 calc R . .
H2C H 0.4864 0.1767 0.1896 0.063 Uiso 1 1 calc R . .
C3 C 0.60103(19) 0.2552(2) 0.36513(13) 0.0363(6) Uani 1 1 d . . .
H3A H 0.6654 0.2398 0.3416 0.054 Uiso 1 1 calc R . .
H3B H 0.5581 0.1836 0.3810 0.054 Uiso 1 1 calc R . .
H3C H 0.6345 0.3146 0.4084 0.054 Uiso 1 1 calc R . .
C4 C 0.7270(2) 0.3453(2) 0.18847(13) 0.0389(6) Uani 1 1 d . . .
H4A H 0.7208 0.2771 0.2150 0.058 Uiso 1 1 calc R . .
H4B H 0.8072 0.3699 0.1778 0.058 Uiso 1 1 calc R . .
H4C H 0.6688 0.3255 0.1418 0.058 Uiso 1 1 calc R . .
C5 C 0.72518(19) 0.59607(19) 0.19652(13) 0.0334(6) Uani 1 1 d . . .
H5A H 0.6700 0.5793 0.1486 0.050 Uiso 1 1 calc R . .
H5B H 0.8070 0.6135 0.1881 0.050 Uiso 1 1 calc R . .
H5C H 0.7133 0.6631 0.2259 0.050 Uiso 1 1 calc R . .
C6 C 0.81740(18) 0.5050(2) 0.33361(13) 0.0361(6) Uani 1 1 d . . .
H6A H 0.8044 0.5675 0.3666 0.054 Uiso 1 1 calc R . .
H6B H 0.8950 0.5308 0.3194 0.054 Uiso 1 1 calc R . .
H6C H 0.8154 0.4365 0.3594 0.054 Uiso 1 1 calc R . .
C7 C 0.73991(17) 0.82420(19) 0.39201(13) 0.0321(5) Uani 1 1 d . . .
H7A H 0.7796 0.7717 0.3687 0.048 Uiso 1 1 calc R . .
H7B H 0.7708 0.8391 0.4456 0.048 Uiso 1 1 calc R . .
H7C H 0.7550 0.8976 0.3710 0.048 Uiso 1 1 calc R . .
C8 C 0.5058(2) 0.8616(2) 0.42040(13) 0.0401(6) Uani 1 1 d . . .
H8A H 0.5251 0.9353 0.3999 0.060 Uiso 1 1 calc R . .
H8B H 0.5372 0.8747 0.4740 0.060 Uiso 1 1 calc R . .
H8C H 0.4194 0.8303 0.4113 0.060 Uiso 1 1 calc R . .
C9 C 0.5561(2) 0.6291(2) 0.42823(12) 0.0355(6) Uani 1 1 d . . .
H9A H 0.4715 0.5962 0.4275 0.053 Uiso 1 1 calc R . .
H9B H 0.5981 0.6551 0.4797 0.053 Uiso 1 1 calc R . .
H9C H 0.5891 0.5697 0.4059 0.053 Uiso 1 1 calc R . .
C10 C 0.5031(2) 0.7603(2) 0.12405(13) 0.0413(6) Uani 1 1 d . . .
C11 C 0.34749(18) 0.8474(2) 0.21789(14) 0.0381(6) Uani 1 1 d . . .
H11A H 0.2839 0.7759 0.2013 0.057 Uiso 1 1 calc R . .
H11B H 0.3403 0.9032 0.1825 0.057 Uiso 1 1 calc R . .
H11C H 0.3410 0.8809 0.2670 0.057 Uiso 1 1 calc R . .
C12 C 0.60961(18) 0.95753(18) 0.24734(13) 0.0328(5) Uani 1 1 d . . .
H12A H 0.6069 0.9930 0.2968 0.049 Uiso 1 1 calc R . .
H12B H 0.5927 1.0089 0.2106 0.049 Uiso 1 1 calc R . .
H12C H 0.6888 0.9457 0.2471 0.049 Uiso 1 1 calc R . .
C13 C 0.41635(19) 0.4098(2) 0.06971(12) 0.0321(5) Uani 1 1 d . . .
H13A H 0.4729 0.4862 0.0755 0.048 Uiso 1 1 calc R . .
H13B H 0.4037 0.3725 0.0185 0.048 Uiso 1 1 calc R . .
H13C H 0.4482 0.3614 0.1038 0.048 Uiso 1 1 calc R . .
C14 C 0.2144(2) 0.5153(2) 0.02029(13) 0.0515(7) Uani 1 1 d . . .
H14A H 0.1320 0.5142 0.0230 0.077 Uiso 1 1 calc R . .
H14B H 0.2178 0.4818 -0.0295 0.077 Uiso 1 1 calc R . .
H14C H 0.2635 0.5956 0.0306 0.077 Uiso 1 1 calc R . .
C15 C 0.1656(2) 0.2777(2) 0.06697(13) 0.0400(6) Uani 1 1 d . . .
H15A H 0.1898 0.2265 0.1018 0.060 Uiso 1 1 calc R . .
H15B H 0.1669 0.2460 0.0163 0.060 Uiso 1 1 calc R . .
H15C H 0.0850 0.2829 0.0702 0.060 Uiso 1 1 calc R . .
C16 C 0.06998(19) 0.35283(19) 0.23343(13) 0.0321(5) Uani 1 1 d . . .
H16A H 0.0270 0.3119 0.1846 0.048 Uiso 1 1 calc R . .
H16B H 0.0130 0.3668 0.2640 0.048 Uiso 1 1 calc R . .
H16C H 0.1180 0.3054 0.2579 0.048 Uiso 1 1 calc R . .
C17 C 0.06566(19) 0.5687(2) 0.16773(14) 0.0392(6) Uani 1 1 d . . .
H17A H 0.1111 0.6413 0.1543 0.059 Uiso 1 1 calc R . .
H17B H 0.0098 0.5857 0.1983 0.059 Uiso 1 1 calc R . .
H17C H 0.0215 0.5172 0.1225 0.059 Uiso 1 1 calc R . .
C18 C 0.22060(18) 0.57853(19) 0.31751(12) 0.0309(5) Uani 1 1 d . . .
H18A H 0.2681 0.5377 0.3488 0.046 Uiso 1 1 calc R . .
H18B H 0.1512 0.5844 0.3388 0.046 Uiso 1 1 calc R . .
H18C H 0.2689 0.6566 0.3150 0.046 Uiso 1 1 calc R . .
C19 C -0.2961(3) -0.0282(3) -0.02080(18) 0.0668(9) Uani 1 1 d . . .
H19A H -0.2962 -0.1083 -0.0132 0.100 Uiso 1 1 calc R . .
H19B H -0.2967 -0.0193 -0.0733 0.100 Uiso 1 1 calc R . .
H19C H -0.3667 -0.0105 -0.0065 0.100 Uiso 1 1 calc R . .
C20 C -0.1946(2) 0.1700(2) 0.01207(15) 0.0448(7) Uani 1 1 d . . .
H20A H -0.2664 0.1853 0.0263 0.067 Uiso 1 1 calc R . .
H20B H -0.1962 0.1782 -0.0405 0.067 Uiso 1 1 calc R . .
H20C H -0.1243 0.2256 0.0422 0.067 Uiso 1 1 calc R . .
C21 C -0.1857(3) 0.0414(3) 0.10364(16) 0.0634(9) Uani 1 1 d . . .
H21A H -0.2668 0.0326 0.1138 0.076 Uiso 1 1 calc R A 1
H21B H -0.1351 0.1153 0.1323 0.076 Uiso 1 1 calc R A 1
C22 C -0.1404(3) -0.0551(3) 0.13222(18) 0.0405(10) Uani 0.803(6) 1 d P B 1
H22A H -0.1459 -0.0544 0.1853 0.049 Uiso 0.803(6) 1 calc PR B 1
H22B H -0.1927 -0.1295 0.1053 0.049 Uiso 0.803(6) 1 calc PR B 1
C23 C 0.0001(3) -0.1688(3) 0.13707(17) 0.0353(9) Uani 0.803(6) 1 d P B 1
H23A H 0.0834 -0.1666 0.1366 0.053 Uiso 0.803(6) 1 calc PR B 1
H23B H -0.0513 -0.2274 0.0972 0.053 Uiso 0.803(6) 1 calc PR B 1
H23C H -0.0186 -0.1886 0.1850 0.053 Uiso 0.803(6) 1 calc PR B 1
C22A C -0.1037(10) 0.0351(11) 0.1466(6) 0.024(3) Uani 0.197(6) 1 d P B 2
H22C H -0.1330 0.0113 0.1917 0.029 Uiso 0.197(6) 1 calc PR B 2
H22D H -0.0509 0.1146 0.1606 0.029 Uiso 0.197(6) 1 calc PR B 2
C23A C -0.0814(14) -0.1576(12) 0.1436(8) 0.049(4) Uani 0.197(6) 1 d P B 2
H23D H -0.1172 -0.1436 0.1868 0.074 Uiso 0.197(6) 1 calc PR B 2
H23E H -0.0258 -0.2054 0.1554 0.074 Uiso 0.197(6) 1 calc PR B 2
H23F H -0.1439 -0.1982 0.1014 0.074 Uiso 0.197(6) 1 calc PR B 2
C24 C 0.0716(2) 0.0289(2) 0.17975(15) 0.0550(7) Uani 1 1 d . B .
H24A H 0.0702 0.1087 0.1724 0.083 Uiso 1 1 calc R . .
H24B H 0.1492 0.0171 0.1742 0.083 Uiso 1 1 calc R . .
H24C H 0.0579 0.0152 0.2297 0.083 Uiso 1 1 calc R . .
C25 C -0.0875(2) 0.1508(2) 0.37311(12) 0.0372(6) Uani 1 1 d . . .
H25A H -0.1623 0.0964 0.3768 0.056 Uiso 1 1 calc R . .
H25B H -0.0440 0.1115 0.3429 0.056 Uiso 1 1 calc R . .
H25C H -0.1044 0.2171 0.3498 0.056 Uiso 1 1 calc R . .
C26 C 0.09198(19) 0.2797(2) 0.44044(14) 0.0403(6) Uani 1 1 d . . .
H26A H 0.1359 0.2453 0.4080 0.060 Uiso 1 1 calc R . .
H26B H 0.1424 0.3072 0.4896 0.060 Uiso 1 1 calc R . .
H26C H 0.0691 0.3452 0.4191 0.060 Uiso 1 1 calc R . .
C27 C -0.08266(19) 0.24622(19) 0.49466(12) 0.0308(5) Uani 1 1 d . . .
H27A H -0.1235 0.2956 0.4654 0.037 Uiso 1 1 calc R . .
H27B H -0.0258 0.2973 0.5369 0.037 Uiso 1 1 calc R . .
C29 C -0.2188(2) -0.0019(2) 0.59239(13) 0.0386(6) Uani 1 1 d . . .
H29A H -0.2671 0.0364 0.6192 0.058 Uiso 1 1 calc R . .
H29B H -0.1847 -0.0521 0.6240 0.058 Uiso 1 1 calc R . .
H29C H -0.2686 -0.0489 0.5470 0.058 Uiso 1 1 calc R . .
C30 C -0.05076(19) 0.1546(2) 0.64213(12) 0.0348(6) Uani 1 1 d . . .
H30A H 0.0147 0.2141 0.6309 0.052 Uiso 1 1 calc R . .
H30B H -0.0186 0.1033 0.6737 0.052 Uiso 1 1 calc R . .
H30C H -0.1005 0.1922 0.6681 0.052 Uiso 1 1 calc R . .
C82 C -0.17350(18) 0.1602(2) 0.52457(12) 0.0306(5) Uani 1 1 d . . .
H82A H -0.2176 0.2032 0.5528 0.037 Uiso 1 1 calc R . .
H82B H -0.2312 0.1100 0.4823 0.037 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
Mg Mg 0.0486 0.0363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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'
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'
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 N2 119.77(7) . .
N1 Mg1 N3 121.04(7) . .
N2 Mg1 N3 119.19(7) . .
N1 Mg1 Si1 28.18(5) . .
N2 Mg1 Si1 135.90(5) . .
N3 Mg1 Si1 100.12(5) . .
N1 Mg1 Si4 136.29(5) . .
N2 Mg1 Si4 27.87(5) . .
N3 Mg1 Si4 98.48(5) . .
Si1 Mg1 Si4 161.38(3) . .
N1 Mg1 Si3 100.76(5) . .
N2 Mg1 Si3 27.53(5) . .
N3 Mg1 Si3 133.28(5) . .
Si1 Mg1 Si3 109.68(3) . .
Si4 Mg1 Si3 55.34(2) . .
N1 Mg1 Si2 27.49(5) . .
N2 Mg1 Si2 101.50(5) . .
N3 Mg1 Si2 134.23(5) . .
Si1 Mg1 Si2 55.580(19) . .
Si4 Mg1 Si2 110.49(3) . .
Si3 Mg1 Si2 92.49(2) . .
N1 Mg1 Si5 106.40(5) . .
N2 Mg1 Si5 127.67(6) . .
N3 Mg1 Si5 27.77(4) . .
Si1 Mg1 Si5 96.41(2) . .
Si4 Mg1 Si5 100.44(2) . .
Si3 Mg1 Si5 152.53(3) . .
Si2 Mg1 Si5 109.78(2) . .
N1 Mg1 Si6 129.42(5) . .
N2 Mg1 Si6 104.29(5) . .
N3 Mg1 Si6 27.78(4) . .
Si1 Mg1 Si6 101.86(2) . .
Si4 Mg1 Si6 94.21(2) . .
Si3 Mg1 Si6 108.86(2) . .
Si2 Mg1 Si6 153.95(3) . .
Si5 Mg1 Si6 55.548(18) . .
N5 Na1 N5 180.00(14) 2 .
N5 Na1 N4 105.43(6) 2 .
N5 Na1 N4 74.57(6) . .
N5 Na1 N4 74.57(6) 2 2
N5 Na1 N4 105.43(6) . 2
N4 Na1 N4 180.0 . 2
N7 Na2 N7 180.0 2_556 .
N7 Na2 N6 73.56(6) 2_556 2_556
N7 Na2 N6 106.44(6) . 2_556
N7 Na2 N6 106.44(6) 2_556 .
N7 Na2 N6 73.56(6) . .
N6 Na2 N6 180.0 2_556 .
N1 Si1 C2 113.14(10) . .
N1 Si1 C1 111.80(9) . .
C2 Si1 C1 104.77(11) . .
N1 Si1 C3 114.44(9) . .
C2 Si1 C3 107.18(11) . .
C1 Si1 C3 104.71(11) . .
N1 Si1 Mg1 34.08(5) . .
C2 Si1 Mg1 109.01(8) . .
C1 Si1 Mg1 81.27(8) . .
C3 Si1 Mg1 140.31(8) . .
N1 Si2 C5 111.65(9) . .
N1 Si2 C4 113.31(9) . .
C5 Si2 C4 106.09(11) . .
N1 Si2 C6 113.36(9) . .
C5 Si2 C6 105.12(11) . .
C4 Si2 C6 106.70(10) . .
N1 Si2 Mg1 33.20(6) . .
C5 Si2 Mg1 78.64(6) . .
C4 Si2 Mg1 128.86(7) . .
C6 Si2 Mg1 121.38(7) . .
N2 Si3 C9 112.47(9) . .
N2 Si3 C8 113.37(9) . .
C9 Si3 C8 105.84(11) . .
N2 Si3 C7 112.66(9) . .
C9 Si3 C7 105.30(10) . .
C8 Si3 C7 106.57(10) . .
N2 Si3 Mg1 33.45(6) . .
C9 Si3 Mg1 79.24(7) . .
C8 Si3 Mg1 129.43(7) . .
C7 Si3 Mg1 120.75(7) . .
N2 Si4 C11 113.14(10) . .
N2 Si4 C12 114.22(10) . .
C11 Si4 C12 105.82(10) . .
N2 Si4 C10 112.19(9) . .
C11 Si4 C10 105.92(11) . .
C12 Si4 C10 104.80(11) . .
N2 Si4 Mg1 33.76(5) . .
C11 Si4 Mg1 106.86(8) . .
C12 Si4 Mg1 142.42(8) . .
C10 Si4 Mg1 83.50(8) . .
N3 Si5 C13 111.29(9) . .
N3 Si5 C14 114.92(10) . .
C13 Si5 C14 106.38(11) . .
N3 Si5 C15 113.35(10) . .
C13 Si5 C15 105.45(10) . .
C14 Si5 C15 104.69(12) . .
N3 Si5 Mg1 33.71(5) . .
C13 Si5 Mg1 77.92(7) . .
C14 Si5 Mg1 122.80(9) . .
C15 Si5 Mg1 129.70(8) . .
N3 Si6 C17 114.14(10) . .
N3 Si6 C18 111.43(8) . .
C17 Si6 C18 107.37(10) . .
N3 Si6 C16 114.60(9) . .
C17 Si6 C16 103.43(10) . .
C18 Si6 C16 105.07(10) . .
N3 Si6 Mg1 33.69(5) . .
C17 Si6 Mg1 130.48(8) . .
C18 Si6 Mg1 77.90(6) . .
C16 Si6 Mg1 123.12(7) . .
Si1 N1 Si2 122.64(9) . .
Si1 N1 Mg1 117.74(8) . .
Si2 N1 Mg1 119.31(9) . .
Si3 N2 Si4 122.40(9) . .
Si3 N2 Mg1 119.02(10) . .
Si4 N2 Mg1 118.37(9) . .
Si5 N3 Si6 122.95(9) . .
Si5 N3 Mg1 118.52(8) . .
Si6 N3 Mg1 118.53(8) . .
C19 N4 C21 111.5(2) . .
C19 N4 C20 107.5(2) . .
C21 N4 C20 108.47(19) . .
C19 N4 Na1 112.00(14) . .
C21 N4 Na1 103.35(15) . .
C20 N4 Na1 114.03(15) . .
C23A N5 C22 66.8(7) . .
C23A N5 C24 120.5(6) . .
C22 N5 C24 116.2(2) . .
C23A N5 C23 41.1(6) . .
C22 N5 C23 107.8(2) . .
C24 N5 C23 104.2(2) . .
C23A N5 C22A 101.9(8) . .
C22 N5 C22A 39.1(4) . .
C24 N5 C22A 84.2(4) . .
C23 N5 C22A 141.3(5) . .
C23A N5 Na1 127.4(6) . .
C22 N5 Na1 106.52(16) . .
C24 N5 Na1 109.24(15) . .
C23 N5 Na1 113.07(15) . .
C22A N5 Na1 98.8(4) . .
C25 N6 C26 108.13(18) . .
C25 N6 C27 110.02(16) . .
C26 N6 C27 108.69(17) . .
C25 N6 Na2 103.06(13) . .
C26 N6 Na2 120.81(13) . .
C27 N6 Na2 105.78(13) . .
C30 N7 C82 111.04(17) . .
C30 N7 C29 107.55(17) . .
C82 N7 C29 109.37(17) . .
C30 N7 Na2 111.37(12) . .
C82 N7 Na2 105.24(12) . .
C29 N7 Na2 112.29(12) . .
Si1 C1 H1A 109.5 . .
Si1 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
Si1 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
Si1 C2 H2A 109.5 . .
Si1 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
Si1 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
Si1 C3 H3A 109.5 . .
Si1 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
Si1 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
Si2 C4 H4A 109.5 . .
Si2 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
Si2 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
Si2 C5 H5A 109.5 . .
Si2 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
Si2 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
Si2 C6 H6A 109.5 . .
Si2 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
Si2 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
Si3 C7 H7A 109.5 . .
Si3 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
Si3 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
Si3 C8 H8A 109.5 . .
Si3 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
Si3 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
Si3 C9 H9A 109.5 . .
Si3 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
Si3 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
Si4 C11 H11A 109.5 . .
Si4 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
Si4 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
Si4 C12 H12A 109.5 . .
Si4 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
Si4 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
Si5 C13 H13A 109.5 . .
Si5 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
Si5 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
Si5 C14 H14A 109.5 . .
Si5 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
Si5 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
Si5 C15 H15A 109.5 . .
Si5 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
Si5 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
Si6 C16 H16A 109.5 . .
Si6 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
Si6 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
Si6 C17 H17A 109.5 . .
Si6 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
Si6 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
Si6 C18 H18A 109.5 . .
Si6 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
Si6 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
N4 C19 H19A 109.5 . .
N4 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
N4 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
N4 C20 H20A 109.5 . .
N4 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
N4 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
C22A C21 N4 126.5(6) . .
C22A C21 C22 44.9(6) . .
N4 C21 C22 116.5(2) . .
C22A C21 H21A 125.0 . .
N4 C21 H21A 108.2 . .
C22 C21 H21A 108.2 . .
C22A C21 H21B 63.5 . .
N4 C21 H21B 108.2 . .
C22 C21 H21B 108.2 . .
H21A C21 H21B 107.3 . .
N5 C22 C21 115.0(3) . .
N5 C22 H22A 108.5 . .
C21 C22 H22A 108.5 . .
N5 C22 H22B 108.5 . .
C21 C22 H22B 108.5 . .
H22A C22 H22B 107.5 . .
N5 C23 H23A 109.5 . .
N5 C23 H23B 109.5 . .
N5 C23 H23C 109.5 . .
C21 C22A N5 120.6(8) . .
C21 C22A H22C 107.2 . .
N5 C22A H22C 107.2 . .
C21 C22A H22D 107.2 . .
N5 C22A H22D 107.2 . .
H22C C22A H22D 106.8 . .
N5 C23A H23D 109.5 . .
N5 C23A H23E 109.5 . .
H23D C23A H23E 109.5 . .
N5 C23A H23F 109.5 . .
H23D C23A H23F 109.5 . .
H23E C23A H23F 109.5 . .
N5 C24 H24A 109.5 . .
N5 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
N5 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
N6 C25 H25A 109.5 . .
N6 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
N6 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
N6 C26 H26A 109.5 . .
N6 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
N6 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
N6 C27 C82 113.86(17) . .
N6 C27 H27A 108.8 . .
C82 C27 H27A 108.8 . .
N6 C27 H27B 108.8 . .
C82 C27 H27B 108.8 . .
H27A C27 H27B 107.7 . .
N7 C29 H29A 109.5 . .
N7 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
N7 C29 H29C 109.5 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
N7 C30 H30A 109.5 . .
N7 C30 H30B 109.5 . .
H30A C30 H30B 109.5 . .
N7 C30 H30C 109.5 . .
H30A C30 H30C 109.5 . .
H30B C30 H30C 109.5 . .
N7 C82 C27 113.83(17) . .
N7 C82 H82A 108.8 . .
C27 C82 H82A 108.8 . .
N7 C82 H82B 108.8 . .
C27 C82 H82B 108.8 . .
H82A C82 H82B 107.7 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mg1 N1 2.0173(16) .
Mg1 N2 2.0240(17) .
Mg1 N3 2.0297(16) .
Mg1 Si1 3.1864(9) .
Mg1 Si4 3.2050(9) .
Mg1 Si3 3.2110(9) .
Mg1 Si2 3.2126(8) .
Mg1 Si5 3.2131(9) .
Mg1 Si6 3.2150(8) .
Na1 N5 2.4723(18) 2
Na1 N5 2.4723(18) .
Na1 N4 2.5624(17) .
Na1 N4 2.5624(17) 2
Na2 N7 2.4666(15) 2_556
Na2 N7 2.4666(15) .
Na2 N6 2.6004(18) 2_556
Na2 N6 2.6004(18) .
Si1 N1 1.7001(18) .
Si1 C2 1.872(2) .
Si1 C1 1.875(2) .
Si1 C3 1.885(2) .
Si2 N1 1.7006(16) .
Si2 C5 1.869(2) .
Si2 C4 1.883(2) .
Si2 C6 1.886(2) .
Si3 N2 1.6972(17) .
Si3 C9 1.866(2) .
Si3 C8 1.885(2) .
Si3 C7 1.890(2) .
Si4 N2 1.7029(18) .
Si4 C11 1.875(2) .
Si4 C12 1.883(2) .
Si4 C10 1.908(2) .
Si5 N3 1.7037(16) .
Si5 C13 1.871(2) .
Si5 C14 1.887(3) .
Si5 C15 1.893(2) .
Si6 N3 1.7056(15) .
Si6 C17 1.877(2) .
Si6 C18 1.878(2) .
Si6 C16 1.886(2) .
N4 C19 1.454(3) .
N4 C21 1.464(3) .
N4 C20 1.475(3) .
N5 C23A 1.404(14) .
N5 C22 1.436(3) .
N5 C24 1.441(3) .
N5 C23 1.512(3) .
N5 C22A 1.656(10) .
N6 C25 1.460(3) .
N6 C26 1.474(3) .
N6 C27 1.481(2) .
N7 C30 1.464(3) .
N7 C82 1.466(3) .
N7 C29 1.472(3) .
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C1 H1C 0.9800 .
C2 H2A 0.9800 .
C2 H2B 0.9800 .
C2 H2C 0.9800 .
C3 H3A 0.9800 .
C3 H3B 0.9800 .
C3 H3C 0.9800 .
C4 H4A 0.9800 .
C4 H4B 0.9800 .
C4 H4C 0.9800 .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C6 H6A 0.9800 .
C6 H6B 0.9800 .
C6 H6C 0.9800 .
C7 H7A 0.9800 .
C7 H7B 0.9800 .
C7 H7C 0.9800 .
C8 H8A 0.9800 .
C8 H8B 0.9800 .
C8 H8C 0.9800 .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 0.9800 .
C16 H16A 0.9800 .
C16 H16B 0.9800 .
C16 H16C 0.9800 .
C17 H17A 0.9800 .
C17 H17B 0.9800 .
C17 H17C 0.9800 .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C19 H19A 0.9800 .
C19 H19B 0.9800 .
C19 H19C 0.9800 .
C20 H20A 0.9800 .
C20 H20B 0.9800 .
C20 H20C 0.9800 .
C21 C22A 1.167(11) .
C21 C22 1.485(4) .
C21 H21A 0.9900 .
C21 H21B 0.9900 .
C22 H22A 0.9900 .
C22 H22B 0.9900 .
C23 H23A 0.9800 .
C23 H23B 0.9800 .
C23 H23C 0.9800 .
C22A H22C 0.9900 .
C22A H22D 0.9900 .
C23A H23D 0.9800 .
C23A H23E 0.9800 .
C23A H23F 0.9800 .
C24 H24A 0.9800 .
C24 H24B 0.9800 .
C24 H24C 0.9800 .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
C27 C82 1.508(3) .
C27 H27A 0.9900 .
C27 H27B 0.9900 .
C29 H29A 0.9800 .
C29 H29B 0.9800 .
C29 H29C 0.9800 .
C30 H30A 0.9800 .
C30 H30B 0.9800 .
C30 H30C 0.9800 .
C82 H82A 0.9900 .
C82 H82B 0.9900 .
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
N2 Mg1 Si1 N1 -65.47(12) .
N3 Mg1 Si1 N1 140.88(11) .
Si4 Mg1 Si1 N1 -41.75(13) .
Si3 Mg1 Si1 N1 -75.65(10) .
Si2 Mg1 Si1 N1 3.44(10) .
Si5 Mg1 Si1 N1 113.06(10) .
Si6 Mg1 Si1 N1 169.14(10) .
N1 Mg1 Si1 C2 -103.44(13) .
N2 Mg1 Si1 C2 -168.91(11) .
N3 Mg1 Si1 C2 37.44(10) .
Si4 Mg1 Si1 C2 -145.19(11) .
Si3 Mg1 Si1 C2 -179.10(8) .
Si2 Mg1 Si1 C2 -100.01(9) .
Si5 Mg1 Si1 C2 9.62(9) .
Si6 Mg1 Si1 C2 65.69(9) .
N1 Mg1 Si1 C1 153.85(13) .
N2 Mg1 Si1 C1 88.39(11) .
N3 Mg1 Si1 C1 -65.26(9) .
Si4 Mg1 Si1 C1 112.10(11) .
Si3 Mg1 Si1 C1 78.20(8) .
Si2 Mg1 Si1 C1 157.29(8) .
Si5 Mg1 Si1 C1 -93.08(8) .
Si6 Mg1 Si1 C1 -37.01(8) .
N1 Mg1 Si1 C3 51.31(15) .
N2 Mg1 Si1 C3 -14.16(15) .
N3 Mg1 Si1 C3 -167.81(13) .
Si4 Mg1 Si1 C3 9.56(16) .
Si3 Mg1 Si1 C3 -24.34(13) .
Si2 Mg1 Si1 C3 54.75(12) .
Si5 Mg1 Si1 C3 164.37(12) .
Si6 Mg1 Si1 C3 -139.55(12) .
N2 Mg1 Si2 N1 134.99(11) .
N3 Mg1 Si2 N1 -71.82(12) .
Si1 Mg1 Si2 N1 -3.52(10) .
Si4 Mg1 Si2 N1 162.49(10) .
Si3 Mg1 Si2 N1 108.75(10) .
Si5 Mg1 Si2 N1 -87.63(10) .
Si6 Mg1 Si2 N1 -36.92(11) .
N1 Mg1 Si2 C5 173.93(13) .
N2 Mg1 Si2 C5 -51.08(9) .
N3 Mg1 Si2 C5 102.11(11) .
Si1 Mg1 Si2 C5 170.42(8) .
Si4 Mg1 Si2 C5 -23.58(8) .
Si3 Mg1 Si2 C5 -77.32(8) .
Si5 Mg1 Si2 C5 86.30(8) .
Si6 Mg1 Si2 C5 137.01(9) .
N1 Mg1 Si2 C4 72.34(15) .
N2 Mg1 Si2 C4 -152.68(12) .
N3 Mg1 Si2 C4 0.52(14) .
Si1 Mg1 Si2 C4 68.82(11) .
Si4 Mg1 Si2 C4 -125.17(11) .
Si3 Mg1 Si2 C4 -178.91(11) .
Si5 Mg1 Si2 C4 -15.29(11) .
Si6 Mg1 Si2 C4 35.41(13) .
N1 Mg1 Si2 C6 -85.17(14) .
N2 Mg1 Si2 C6 49.82(11) .
N3 Mg1 Si2 C6 -156.99(12) .
Si1 Mg1 Si2 C6 -88.69(10) .
Si4 Mg1 Si2 C6 77.32(10) .
Si3 Mg1 Si2 C6 23.58(10) .
Si5 Mg1 Si2 C6 -172.80(10) .
Si6 Mg1 Si2 C6 -122.09(11) .
N1 Mg1 Si3 N2 136.81(11) .
N3 Mg1 Si3 N2 -69.05(12) .
Si1 Mg1 Si3 N2 164.56(10) .
Si4 Mg1 Si3 N2 -2.93(9) .
Si2 Mg1 Si3 N2 110.39(9) .
Si5 Mg1 Si3 N2 -34.49(10) .
Si6 Mg1 Si3 N2 -84.78(9) .
N1 Mg1 Si3 C9 -49.70(9) .
N2 Mg1 Si3 C9 173.49(12) .
N3 Mg1 Si3 C9 104.44(10) .
Si1 Mg1 Si3 C9 -21.95(7) .
Si4 Mg1 Si3 C9 170.56(7) .
Si2 Mg1 Si3 C9 -76.12(7) .
Si5 Mg1 Si3 C9 139.01(9) .
Si6 Mg1 Si3 C9 88.71(7) .
N1 Mg1 Si3 C8 -151.44(12) .
N2 Mg1 Si3 C8 71.76(15) .
N3 Mg1 Si3 C8 2.71(14) .
Si1 Mg1 Si3 C8 -123.68(12) .
Si4 Mg1 Si3 C8 68.82(12) .
Si2 Mg1 Si3 C8 -177.85(12) .
Si5 Mg1 Si3 C8 37.27(14) .
Si6 Mg1 Si3 C8 -13.02(12) .
N1 Mg1 Si3 C7 51.81(11) .
N2 Mg1 Si3 C7 -85.00(13) .
N3 Mg1 Si3 C7 -154.05(11) .
Si1 Mg1 Si3 C7 79.56(10) .
Si4 Mg1 Si3 C7 -87.93(9) .
Si2 Mg1 Si3 C7 25.39(9) .
Si5 Mg1 Si3 C7 -119.48(10) .
Si6 Mg1 Si3 C7 -169.78(9) .
N1 Mg1 Si4 N2 -63.85(12) .
N3 Mg1 Si4 N2 140.60(11) .
Si1 Mg1 Si4 N2 -36.78(12) .
Si3 Mg1 Si4 N2 2.90(9) .
Si2 Mg1 Si4 N2 -75.44(9) .
Si5 Mg1 Si4 N2 168.69(9) .
Si6 Mg1 Si4 N2 112.97(9) .
N1 Mg1 Si4 C11 -170.44(11) .
N2 Mg1 Si4 C11 -106.60(13) .
N3 Mg1 Si4 C11 34.01(10) .
Si1 Mg1 Si4 C11 -143.37(11) .
Si3 Mg1 Si4 C11 -103.70(9) .
Si2 Mg1 Si4 C11 177.96(9) .
Si5 Mg1 Si4 C11 62.10(9) .
Si6 Mg1 Si4 C11 6.38(9) .
N1 Mg1 Si4 C12 -21.03(15) .
N2 Mg1 Si4 C12 42.81(15) .
N3 Mg1 Si4 C12 -176.58(12) .
Si1 Mg1 Si4 C12 6.03(16) .
Si3 Mg1 Si4 C12 45.71(12) .
Si2 Mg1 Si4 C12 -32.63(12) .
Si5 Mg1 Si4 C12 -148.49(12) .
Si6 Mg1 Si4 C12 155.79(12) .
N1 Mg1 Si4 C10 84.85(11) .
N2 Mg1 Si4 C10 148.69(12) .
N3 Mg1 Si4 C10 -70.71(9) .
Si1 Mg1 Si4 C10 111.91(11) .
Si3 Mg1 Si4 C10 151.59(8) .
Si2 Mg1 Si4 C10 73.25(8) .
Si5 Mg1 Si4 C10 -42.61(8) .
Si6 Mg1 Si4 C10 -98.33(8) .
N1 Mg1 Si5 N3 126.50(12) .
N2 Mg1 Si5 N3 -81.73(12) .
Si1 Mg1 Si5 N3 99.57(10) .
Si4 Mg1 Si5 N3 -88.38(10) .
Si3 Mg1 Si5 N3 -62.42(12) .
Si2 Mg1 Si5 N3 155.23(11) .
Si6 Mg1 Si5 N3 -0.44(10) .
N1 Mg1 Si5 C13 -45.26(9) .
N2 Mg1 Si5 C13 106.52(10) .
N3 Mg1 Si5 C13 -171.76(13) .
Si1 Mg1 Si5 C13 -72.19(8) .
Si4 Mg1 Si5 C13 99.87(8) .
Si3 Mg1 Si5 C13 125.82(9) .
Si2 Mg1 Si5 C13 -16.53(8) .
Si6 Mg1 Si5 C13 -172.19(8) .
N1 Mg1 Si5 C14 -147.10(11) .
N2 Mg1 Si5 C14 4.67(12) .
N3 Mg1 Si5 C14 86.40(14) .
Si1 Mg1 Si5 C14 -174.03(10) .
Si4 Mg1 Si5 C14 -1.98(10) .
Si3 Mg1 Si5 C14 23.98(12) .
Si2 Mg1 Si5 C14 -118.37(10) .
Si6 Mg1 Si5 C14 85.97(10) .
N1 Mg1 Si5 C15 54.91(11) .
N2 Mg1 Si5 C15 -153.32(11) .
N3 Mg1 Si5 C15 -71.59(14) .
Si1 Mg1 Si5 C15 27.98(10) .
Si4 Mg1 Si5 C15 -159.96(9) .
Si3 Mg1 Si5 C15 -134.01(10) .
Si2 Mg1 Si5 C15 83.64(10) .
Si6 Mg1 Si5 C15 -72.02(9) .
N1 Mg1 Si6 N3 -82.63(12) .
N2 Mg1 Si6 N3 126.59(12) .
Si1 Mg1 Si6 N3 -89.24(10) .
Si4 Mg1 Si6 N3 100.22(10) .
Si3 Mg1 Si6 N3 154.95(11) .
Si2 Mg1 Si6 N3 -61.59(12) .
Si5 Mg1 Si6 N3 0.43(10) .
N1 Mg1 Si6 C17 -154.50(12) .
N2 Mg1 Si6 C17 54.72(12) .
N3 Mg1 Si6 C17 -71.87(14) .
Si1 Mg1 Si6 C17 -161.11(10) .
Si4 Mg1 Si6 C17 28.35(11) .
Si3 Mg1 Si6 C17 83.08(11) .
Si2 Mg1 Si6 C17 -133.46(11) .
Si5 Mg1 Si6 C17 -71.44(10) .
N1 Mg1 Si6 C18 102.88(10) .
N2 Mg1 Si6 C18 -47.90(10) .
N3 Mg1 Si6 C18 -174.49(13) .
Si1 Mg1 Si6 C18 96.26(8) .
Si4 Mg1 Si6 C18 -74.28(8) .
Si3 Mg1 Si6 C18 -19.55(8) .
Si2 Mg1 Si6 C18 123.91(10) .
Si5 Mg1 Si6 C18 -174.06(8) .
N1 Mg1 Si6 C16 2.64(11) .
N2 Mg1 Si6 C16 -148.14(10) .
N3 Mg1 Si6 C16 85.27(13) .
Si1 Mg1 Si6 C16 -3.97(9) .
Si4 Mg1 Si6 C16 -174.51(9) .
Si3 Mg1 Si6 C16 -119.78(9) .
Si2 Mg1 Si6 C16 23.68(11) .
Si5 Mg1 Si6 C16 85.70(9) .
C2 Si1 N1 Si2 -83.60(13) .
C1 Si1 N1 Si2 158.39(12) .
C3 Si1 N1 Si2 39.57(15) .
Mg1 Si1 N1 Si2 -173.63(18) .
C2 Si1 N1 Mg1 90.03(12) .
C1 Si1 N1 Mg1 -27.98(13) .
C3 Si1 N1 Mg1 -146.80(10) .
C5 Si2 N1 Si1 167.13(11) .
C4 Si2 N1 Si1 47.42(15) .
C6 Si2 N1 Si1 -74.38(14) .
Mg1 Si2 N1 Si1 173.53(18) .
C5 Si2 N1 Mg1 -6.40(13) .
C4 Si2 N1 Mg1 -126.11(11) .
C6 Si2 N1 Mg1 112.09(11) .
N2 Mg1 N1 Si1 133.17(9) .
N3 Mg1 N1 Si1 -46.46(12) .
Si4 Mg1 N1 Si1 162.08(6) .
Si3 Mg1 N1 Si1 111.79(9) .
Si2 Mg1 N1 Si1 -173.85(17) .
Si5 Mg1 N1 Si1 -72.38(10) .
Si6 Mg1 N1 Si1 -13.81(13) .
N2 Mg1 N1 Si2 -52.98(12) .
N3 Mg1 N1 Si2 127.39(9) .
Si1 Mg1 N1 Si2 173.85(17) .
Si4 Mg1 N1 Si2 -24.07(14) .
Si3 Mg1 N1 Si2 -74.36(9) .
Si5 Mg1 N1 Si2 101.47(9) .
Si6 Mg1 N1 Si2 160.04(6) .
C9 Si3 N2 Si4 167.69(10) .
C8 Si3 N2 Si4 47.66(15) .
C7 Si3 N2 Si4 -73.48(13) .
Mg1 Si3 N2 Si4 174.61(17) .
C9 Si3 N2 Mg1 -6.92(13) .
C8 Si3 N2 Mg1 -126.96(11) .
C7 Si3 N2 Mg1 111.91(11) .
C11 Si4 N2 Si3 -88.77(13) .
C12 Si4 N2 Si3 32.38(13) .
C10 Si4 N2 Si3 151.46(12) .
Mg1 Si4 N2 Si3 -174.65(17) .
C11 Si4 N2 Mg1 85.88(12) .
C12 Si4 N2 Mg1 -152.97(9) .
C10 Si4 N2 Mg1 -33.89(13) .
N1 Mg1 N2 Si3 -50.78(12) .
N3 Mg1 N2 Si3 128.86(9) .
Si1 Mg1 N2 Si3 -21.11(13) .
Si4 Mg1 N2 Si3 174.83(16) .
Si2 Mg1 N2 Si3 -72.87(9) .
Si5 Mg1 N2 Si3 160.74(6) .
Si6 Mg1 N2 Si3 103.47(8) .
N1 Mg1 N2 Si4 134.39(9) .
N3 Mg1 N2 Si4 -45.98(12) .
Si1 Mg1 N2 Si4 164.06(5) .
Si3 Mg1 N2 Si4 -174.83(16) .
Si2 Mg1 N2 Si4 112.30(8) .
Si5 Mg1 N2 Si4 -14.10(12) .
Si6 Mg1 N2 Si4 -71.36(9) .
C13 Si5 N3 Si6 -172.15(12) .
C14 Si5 N3 Si6 66.86(16) .
C15 Si5 N3 Si6 -53.48(15) .
Mg1 Si5 N3 Si6 179.19(19) .
C13 Si5 N3 Mg1 8.66(14) .
C14 Si5 N3 Mg1 -112.33(13) .
C15 Si5 N3 Mg1 127.33(11) .
C17 Si6 N3 Si5 -51.58(15) .
C18 Si6 N3 Si5 -173.41(12) .
C16 Si6 N3 Si5 67.44(15) .
Mg1 Si6 N3 Si5 -179.19(19) .
C17 Si6 N3 Mg1 127.62(11) .
C18 Si6 N3 Mg1 5.78(14) .
C16 Si6 N3 Mg1 -113.36(11) .
N1 Mg1 N3 Si5 -64.17(13) .
N2 Mg1 N3 Si5 116.20(10) .
Si1 Mg1 N3 Si5 -84.52(10) .
Si4 Mg1 N3 Si5 96.33(9) .
Si3 Mg1 N3 Si5 145.83(7) .
Si2 Mg1 N3 Si5 -33.38(14) .
Si6 Mg1 N3 Si5 179.23(18) .
N1 Mg1 N3 Si6 116.60(10) .
N2 Mg1 N3 Si6 -63.03(12) .
Si1 Mg1 N3 Si6 96.25(9) .
Si4 Mg1 N3 Si6 -82.90(9) .
Si3 Mg1 N3 Si6 -33.40(14) .
Si2 Mg1 N3 Si6 147.39(7) .
Si5 Mg1 N3 Si6 -179.23(18) .
N5 Na1 N4 C19 70.75(19) 2
N5 Na1 N4 C19 -109.25(19) .
N4 Na1 N4 C19 -113(42) 2
N5 Na1 N4 C21 -169.17(17) 2
N5 Na1 N4 C21 10.83(17) .
N4 Na1 N4 C21 7(42) 2
N5 Na1 N4 C20 -51.64(17) 2
N5 Na1 N4 C20 128.36(17) .
N4 Na1 N4 C20 124(42) 2
N5 Na1 N5 C23A -104(100) 2
N4 Na1 N5 C23A 89.1(9) .
N4 Na1 N5 C23A -90.9(9) 2
N5 Na1 N5 C22 -177(100) 2
N4 Na1 N5 C22 15.98(19) .
N4 Na1 N5 C22 -164.02(19) 2
N5 Na1 N5 C24 57(100) 2
N4 Na1 N5 C24 -110.31(16) .
N4 Na1 N5 C24 69.69(16) 2
N5 Na1 N5 C23 -59(100) 2
N4 Na1 N5 C23 134.2(2) .
N4 Na1 N5 C23 -45.8(2) 2
N5 Na1 N5 C22A 144(100) 2
N4 Na1 N5 C22A -23.4(5) .
N4 Na1 N5 C22A 156.6(5) 2
N7 Na2 N6 C25 67.99(13) 2_556
N7 Na2 N6 C25 -112.01(13) .
N6 Na2 N6 C25 130(100) 2_556
N7 Na2 N6 C26 -52.70(16) 2_556
N7 Na2 N6 C26 127.30(16) .
N6 Na2 N6 C26 9(100) 2_556
N7 Na2 N6 C27 -176.50(12) 2_556
N7 Na2 N6 C27 3.50(12) .
N6 Na2 N6 C27 -115(100) 2_556
N7 Na2 N7 C30 41(64) 2_556
N6 Na2 N7 C30 84.03(15) 2_556
N6 Na2 N7 C30 -95.97(15) .
N7 Na2 N7 C82 161(64) 2_556
N6 Na2 N7 C82 -155.56(12) 2_556
N6 Na2 N7 C82 24.44(12) .
N7 Na2 N7 C29 -80(64) 2_556
N6 Na2 N7 C29 -36.67(16) 2_556
N6 Na2 N7 C29 143.33(16) .
C19 N4 C21 C22A 133.9(9) .
C20 N4 C21 C22A -107.9(9) .
Na1 N4 C21 C22A 13.5(9) .
C19 N4 C21 C22 81.9(3) .
C20 N4 C21 C22 -159.9(3) .
Na1 N4 C21 C22 -38.5(3) .
C23A N5 C22 C21 -167.5(7) .
C24 N5 C22 C21 78.6(3) .
C23 N5 C22 C21 -165.0(3) .
C22A N5 C22 C21 40.3(7) .
Na1 N5 C22 C21 -43.4(3) .
C22A C21 C22 N5 -55.0(8) .
N4 C21 C22 N5 61.2(4) .
N4 C21 C22A N5 -44.2(14) .
C22 C21 C22A N5 48.4(7) .
C23A N5 C22A C21 -86.0(12) .
C22 N5 C22A C21 -60.0(9) .
C24 N5 C22A C21 154.0(11) .
C23 N5 C22A C21 -100.5(11) .
Na1 N5 C22A C21 45.4(11) .
C25 N6 C27 C82 78.8(2) .
C26 N6 C27 C82 -163.00(19) .
Na2 N6 C27 C82 -31.9(2) .
C30 N7 C82 C27 67.5(2) .
C29 N7 C82 C27 -174.00(17) .
Na2 N7 C82 C27 -53.17(19) .
N6 C27 C82 N7 62.0(2) .
