#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:44:41 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179861 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/57/7015765.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_7015765
loop_
_publ_author_name
'García-Álvarez, Pablo'
'Kennedy, Alan R.'
'O'Hara, Charles T'
'Reilly, Kieran'
'Robertson, Gemma M.'
_publ_section_title
;
 Synthesis and structural chemistry of alkali metal tris(HMDS)
 magnesiates containing chiral diamine donor ligands.
;
_journal_issue                   19
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5332
_journal_page_last               5341
_journal_paper_doi               10.1039/c1dt10058k
_journal_volume                  40
_journal_year                    2011
_chemical_absolute_configuration ad
_chemical_formula_sum            'C45 H106 Li Mg N7 Si6'
_chemical_formula_weight         945.16
_chemical_name_systematic
;
?
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 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                 96.227(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.7763(3)
_cell_length_b                   35.6239(8)
_cell_length_c                   14.4655(3)
_cell_measurement_reflns_used    9866
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      29.7778
_cell_measurement_theta_min      2.7223
_cell_volume                     6032.7(2)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_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     0.71073
_diffrn_reflns_av_R_equivalents  0.0316
_diffrn_reflns_av_sigmaI/netI    0.1227
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       40
_diffrn_reflns_limit_k_min       -43
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            29468
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         2.73
_exptl_absorpt_coefficient_mu    0.182
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.98879
_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    1.041
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       fragment
_exptl_crystal_F_000             2096
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.433
_refine_diff_density_min         -0.272
_refine_diff_density_rms         0.043
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   -0.03(5)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.801
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1134
_refine_ls_number_reflns         21184
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      0.801
_refine_ls_R_factor_all          0.0701
_refine_ls_R_factor_gt           0.0418
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0201P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0602
_refine_ls_wR_factor_ref         0.0638
_reflns_number_gt                14010
_reflns_number_total             21184
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c1dt10058k.txt
_cod_data_source_block           pgaki17
_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.

Automatic conversion script
Id: cif_fix_enum 1555 2011-01-17 13:19:09Z saulius 
;
_cod_original_sg_symbol_H-M      P21
_cod_database_code               7015765
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, 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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Mg1 Mg -0.17938(8) 0.45116(3) 1.43376(7) 0.0178(2) Uani 1 1 d . . .
Mg2 Mg -0.20503(7) 0.18229(3) 0.92446(7) 0.0176(2) Uani 1 1 d . . .
Li1 Li -0.5530(4) 0.42216(16) 0.8998(4) 0.0275(14) Uani 1 1 d . . .
Li2 Li -0.5464(4) 0.21002(16) 1.3860(4) 0.0225(13) Uani 1 1 d . . .
Si1 Si 0.08032(7) 0.47795(3) 1.45640(7) 0.0260(2) Uani 1 1 d . . .
Si2 Si -0.07263(7) 0.50970(3) 1.58928(7) 0.0311(2) Uani 1 1 d . . .
Si3 Si -0.12690(7) 0.37031(2) 1.52740(6) 0.0202(2) Uani 1 1 d . . .
Si4 Si -0.20562(7) 0.37268(2) 1.32508(6) 0.0203(2) Uani 1 1 d . . .
Si5 Si -0.45118(7) 0.46464(2) 1.39940(7) 0.0239(2) Uani 1 1 d . . .
Si6 Si -0.30028(7) 0.51400(2) 1.30099(7) 0.0219(2) Uani 1 1 d . . .
Si7 Si -0.16057(7) 0.26121(2) 1.02940(6) 0.0213(2) Uani 1 1 d . . .
Si8 Si -0.20363(7) 0.26253(2) 0.82254(6) 0.0211(2) Uani 1 1 d . . .
Si9 Si 0.04735(7) 0.14843(2) 0.96331(6) 0.0215(2) Uani 1 1 d . . .
Si10 Si -0.12412(7) 0.12305(3) 1.08753(6) 0.0257(2) Uani 1 1 d . . .
Si11 Si -0.47467(7) 0.17034(2) 0.86364(6) 0.0227(2) Uani 1 1 d . . .
Si12 Si -0.30932(6) 0.12082(2) 0.78054(6) 0.0194(2) Uani 1 1 d . . .
N1 N -0.04934(17) 0.48186(7) 1.49863(17) 0.0207(6) Uani 1 1 d . . .
N2 N -0.17173(17) 0.39448(7) 1.42848(16) 0.0157(6) Uani 1 1 d . . .
N3 N -0.32004(17) 0.47715(7) 1.37149(16) 0.0175(6) Uani 1 1 d . . .
N5 N -0.37919(19) 0.43887(7) 0.88942(19) 0.0239(7) Uani 1 1 d . . .
N6 N -0.58153(18) 0.48037(7) 0.92117(18) 0.0224(6) Uani 1 1 d . . .
N7 N -0.6402(2) 0.38887(7) 0.79185(18) 0.0263(7) Uani 1 1 d . . .
N8 N -0.61102(19) 0.37939(7) 0.98865(17) 0.0216(6) Uani 1 1 d . . .
N9 N -0.19118(18) 0.23912(7) 0.92585(17) 0.0174(6) Uani 1 1 d . . .
N10 N -0.08639(17) 0.14907(7) 0.99736(17) 0.0186(6) Uani 1 1 d . . .
N11 N -0.33888(17) 0.15774(6) 0.84882(16) 0.0150(6) Uani 1 1 d . . .
N12 N -0.6250(2) 0.24877(7) 1.27924(19) 0.0260(7) Uani 1 1 d . . .
N13 N -0.58026(19) 0.25524(7) 1.47865(18) 0.0233(6) Uani 1 1 d . . .
N14 N -0.37855(19) 0.18421(7) 1.40321(19) 0.0258(7) Uani 1 1 d . . .
N15 N -0.60617(19) 0.15353(7) 1.37911(18) 0.0238(6) Uani 1 1 d . . .
C1 C 0.0755(2) 0.44109(9) 1.3645(2) 0.0308(9) Uani 1 1 d . . .
H1A H 0.0566 0.4168 1.3909 0.046 Uiso 1 1 calc R . .
H1B H 0.1502 0.4394 1.3408 0.046 Uiso 1 1 calc R . .
H1C H 0.0172 0.4477 1.3135 0.046 Uiso 1 1 calc R . .
C2 C 0.1997(2) 0.46356(10) 1.5476(2) 0.0413(10) Uani 1 1 d . . .
H2A H 0.2220 0.4851 1.5878 0.062 Uiso 1 1 calc R . .
H2B H 0.2655 0.4551 1.5171 0.062 Uiso 1 1 calc R . .
H2C H 0.1734 0.4431 1.5852 0.062 Uiso 1 1 calc R . .
C3 C 0.1278(3) 0.52213(9) 1.4009(3) 0.0420(10) Uani 1 1 d . . .
H3A H 0.0682 0.5304 1.3527 0.063 Uiso 1 1 calc R . .
H3B H 0.1985 0.5172 1.3729 0.063 Uiso 1 1 calc R . .
H3C H 0.1415 0.5418 1.4483 0.063 Uiso 1 1 calc R . .
C4 C -0.0417(3) 0.56106(9) 1.5746(3) 0.0515(12) Uani 1 1 d . . .
H4A H 0.0409 0.5647 1.5752 0.077 Uiso 1 1 calc R . .
H4B H -0.0692 0.5753 1.6258 0.077 Uiso 1 1 calc R . .
H4C H -0.0806 0.5699 1.5153 0.077 Uiso 1 1 calc R . .
C5 C 0.0145(3) 0.49695(11) 1.7026(2) 0.0541(11) Uani 1 1 d . . .
H5A H 0.0132 0.4697 1.7112 0.081 Uiso 1 1 calc R . .
H5B H -0.0181 0.5092 1.7543 0.081 Uiso 1 1 calc R . .
H5C H 0.0935 0.5053 1.7010 0.081 Uiso 1 1 calc R . .
C6 C -0.2263(2) 0.50651(10) 1.6135(2) 0.0404(9) Uani 1 1 d . . .
H6A H -0.2761 0.5140 1.5578 0.061 Uiso 1 1 calc R . .
H6B H -0.2389 0.5233 1.6650 0.061 Uiso 1 1 calc R . .
H6C H -0.2437 0.4806 1.6301 0.061 Uiso 1 1 calc R . .
C7 C 0.0282(2) 0.35712(9) 1.5400(2) 0.0328(9) Uani 1 1 d . . .
H7A H 0.0446 0.3421 1.4863 0.049 Uiso 1 1 calc R . .
H7B H 0.0460 0.3424 1.5971 0.049 Uiso 1 1 calc R . .
H7C H 0.0749 0.3799 1.5434 0.049 Uiso 1 1 calc R . .
C8 C -0.1465(3) 0.39852(9) 1.6338(2) 0.0407(9) Uani 1 1 d . . .
H8A H -0.1066 0.4226 1.6310 0.061 Uiso 1 1 calc R . .
H8B H -0.1151 0.3847 1.6893 0.061 Uiso 1 1 calc R . .
H8C H -0.2281 0.4031 1.6367 0.061 Uiso 1 1 calc R . .
C9 C -0.2078(3) 0.32499(9) 1.5396(2) 0.0322(9) Uani 1 1 d . . .
H9A H -0.2895 0.3304 1.5386 0.048 Uiso 1 1 calc R . .
H9B H -0.1801 0.3129 1.5986 0.048 Uiso 1 1 calc R . .
H9C H -0.1956 0.3082 1.4879 0.048 Uiso 1 1 calc R . .
C10 C -0.3416(3) 0.34418(10) 1.3176(3) 0.0402(10) Uani 1 1 d . . .
H10A H -0.3283 0.3212 1.3546 0.060 Uiso 1 1 calc R . .
H10B H -0.3649 0.3375 1.2526 0.060 Uiso 1 1 calc R . .
H10C H -0.4019 0.3590 1.3418 0.060 Uiso 1 1 calc R . .
C11 C -0.0908(3) 0.33925(10) 1.2952(2) 0.0379(10) Uani 1 1 d . . .
H11A H -0.0224 0.3535 1.2840 0.057 Uiso 1 1 calc R . .
H11B H -0.1183 0.3251 1.2391 0.057 Uiso 1 1 calc R . .
H11C H -0.0720 0.3218 1.3470 0.057 Uiso 1 1 calc R . .
C12 C -0.2276(2) 0.40581(9) 1.2250(2) 0.0247(8) Uani 1 1 d . . .
H12A H -0.2889 0.4234 1.2350 0.037 Uiso 1 1 calc R . .
H12B H -0.2484 0.3917 1.1676 0.037 Uiso 1 1 calc R . .
H12C H -0.1568 0.4198 1.2198 0.037 Uiso 1 1 calc R . .
C13 C -0.4418(2) 0.43032(9) 1.4985(2) 0.0309(9) Uani 1 1 d . . .
H13A H -0.3985 0.4082 1.4826 0.046 Uiso 1 1 calc R . .
H13B H -0.5190 0.4227 1.5101 0.046 Uiso 1 1 calc R . .
H13C H -0.4032 0.4422 1.5544 0.046 Uiso 1 1 calc R . .
C14 C -0.5340(2) 0.50573(9) 1.4363(3) 0.0424(10) Uani 1 1 d . . .
H14A H -0.4900 0.5185 1.4885 0.064 Uiso 1 1 calc R . .
H14B H -0.6068 0.4970 1.4555 0.064 Uiso 1 1 calc R . .
H14C H -0.5487 0.5232 1.3841 0.064 Uiso 1 1 calc R . .
C15 C -0.5451(2) 0.44160(10) 1.3015(2) 0.0371(10) Uani 1 1 d . . .
H15A H -0.5638 0.4598 1.2514 0.056 Uiso 1 1 calc R . .
H15B H -0.6156 0.4328 1.3246 0.056 Uiso 1 1 calc R . .
H15C H -0.5046 0.4202 1.2777 0.056 Uiso 1 1 calc R . .
C16 C -0.4165(3) 0.51901(10) 1.2016(2) 0.0334(9) Uani 1 1 d . . .
H16A H -0.4242 0.4955 1.1665 0.050 Uiso 1 1 calc R . .
H16B H -0.3969 0.5394 1.1606 0.050 Uiso 1 1 calc R . .
H16C H -0.4889 0.5248 1.2260 0.050 Uiso 1 1 calc R . .
C17 C -0.1661(3) 0.50954(10) 1.2436(3) 0.0412(10) Uani 1 1 d . . .
H17A H -0.1016 0.5048 1.2908 0.062 Uiso 1 1 calc R . .
H17B H -0.1528 0.5328 1.2104 0.062 Uiso 1 1 calc R . .
H17C H -0.1737 0.4886 1.1994 0.062 Uiso 1 1 calc R . .
C18 C -0.2898(2) 0.55988(9) 1.3632(2) 0.0354(10) Uani 1 1 d . . .
H18A H -0.3554 0.5628 1.3989 0.053 Uiso 1 1 calc R . .
H18B H -0.2894 0.5803 1.3179 0.053 Uiso 1 1 calc R . .
H18C H -0.2190 0.5606 1.4056 0.053 Uiso 1 1 calc R . .
C19 C -0.3097(2) 0.42883(10) 0.9766(3) 0.0390(10) Uani 1 1 d . . .
H19A H -0.3080 0.4015 0.9836 0.058 Uiso 1 1 calc R . .
H19B H -0.3431 0.4401 1.0292 0.058 Uiso 1 1 calc R . .
H19C H -0.2317 0.4382 0.9751 0.058 Uiso 1 1 calc R . .
C20 C -0.3288(3) 0.42033(9) 0.8122(2) 0.0361(9) Uani 1 1 d . . .
H20A H -0.2481 0.4273 0.8141 0.054 Uiso 1 1 calc R . .
H20B H -0.3697 0.4283 0.7529 0.054 Uiso 1 1 calc R . .
H20C H -0.3352 0.3930 0.8184 0.054 Uiso 1 1 calc R . .
C21 C -0.3842(2) 0.48038(8) 0.8734(2) 0.0228(8) Uani 1 1 d . . .
H21 H -0.4166 0.4844 0.8074 0.027 Uiso 1 1 calc R . .
C22 C -0.2662(2) 0.49983(9) 0.8860(2) 0.0331(9) Uani 1 1 d . . .
H22A H -0.2293 0.4952 0.9498 0.040 Uiso 1 1 calc R . .
H22B H -0.2168 0.4890 0.8416 0.040 Uiso 1 1 calc R . .
C23 C -0.2778(3) 0.54209(9) 0.8697(3) 0.0399(10) Uani 1 1 d . . .
H23A H -0.2012 0.5539 0.8773 0.048 Uiso 1 1 calc R . .
H23B H -0.3127 0.5469 0.8054 0.048 Uiso 1 1 calc R . .
C24 C -0.3515(3) 0.55914(10) 0.9381(3) 0.0416(10) Uani 1 1 d . . .
H24A H -0.3574 0.5866 0.9283 0.050 Uiso 1 1 calc R . .
H24B H -0.3165 0.5545 1.0025 0.050 Uiso 1 1 calc R . .
C25 C -0.4700(2) 0.54146(8) 0.9239(2) 0.0333(9) Uani 1 1 d . . .
H25A H -0.5060 0.5477 0.8607 0.040 Uiso 1 1 calc R . .
H25B H -0.5178 0.5524 0.9693 0.040 Uiso 1 1 calc R . .
C26 C -0.4670(2) 0.49876(8) 0.9353(2) 0.0223(7) Uani 1 1 d . . .
H26 H -0.4356 0.4937 1.0012 0.027 Uiso 1 1 calc R . .
C27 C -0.6440(2) 0.48719(10) 1.0030(2) 0.0356(10) Uani 1 1 d . . .
H27A H -0.5992 0.4775 1.0590 0.053 Uiso 1 1 calc R . .
H27B H -0.7180 0.4744 0.9943 0.053 Uiso 1 1 calc R . .
H27C H -0.6562 0.5142 1.0099 0.053 Uiso 1 1 calc R . .
C28 C -0.6520(2) 0.49382(9) 0.8379(2) 0.0372(10) Uani 1 1 d . . .
H28A H -0.6644 0.5209 0.8432 0.056 Uiso 1 1 calc R . .
H28B H -0.7257 0.4808 0.8321 0.056 Uiso 1 1 calc R . .
H28C H -0.6128 0.4887 0.7828 0.056 Uiso 1 1 calc R . .
C29 C -0.5929(3) 0.38957(10) 0.7019(2) 0.0484(10) Uani 1 1 d . . .
H29A H -0.5193 0.3765 0.7077 0.073 Uiso 1 1 calc R . .
H29B H -0.5819 0.4157 0.6833 0.073 Uiso 1 1 calc R . .
H29C H -0.6459 0.3771 0.6548 0.073 Uiso 1 1 calc R . .
C30 C -0.7580(2) 0.40477(9) 0.7778(2) 0.0394(9) Uani 1 1 d . . .
H30A H -0.8080 0.3876 0.7392 0.059 Uiso 1 1 calc R . .
H30B H -0.7562 0.4292 0.7467 0.059 Uiso 1 1 calc R . .
H30C H -0.7872 0.4080 0.8382 0.059 Uiso 1 1 calc R . .
C31 C -0.6393(2) 0.35007(9) 0.8311(2) 0.0249(8) Uani 1 1 d . . .
H31 H -0.5582 0.3412 0.8367 0.030 Uiso 1 1 calc R . .
C32 C -0.7099(3) 0.32122(9) 0.7706(3) 0.0365(10) Uani 1 1 d . . .
H32A H -0.7904 0.3297 0.7612 0.044 Uiso 1 1 calc R . .
H32B H -0.6811 0.3200 0.7089 0.044 Uiso 1 1 calc R . .
C33 C -0.7051(3) 0.28263(9) 0.8131(3) 0.0468(11) Uani 1 1 d . . .
H33A H -0.6258 0.2730 0.8174 0.056 Uiso 1 1 calc R . .
H33B H -0.7543 0.2654 0.7728 0.056 Uiso 1 1 calc R . .
C34 C -0.7450(3) 0.28352(10) 0.9092(3) 0.0445(11) Uani 1 1 d . . .
H34A H -0.7392 0.2581 0.9369 0.053 Uiso 1 1 calc R . .
H34B H -0.8260 0.2915 0.9047 0.053 Uiso 1 1 calc R . .
C35 C -0.6716(3) 0.31083(10) 0.9708(3) 0.0369(10) Uani 1 1 d . . .
H35A H -0.5915 0.3018 0.9783 0.044 Uiso 1 1 calc R . .
H35B H -0.6988 0.3116 1.0331 0.044 Uiso 1 1 calc R . .
C36 C -0.6756(2) 0.35038(8) 0.9295(2) 0.0240(8) Uani 1 1 d . . .
H36 H -0.7576 0.3583 0.9233 0.029 Uiso 1 1 calc R . .
C37 C -0.6815(3) 0.39240(10) 1.0605(2) 0.0377(9) Uani 1 1 d . . .
H37A H -0.7482 0.4060 1.0309 0.057 Uiso 1 1 calc R . .
H37B H -0.6363 0.4092 1.1038 0.057 Uiso 1 1 calc R . .
H37C H -0.7070 0.3707 1.0946 0.057 Uiso 1 1 calc R . .
C38 C -0.5034(3) 0.36458(10) 1.0373(3) 0.0409(10) Uani 1 1 d . . .
H38A H -0.5207 0.3447 1.0803 0.061 Uiso 1 1 calc R . .
H38B H -0.4621 0.3849 1.0723 0.061 Uiso 1 1 calc R . .
H38C H -0.4559 0.3544 0.9917 0.061 Uiso 1 1 calc R . .
C39 C -0.2144(3) 0.23460(10) 1.1262(2) 0.0464(10) Uani 1 1 d . . .
H39A H -0.2979 0.2330 1.1159 0.070 Uiso 1 1 calc R . .
H39B H -0.1918 0.2475 1.1852 0.070 Uiso 1 1 calc R . .
H39C H -0.1820 0.2092 1.1287 0.070 Uiso 1 1 calc R . .
C40 C -0.0038(2) 0.26825(10) 1.0658(2) 0.0390(9) Uani 1 1 d . . .
H40A H 0.0355 0.2440 1.0664 0.058 Uiso 1 1 calc R . .
H40B H 0.0067 0.2793 1.1282 0.058 Uiso 1 1 calc R . .
H40C H 0.0281 0.2851 1.0218 0.058 Uiso 1 1 calc R . .
C41 C -0.2303(3) 0.30857(10) 1.0332(3) 0.0382(10) Uani 1 1 d . . .
H41A H -0.2016 0.3250 0.9867 0.057 Uiso 1 1 calc R . .
H41B H -0.2124 0.3195 1.0952 0.057 Uiso 1 1 calc R . .
H41C H -0.3132 0.3058 1.0197 0.057 Uiso 1 1 calc R . .
C42 C -0.0755(2) 0.29257(9) 0.8082(2) 0.0328(9) Uani 1 1 d . . .
H42A H -0.0608 0.3093 0.8619 0.049 Uiso 1 1 calc R . .
H42B H -0.0901 0.3076 0.7514 0.049 Uiso 1 1 calc R . .
H42C H -0.0088 0.2765 0.8037 0.049 Uiso 1 1 calc R . .
C43 C -0.3331(3) 0.29418(10) 0.8027(3) 0.0396(10) Uani 1 1 d . . .
H43A H -0.4021 0.2797 0.8104 0.059 Uiso 1 1 calc R . .
H43B H -0.3384 0.3045 0.7395 0.059 Uiso 1 1 calc R . .
H43C H -0.3257 0.3148 0.8478 0.059 Uiso 1 1 calc R . .
C44 C -0.2179(2) 0.23008(9) 0.7203(2) 0.0261(8) Uani 1 1 d . . .
H44A H -0.1496 0.2143 0.7219 0.039 Uiso 1 1 calc R . .
H44B H -0.2262 0.2448 0.6627 0.039 Uiso 1 1 calc R . .
H44C H -0.2854 0.2142 0.7227 0.039 Uiso 1 1 calc R . .
C45 C 0.1626(2) 0.15511(9) 1.0613(2) 0.0341(9) Uani 1 1 d . . .
H45A H 0.1471 0.1778 1.0960 0.051 Uiso 1 1 calc R . .
H45B H 0.2364 0.1577 1.0364 0.051 Uiso 1 1 calc R . .
H45C H 0.1649 0.1333 1.1028 0.051 Uiso 1 1 calc R . .
C46 C 0.0850(2) 0.10335(9) 0.9053(2) 0.0310(9) Uani 1 1 d . . .
H46A H 0.0869 0.0827 0.9502 0.047 Uiso 1 1 calc R . .
H46B H 0.1602 0.1059 0.8828 0.047 Uiso 1 1 calc R . .
H46C H 0.0275 0.0980 0.8528 0.047 Uiso 1 1 calc R . .
C47 C 0.0664(2) 0.18733(9) 0.8787(2) 0.0275(8) Uani 1 1 d . . .
H47A H 0.0101 0.1846 0.8241 0.041 Uiso 1 1 calc R . .
H47B H 0.1436 0.1861 0.8593 0.041 Uiso 1 1 calc R . .
H47C H 0.0556 0.2116 0.9085 0.041 Uiso 1 1 calc R . .
C48 C -0.2828(2) 0.12478(10) 1.0929(2) 0.0306(8) Uani 1 1 d . . .
H48A H -0.3055 0.1505 1.1068 0.046 Uiso 1 1 calc R . .
H48B H -0.3033 0.1079 1.1419 0.046 Uiso 1 1 calc R . .
H48C H -0.3224 0.1169 1.0329 0.046 Uiso 1 1 calc R . .
C49 C -0.0559(3) 0.13935(10) 1.2052(2) 0.0452(10) Uani 1 1 d . . .
H49A H 0.0271 0.1359 1.2089 0.068 Uiso 1 1 calc R . .
H49B H -0.0862 0.1246 1.2542 0.068 Uiso 1 1 calc R . .
H49C H -0.0731 0.1660 1.2135 0.068 Uiso 1 1 calc R . .
C50 C -0.0857(3) 0.07168(9) 1.0837(3) 0.0413(10) Uani 1 1 d . . .
H50A H -0.1148 0.0612 1.0231 0.062 Uiso 1 1 calc R . .
H50B H -0.1199 0.0583 1.1330 0.062 Uiso 1 1 calc R . .
H50C H -0.0024 0.0689 1.0932 0.062 Uiso 1 1 calc R . .
C51 C -0.4791(2) 0.20481(9) 0.9618(2) 0.0338(9) Uani 1 1 d . . .
H51A H -0.4451 0.1934 1.0199 0.051 Uiso 1 1 calc R . .
H51B H -0.5586 0.2117 0.9677 0.051 Uiso 1 1 calc R . .
H51C H -0.4359 0.2274 0.9488 0.051 Uiso 1 1 calc R . .
C52 C -0.5676(2) 0.13031(9) 0.8934(2) 0.0370(10) Uani 1 1 d . . .
H52A H -0.5700 0.1112 0.8444 0.056 Uiso 1 1 calc R . .
H52B H -0.6451 0.1395 0.8985 0.056 Uiso 1 1 calc R . .
H52C H -0.5363 0.1192 0.9528 0.056 Uiso 1 1 calc R . .
C53 C -0.5528(3) 0.19349(9) 0.7586(2) 0.0349(9) Uani 1 1 d . . .
H53A H -0.5136 0.2168 0.7451 0.052 Uiso 1 1 calc R . .
H53B H -0.6312 0.1992 0.7708 0.052 Uiso 1 1 calc R . .
H53C H -0.5544 0.1765 0.7051 0.052 Uiso 1 1 calc R . .
C54 C -0.1723(2) 0.12768(9) 0.7263(2) 0.0308(9) Uani 1 1 d . . .
H54A H -0.1823 0.1479 0.6802 0.046 Uiso 1 1 calc R . .
H54B H -0.1526 0.1044 0.6958 0.046 Uiso 1 1 calc R . .
H54C H -0.1108 0.1343 0.7747 0.046 Uiso 1 1 calc R . .
C55 C -0.2943(3) 0.07497(9) 0.8448(2) 0.0363(9) Uani 1 1 d . . .
H55A H -0.2315 0.0767 0.8949 0.054 Uiso 1 1 calc R . .
H55B H -0.2781 0.0549 0.8018 0.054 Uiso 1 1 calc R . .
H55C H -0.3656 0.0693 0.8713 0.054 Uiso 1 1 calc R . .
C56 C -0.4187(2) 0.11331(10) 0.6782(2) 0.0332(9) Uani 1 1 d . . .
H56A H -0.4918 0.1065 0.7000 0.050 Uiso 1 1 calc R . .
H56B H -0.3935 0.0931 0.6393 0.050 Uiso 1 1 calc R . .
H56C H -0.4279 0.1365 0.6416 0.050 Uiso 1 1 calc R . .
C57 C -0.7112(3) 0.23193(9) 1.2104(3) 0.0498(11) Uani 1 1 d . . .
H57A H -0.7334 0.2502 1.1610 0.075 Uiso 1 1 calc R . .
H57B H -0.7784 0.2248 1.2408 0.075 Uiso 1 1 calc R . .
H57C H -0.6792 0.2096 1.1835 0.075 Uiso 1 1 calc R . .
C58 C -0.5270(3) 0.26078(9) 1.2300(2) 0.0341(8) Uani 1 1 d . . .
H58A H -0.4926 0.2388 1.2034 0.051 Uiso 1 1 calc R . .
H58B H -0.4699 0.2732 1.2740 0.051 Uiso 1 1 calc R . .
H58C H -0.5537 0.2783 1.1801 0.051 Uiso 1 1 calc R . .
C59 C -0.6756(2) 0.28022(9) 1.3293(2) 0.0260(8) Uani 1 1 d . . .
H59 H -0.7516 0.2712 1.3449 0.031 Uiso 1 1 calc R . .
C60 C -0.6986(3) 0.31569(9) 1.2697(3) 0.0377(10) Uani 1 1 d . . .
H60A H -0.6256 0.3252 1.2509 0.045 Uiso 1 1 calc R . .
H60B H -0.7489 0.3093 1.2126 0.045 Uiso 1 1 calc R . .
C61 C -0.7549(3) 0.34629(10) 1.3227(3) 0.0453(11) Uani 1 1 d . . .
H61A H -0.7667 0.3690 1.2834 0.054 Uiso 1 1 calc R . .
H61B H -0.8305 0.3375 1.3378 0.054 Uiso 1 1 calc R . .
C62 C -0.6807(3) 0.35585(9) 1.4112(3) 0.0433(10) Uani 1 1 d . . .
H62A H -0.7180 0.3756 1.4453 0.052 Uiso 1 1 calc R . .
H62B H -0.6063 0.3656 1.3960 0.052 Uiso 1 1 calc R . .
C63 C -0.6615(3) 0.32133(9) 1.4720(3) 0.0335(9) Uani 1 1 d . . .
H63A H -0.7356 0.3127 1.4906 0.040 Uiso 1 1 calc R . .
H63B H -0.6115 0.3279 1.5292 0.040 Uiso 1 1 calc R . .
C64 C -0.6060(2) 0.28930(8) 1.4212(2) 0.0224(8) Uani 1 1 d . . .
H64 H -0.5309 0.2991 1.4054 0.027 Uiso 1 1 calc R . .
C65 C -0.4865(2) 0.26231(10) 1.5533(2) 0.0367(9) Uani 1 1 d . . .
H65A H -0.5129 0.2797 1.5989 0.055 Uiso 1 1 calc R . .
H65B H -0.4212 0.2733 1.5265 0.055 Uiso 1 1 calc R . .
H65C H -0.4634 0.2386 1.5841 0.055 Uiso 1 1 calc R . .
C66 C -0.6795(2) 0.24190(9) 1.5232(2) 0.0304(9) Uani 1 1 d . . .
H66A H -0.7035 0.2614 1.5647 0.046 Uiso 1 1 calc R . .
H66B H -0.6586 0.2192 1.5592 0.046 Uiso 1 1 calc R . .
H66C H -0.7425 0.2362 1.4753 0.046 Uiso 1 1 calc R . .
C67 C -0.3000(3) 0.19855(10) 1.4831(3) 0.0408(10) Uani 1 1 d . . .
H67A H -0.2248 0.1867 1.4827 0.061 Uiso 1 1 calc R . .
H67B H -0.3311 0.1925 1.5414 0.061 Uiso 1 1 calc R . .
H67C H -0.2922 0.2258 1.4777 0.061 Uiso 1 1 calc R . .
C68 C -0.3305(3) 0.19439(9) 1.3168(2) 0.0389(10) Uani 1 1 d . . .
H68A H -0.3237 0.2217 1.3131 0.058 Uiso 1 1 calc R . .
H68B H -0.3809 0.1852 1.2633 0.058 Uiso 1 1 calc R . .
H68C H -0.2548 0.1830 1.3167 0.058 Uiso 1 1 calc R . .
C69 C -0.3957(2) 0.14328(9) 1.4127(2) 0.0232(8) Uani 1 1 d . . .
H69 H -0.4040 0.1385 1.4798 0.028 Uiso 1 1 calc R . .
C70 C -0.2947(3) 0.11915(10) 1.3885(2) 0.0406(10) Uani 1 1 d . . .
H70A H -0.2828 0.1234 1.3226 0.049 Uiso 1 1 calc R . .
H70B H -0.2245 0.1271 1.4274 0.049 Uiso 1 1 calc R . .
C71 C -0.3146(3) 0.07737(10) 1.4040(3) 0.0507(12) Uani 1 1 d . . .
H71A H -0.2487 0.0627 1.3865 0.061 Uiso 1 1 calc R . .
H71B H -0.3220 0.0727 1.4705 0.061 Uiso 1 1 calc R . .
C72 C -0.4217(3) 0.06521(9) 1.3458(3) 0.0545(11) Uani 1 1 d . . .
H72A H -0.4352 0.0382 1.3559 0.065 Uiso 1 1 calc R . .
H72B H -0.4129 0.0690 1.2792 0.065 Uiso 1 1 calc R . .
C73 C -0.5234(3) 0.08792(8) 1.3720(2) 0.0396(10) Uani 1 1 d . . .
H73A H -0.5337 0.0832 1.4380 0.047 Uiso 1 1 calc R . .
H73B H -0.5936 0.0796 1.3336 0.047 Uiso 1 1 calc R . .
C74 C -0.5066(2) 0.13004(8) 1.3576(2) 0.0267(8) Uani 1 1 d . . .
H74 H -0.4978 0.1338 1.2902 0.032 Uiso 1 1 calc R . .
C75 C -0.7061(3) 0.14579(9) 1.3114(3) 0.0473(11) Uani 1 1 d . . .
H75A H -0.7309 0.1198 1.3184 0.071 Uiso 1 1 calc R . .
H75B H -0.6855 0.1496 1.2482 0.071 Uiso 1 1 calc R . .
H75C H -0.7685 0.1629 1.3225 0.071 Uiso 1 1 calc R . .
C76 C -0.6397(3) 0.14670(10) 1.4717(2) 0.0364(9) Uani 1 1 d . . .
H76A H -0.6639 0.1205 1.4764 0.055 Uiso 1 1 calc R . .
H76B H -0.7031 0.1634 1.4825 0.055 Uiso 1 1 calc R . .
H76C H -0.5747 0.1516 1.5183 0.055 Uiso 1 1 calc R . .
C77 C -0.8960(3) 0.14749(11) 1.6162(3) 0.0584(12) Uani 1 1 d . . .
H77A H -0.9450 0.1260 1.5969 0.088 Uiso 1 1 calc R . .
H77B H -0.9016 0.1530 1.6819 0.088 Uiso 1 1 calc R . .
H77C H -0.8167 0.1415 1.6074 0.088 Uiso 1 1 calc R . .
C78 C -0.9341(3) 0.18106(10) 1.5585(3) 0.0345(10) Uani 1 1 d . . .
C79 C -0.9571(3) 0.17846(12) 1.4637(3) 0.0433(11) Uani 1 1 d . . .
H79 H -0.9515 0.1546 1.4350 0.052 Uiso 1 1 calc R . .
C80 C -0.9883(3) 0.20935(14) 1.4080(3) 0.0532(12) Uani 1 1 d . . .
H80 H -1.0014 0.2071 1.3423 0.064 Uiso 1 1 calc R . .
C81 C -0.9995(3) 0.24354(13) 1.4517(4) 0.0588(14) Uani 1 1 d . . .
H81 H -1.0226 0.2650 1.4157 0.071 Uiso 1 1 calc R . .
C82 C -0.9778(3) 0.24667(12) 1.5456(4) 0.0568(14) Uani 1 1 d . . .
H82 H -0.9852 0.2704 1.5744 0.068 Uiso 1 1 calc R . .
C83 C -0.9451(3) 0.21587(10) 1.5994(3) 0.0399(10) Uani 1 1 d . . .
H83 H -0.9300 0.2185 1.6650 0.048 Uiso 1 1 calc R . .
C84 C -0.9129(3) 0.48757(11) 1.1166(3) 0.0562(12) Uani 1 1 d . . .
H84A H -0.9765 0.4956 1.1504 0.084 Uiso 1 1 calc R . .
H84B H -0.8917 0.5081 1.0766 0.084 Uiso 1 1 calc R . .
H84C H -0.8472 0.4810 1.1611 0.084 Uiso 1 1 calc R . .
C85 C -0.9487(2) 0.45385(10) 1.0576(3) 0.0306(9) Uani 1 1 d . . .
C86 C -0.9641(3) 0.41889(11) 1.0972(3) 0.0367(10) Uani 1 1 d . . .
H86 H -0.9526 0.4161 1.1629 0.044 Uiso 1 1 calc R . .
C87 C -0.9954(3) 0.38850(11) 1.0427(3) 0.0457(11) Uani 1 1 d . . .
H87 H -1.0061 0.3648 1.0707 0.055 Uiso 1 1 calc R . .
C88 C -1.0117(3) 0.39202(12) 0.9473(3) 0.0470(11) Uani 1 1 d . . .
H88 H -1.0324 0.3708 0.9094 0.056 Uiso 1 1 calc R . .
C89 C -0.9980(3) 0.42613(12) 0.9081(3) 0.0424(11) Uani 1 1 d . . .
H89 H -1.0111 0.4287 0.8425 0.051 Uiso 1 1 calc R . .
C90 C -0.9659(2) 0.45661(11) 0.9607(3) 0.0368(10) Uani 1 1 d . . .
H90 H -0.9550 0.4800 0.9315 0.044 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
Si Si 0.0817 0.0704 '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'
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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
_geom_angle_publ_flag
N3 Mg1 N2 118.55(10) . . ?
N3 Mg1 N1 120.02(10) . . ?
N2 Mg1 N1 121.43(10) . . ?
N3 Mg1 Si6 28.12(7) . . ?
N2 Mg1 Si6 134.26(8) . . ?
N1 Mg1 Si6 99.55(8) . . ?
N3 Mg1 Si1 129.74(8) . . ?
N2 Mg1 Si1 104.87(7) . . ?
N1 Mg1 Si1 28.65(7) . . ?
Si6 Mg1 Si1 102.28(4) . . ?
N3 Mg1 Si4 98.64(8) . . ?
N2 Mg1 Si4 27.55(7) . . ?
N1 Mg1 Si4 136.48(8) . . ?
Si6 Mg1 Si4 107.72(4) . . ?
Si1 Mg1 Si4 110.61(4) . . ?
N3 Mg1 Si3 135.15(8) . . ?
N2 Mg1 Si3 27.65(7) . . ?
N1 Mg1 Si3 100.79(8) . . ?
Si6 Mg1 Si3 159.62(4) . . ?
Si1 Mg1 Si3 94.97(3) . . ?
Si4 Mg1 Si3 55.19(3) . . ?
N3 Mg1 Si5 27.23(7) . . ?
N2 Mg1 Si5 100.99(7) . . ?
N1 Mg1 Si5 132.77(8) . . ?
Si6 Mg1 Si5 55.27(3) . . ?
Si1 Mg1 Si5 153.85(4) . . ?
Si4 Mg1 Si5 90.75(3) . . ?
Si3 Mg1 Si5 109.94(3) . . ?
N3 Mg1 Si2 104.68(8) . . ?
N2 Mg1 Si2 131.07(8) . . ?
N1 Mg1 Si2 27.07(7) . . ?
Si6 Mg1 Si2 94.66(3) . . ?
Si1 Mg1 Si2 55.72(3) . . ?
Si4 Mg1 Si2 156.43(4) . . ?
Si3 Mg1 Si2 104.07(4) . . ?
Si5 Mg1 Si2 108.49(4) . . ?
N11 Mg2 N9 119.64(10) . . ?
N11 Mg2 N10 118.73(10) . . ?
N9 Mg2 N10 121.63(10) . . ?
N11 Mg2 Si12 28.58(7) . . ?
N9 Mg2 Si12 135.96(9) . . ?
N10 Mg2 Si12 97.68(8) . . ?
N11 Mg2 Si9 126.00(8) . . ?
N9 Mg2 Si9 107.57(7) . . ?
N10 Mg2 Si9 28.10(7) . . ?
Si12 Mg2 Si9 98.11(3) . . ?
N11 Mg2 Si7 135.52(7) . . ?
N9 Mg2 Si7 27.59(7) . . ?
N10 Mg2 Si7 101.33(8) . . ?
Si12 Mg2 Si7 160.98(4) . . ?
Si9 Mg2 Si7 98.41(3) . . ?
N11 Mg2 Si8 100.32(7) . . ?
N9 Mg2 Si8 27.68(7) . . ?
N10 Mg2 Si8 135.77(7) . . ?
Si12 Mg2 Si8 109.46(4) . . ?
Si9 Mg2 Si8 111.38(3) . . ?
Si7 Mg2 Si8 55.25(3) . . ?
N11 Mg2 Si11 26.90(7) . . ?
N9 Mg2 Si11 102.10(7) . . ?
N10 Mg2 Si11 131.58(8) . . ?
Si12 Mg2 Si11 55.36(3) . . ?
Si9 Mg2 Si11 149.88(4) . . ?
Si7 Mg2 Si11 110.44(3) . . ?
Si8 Mg2 Si11 92.64(3) . . ?
N11 Mg2 Si10 105.30(8) . . ?
N9 Mg2 Si10 128.82(8) . . ?
N10 Mg2 Si10 27.21(7) . . ?
Si12 Mg2 Si10 95.20(3) . . ?
Si9 Mg2 Si10 55.31(3) . . ?
Si7 Mg2 Si10 101.93(4) . . ?
Si8 Mg2 Si10 154.05(4) . . ?
Si11 Mg2 Si10 108.43(3) . . ?
N6 Li1 N7 125.2(3) . . ?
N6 Li1 N8 122.5(3) . . ?
N7 Li1 N8 83.4(2) . . ?
N6 Li1 N5 84.7(2) . . ?
N7 Li1 N5 119.3(3) . . ?
N8 Li1 N5 127.1(3) . . ?
N15 Li2 N13 130.6(2) . . ?
N15 Li2 N14 84.1(2) . . ?
N13 Li2 N14 118.2(2) . . ?
N15 Li2 N12 116.6(2) . . ?
N13 Li2 N12 82.9(2) . . ?
N14 Li2 N12 130.9(2) . . ?
N1 Si1 C1 110.63(13) . . ?
N1 Si1 C3 113.77(14) . . ?
C1 Si1 C3 105.84(16) . . ?
N1 Si1 C2 113.43(14) . . ?
C1 Si1 C2 105.61(16) . . ?
C3 Si1 C2 106.96(15) . . ?
N1 Si1 Mg1 34.63(9) . . ?
C1 Si1 Mg1 76.18(9) . . ?
C3 Si1 Mg1 122.27(11) . . ?
C2 Si1 Mg1 128.53(10) . . ?
N1 Si2 C4 115.68(16) . . ?
N1 Si2 C6 110.41(13) . . ?
C4 Si2 C6 106.35(15) . . ?
N1 Si2 C5 114.39(14) . . ?
C4 Si2 C5 103.73(17) . . ?
C6 Si2 C5 105.43(17) . . ?
N1 Si2 Mg1 33.08(8) . . ?
C4 Si2 Mg1 128.05(13) . . ?
C6 Si2 Mg1 77.33(10) . . ?
C5 Si2 Mg1 125.70(12) . . ?
N2 Si3 C8 111.36(13) . . ?
N2 Si3 C7 114.73(13) . . ?
C8 Si3 C7 105.07(15) . . ?
N2 Si3 C9 113.33(14) . . ?
C8 Si3 C9 105.84(15) . . ?
C7 Si3 C9 105.77(15) . . ?
N2 Si3 Mg1 33.43(8) . . ?
C8 Si3 Mg1 80.23(11) . . ?
C7 Si3 Mg1 113.98(11) . . ?
C9 Si3 Mg1 136.72(11) . . ?
N2 Si4 C12 113.27(14) . . ?
N2 Si4 C11 112.67(14) . . ?
C12 Si4 C11 105.32(15) . . ?
N2 Si4 C10 114.44(14) . . ?
C12 Si4 C10 104.52(15) . . ?
C11 Si4 C10 105.76(16) . . ?
N2 Si4 Mg1 33.53(9) . . ?
C12 Si4 Mg1 80.01(11) . . ?
C11 Si4 Mg1 129.00(12) . . ?
C10 Si4 Mg1 122.19(12) . . ?
N3 Si5 C14 112.26(14) . . ?
N3 Si5 C13 111.91(13) . . ?
C14 Si5 C13 106.34(15) . . ?
N3 Si5 C15 114.19(14) . . ?
C14 Si5 C15 105.85(15) . . ?
C13 Si5 C15 105.70(15) . . ?
N3 Si5 Mg1 33.03(8) . . ?
C14 Si5 Mg1 127.85(11) . . ?
C13 Si5 Mg1 79.07(9) . . ?
C15 Si5 Mg1 122.85(11) . . ?
N3 Si6 C18 113.26(14) . . ?
N3 Si6 C17 112.31(13) . . ?
C18 Si6 C17 105.91(16) . . ?
N3 Si6 C16 113.42(14) . . ?
C18 Si6 C16 106.88(16) . . ?
C17 Si6 C16 104.36(16) . . ?
N3 Si6 Mg1 34.25(7) . . ?
C18 Si6 Mg1 108.86(11) . . ?
C17 Si6 Mg1 82.19(11) . . ?
C16 Si6 Mg1 140.17(12) . . ?
N9 Si7 C39 111.81(14) . . ?
N9 Si7 C41 113.00(14) . . ?
C39 Si7 C41 104.48(17) . . ?
N9 Si7 C40 114.67(13) . . ?
C39 Si7 C40 105.17(16) . . ?
C41 Si7 C40 106.90(16) . . ?
N9 Si7 Mg2 33.69(9) . . ?
C39 Si7 Mg2 81.84(11) . . ?
C41 Si7 Mg2 138.62(11) . . ?
C40 Si7 Mg2 110.72(11) . . ?
N9 Si8 C44 112.51(14) . . ?
N9 Si8 C42 112.45(14) . . ?
C44 Si8 C42 105.58(15) . . ?
N9 Si8 C43 114.59(14) . . ?
C44 Si8 C43 104.27(15) . . ?
C42 Si8 C43 106.67(16) . . ?
N9 Si8 Mg2 33.63(9) . . ?
C44 Si8 Mg2 78.98(10) . . ?
C42 Si8 Mg2 126.91(11) . . ?
C43 Si8 Mg2 123.70(12) . . ?
N10 Si9 C45 113.46(13) . . ?
N10 Si9 C47 111.03(13) . . ?
C45 Si9 C47 105.78(14) . . ?
N10 Si9 C46 114.21(13) . . ?
C45 Si9 C46 105.02(14) . . ?
C47 Si9 C46 106.71(15) . . ?
N10 Si9 Mg2 34.33(8) . . ?
C45 Si9 Mg2 132.04(10) . . ?
C47 Si9 Mg2 77.41(9) . . ?
C46 Si9 Mg2 120.09(10) . . ?
N10 Si10 C48 110.98(13) . . ?
N10 Si10 C50 115.05(15) . . ?
C48 Si10 C50 106.00(15) . . ?
N10 Si10 C49 113.72(14) . . ?
C48 Si10 C49 106.24(14) . . ?
C50 Si10 C49 104.11(16) . . ?
N10 Si10 Mg2 33.24(7) . . ?
C48 Si10 Mg2 78.06(10) . . ?
C50 Si10 Mg2 131.66(13) . . ?
C49 Si10 Mg2 121.27(12) . . ?
N11 Si11 C52 114.16(13) . . ?
N11 Si11 C53 113.55(13) . . ?
C52 Si11 C53 105.80(15) . . ?
N11 Si11 C51 111.81(13) . . ?
C52 Si11 C51 104.98(15) . . ?
C53 Si11 C51 105.79(15) . . ?
N11 Si11 Mg2 32.55(8) . . ?
C52 Si11 Mg2 128.22(10) . . ?
C53 Si11 Mg2 122.89(11) . . ?
C51 Si11 Mg2 79.37(9) . . ?
N11 Si12 C56 113.73(13) . . ?
N11 Si12 C55 113.49(14) . . ?
C56 Si12 C55 106.68(16) . . ?
N11 Si12 C54 112.29(13) . . ?
C56 Si12 C54 103.62(14) . . ?
C55 Si12 C54 106.26(15) . . ?
N11 Si12 Mg2 34.53(7) . . ?
C56 Si12 Mg2 143.18(12) . . ?
C55 Si12 Mg2 105.44(12) . . ?
C54 Si12 Mg2 84.02(10) . . ?
Si2 N1 Si1 123.44(14) . . ?
Si2 N1 Mg1 119.85(12) . . ?
Si1 N1 Mg1 116.72(14) . . ?
Si4 N2 Si3 122.12(15) . . ?
Si4 N2 Mg1 118.92(14) . . ?
Si3 N2 Mg1 118.92(14) . . ?
Si6 N3 Si5 122.32(13) . . ?
Si6 N3 Mg1 117.63(11) . . ?
Si5 N3 Mg1 119.74(14) . . ?
C19 N5 C20 107.9(2) . . ?
C19 N5 C21 112.4(3) . . ?
C20 N5 C21 109.7(2) . . ?
C19 N5 Li1 108.5(2) . . ?
C20 N5 Li1 113.1(2) . . ?
C21 N5 Li1 105.2(2) . . ?
C28 N6 C27 108.5(2) . . ?
C28 N6 C26 113.1(2) . . ?
C27 N6 C26 109.8(2) . . ?
C28 N6 Li1 106.4(2) . . ?
C27 N6 Li1 112.1(2) . . ?
C26 N6 Li1 107.0(2) . . ?
C29 N7 C30 108.0(3) . . ?
C29 N7 C31 111.4(3) . . ?
C30 N7 C31 111.8(2) . . ?
C29 N7 Li1 116.1(2) . . ?
C30 N7 Li1 104.8(2) . . ?
C31 N7 Li1 104.6(2) . . ?
C37 N8 C38 107.2(3) . . ?
C37 N8 C36 109.3(2) . . ?
C38 N8 C36 112.5(2) . . ?
C37 N8 Li1 116.0(2) . . ?
C38 N8 Li1 103.1(2) . . ?
C36 N8 Li1 108.8(2) . . ?
Si7 N9 Si8 122.51(15) . . ?
Si7 N9 Mg2 118.72(14) . . ?
Si8 N9 Mg2 118.69(14) . . ?
Si10 N10 Si9 122.88(14) . . ?
Si10 N10 Mg2 119.54(12) . . ?
Si9 N10 Mg2 117.57(13) . . ?
Si11 N11 Si12 122.15(14) . . ?
Si11 N11 Mg2 120.55(13) . . ?
Si12 N11 Mg2 116.89(11) . . ?
C57 N12 C58 108.0(3) . . ?
C57 N12 C59 110.6(2) . . ?
C58 N12 C59 112.9(2) . . ?
C57 N12 Li2 115.2(2) . . ?
C58 N12 Li2 103.2(2) . . ?
C59 N12 Li2 106.8(2) . . ?
C66 N13 C65 107.5(2) . . ?
C66 N13 C64 112.7(2) . . ?
C65 N13 C64 111.1(2) . . ?
C66 N13 Li2 103.8(2) . . ?
C65 N13 Li2 114.0(2) . . ?
C64 N13 Li2 107.6(2) . . ?
C68 N14 C69 113.0(3) . . ?
C68 N14 C67 108.1(2) . . ?
C69 N14 C67 110.2(3) . . ?
C68 N14 Li2 103.2(2) . . ?
C69 N14 Li2 107.2(2) . . ?
C67 N14 Li2 115.2(2) . . ?
C76 N15 C75 107.6(2) . . ?
C76 N15 C74 113.2(2) . . ?
C75 N15 C74 110.1(2) . . ?
C76 N15 Li2 103.6(2) . . ?
C75 N15 Li2 116.3(2) . . ?
C74 N15 Li2 105.9(2) . . ?
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 C10 H10A 109.5 . . ?
Si4 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
Si4 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 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 . . ?
N5 C19 H19A 109.5 . . ?
N5 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
N5 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
N5 C20 H20A 109.5 . . ?
N5 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
N5 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
N5 C21 C26 110.3(2) . . ?
N5 C21 C22 113.9(2) . . ?
C26 C21 C22 111.0(2) . . ?
N5 C21 H21 107.1 . . ?
C26 C21 H21 107.1 . . ?
C22 C21 H21 107.1 . . ?
C23 C22 C21 111.1(2) . . ?
C23 C22 H22A 109.4 . . ?
C21 C22 H22A 109.4 . . ?
C23 C22 H22B 109.4 . . ?
C21 C22 H22B 109.4 . . ?
H22A C22 H22B 108.0 . . ?
C24 C23 C22 110.0(3) . . ?
C24 C23 H23A 109.7 . . ?
C22 C23 H23A 109.7 . . ?
C24 C23 H23B 109.7 . . ?
C22 C23 H23B 109.7 . . ?
H23A C23 H23B 108.2 . . ?
C23 C24 C25 109.1(3) . . ?
C23 C24 H24A 109.9 . . ?
C25 C24 H24A 109.9 . . ?
C23 C24 H24B 109.9 . . ?
C25 C24 H24B 109.9 . . ?
H24A C24 H24B 108.3 . . ?
C24 C25 C26 112.7(2) . . ?
C24 C25 H25A 109.1 . . ?
C26 C25 H25A 109.1 . . ?
C24 C25 H25B 109.1 . . ?
C26 C25 H25B 109.1 . . ?
H25A C25 H25B 107.8 . . ?
N6 C26 C25 114.3(2) . . ?
N6 C26 C21 110.7(2) . . ?
C25 C26 C21 111.6(2) . . ?
N6 C26 H26 106.6 . . ?
C25 C26 H26 106.6 . . ?
C21 C26 H26 106.6 . . ?
N6 C27 H27A 109.5 . . ?
N6 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
N6 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N6 C28 H28A 109.5 . . ?
N6 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N6 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
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 C31 C36 110.8(2) . . ?
N7 C31 C32 114.9(3) . . ?
C36 C31 C32 110.3(3) . . ?
N7 C31 H31 106.8 . . ?
C36 C31 H31 106.8 . . ?
C32 C31 H31 106.8 . . ?
C33 C32 C31 112.6(3) . . ?
C33 C32 H32A 109.1 . . ?
C31 C32 H32A 109.1 . . ?
C33 C32 H32B 109.1 . . ?
C31 C32 H32B 109.1 . . ?
H32A C32 H32B 107.8 . . ?
C32 C33 C34 110.7(3) . . ?
C32 C33 H33A 109.5 . . ?
C34 C33 H33A 109.5 . . ?
C32 C33 H33B 109.5 . . ?
C34 C33 H33B 109.5 . . ?
H33A C33 H33B 108.1 . . ?
C33 C34 C35 109.7(3) . . ?
C33 C34 H34A 109.7 . . ?
C35 C34 H34A 109.7 . . ?
C33 C34 H34B 109.7 . . ?
C35 C34 H34B 109.7 . . ?
H34A C34 H34B 108.2 . . ?
C34 C35 C36 111.6(3) . . ?
C34 C35 H35A 109.3 . . ?
C36 C35 H35A 109.3 . . ?
C34 C35 H35B 109.3 . . ?
C36 C35 H35B 109.3 . . ?
H35A C35 H35B 108.0 . . ?
N8 C36 C35 114.9(3) . . ?
N8 C36 C31 111.1(2) . . ?
C35 C36 C31 110.9(3) . . ?
N8 C36 H36 106.5 . . ?
C35 C36 H36 106.5 . . ?
C31 C36 H36 106.5 . . ?
N8 C37 H37A 109.5 . . ?
N8 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
N8 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
N8 C38 H38A 109.5 . . ?
N8 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
N8 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
Si7 C39 H39A 109.5 . . ?
Si7 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
Si7 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
Si7 C40 H40A 109.5 . . ?
Si7 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
Si7 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
Si7 C41 H41A 109.5 . . ?
Si7 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
Si7 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
Si8 C42 H42A 109.5 . . ?
Si8 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
Si8 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
Si8 C43 H43A 109.5 . . ?
Si8 C43 H43B 109.5 . . ?
H43A C43 H43B 109.5 . . ?
Si8 C43 H43C 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
Si8 C44 H44A 109.5 . . ?
Si8 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
Si8 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
Si9 C45 H45A 109.5 . . ?
Si9 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
Si9 C45 H45C 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
Si9 C46 H46A 109.5 . . ?
Si9 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
Si9 C46 H46C 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
Si9 C47 H47A 109.5 . . ?
Si9 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
Si9 C47 H47C 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
Si10 C48 H48A 109.5 . . ?
Si10 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
Si10 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
Si10 C49 H49A 109.5 . . ?
Si10 C49 H49B 109.5 . . ?
H49A C49 H49B 109.5 . . ?
Si10 C49 H49C 109.5 . . ?
H49A C49 H49C 109.5 . . ?
H49B C49 H49C 109.5 . . ?
Si10 C50 H50A 109.5 . . ?
Si10 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
Si10 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
Si11 C51 H51A 109.5 . . ?
Si11 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
Si11 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
Si11 C52 H52A 109.5 . . ?
Si11 C52 H52B 109.5 . . ?
H52A C52 H52B 109.5 . . ?
Si11 C52 H52C 109.5 . . ?
H52A C52 H52C 109.5 . . ?
H52B C52 H52C 109.5 . . ?
Si11 C53 H53A 109.5 . . ?
Si11 C53 H53B 109.5 . . ?
H53A C53 H53B 109.5 . . ?
Si11 C53 H53C 109.5 . . ?
H53A C53 H53C 109.5 . . ?
H53B C53 H53C 109.5 . . ?
Si12 C54 H54A 109.5 . . ?
Si12 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
Si12 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 109.5 . . ?
Si12 C55 H55A 109.5 . . ?
Si12 C55 H55B 109.5 . . ?
H55A C55 H55B 109.5 . . ?
Si12 C55 H55C 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
Si12 C56 H56A 109.5 . . ?
Si12 C56 H56B 109.5 . . ?
H56A C56 H56B 109.5 . . ?
Si12 C56 H56C 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
N12 C57 H57A 109.5 . . ?
N12 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
N12 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
N12 C58 H58A 109.5 . . ?
N12 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
N12 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
N12 C59 C64 112.3(2) . . ?
N12 C59 C60 113.6(3) . . ?
C64 C59 C60 111.2(3) . . ?
N12 C59 H59 106.4 . . ?
C64 C59 H59 106.4 . . ?
C60 C59 H59 106.4 . . ?
C61 C60 C59 111.4(3) . . ?
C61 C60 H60A 109.3 . . ?
C59 C60 H60A 109.3 . . ?
C61 C60 H60B 109.3 . . ?
C59 C60 H60B 109.3 . . ?
H60A C60 H60B 108.0 . . ?
C62 C61 C60 110.1(3) . . ?
C62 C61 H61A 109.6 . . ?
C60 C61 H61A 109.6 . . ?
C62 C61 H61B 109.6 . . ?
C60 C61 H61B 109.6 . . ?
H61A C61 H61B 108.1 . . ?
C61 C62 C63 110.2(3) . . ?
C61 C62 H62A 109.6 . . ?
C63 C62 H62A 109.6 . . ?
C61 C62 H62B 109.6 . . ?
C63 C62 H62B 109.6 . . ?
H62A C62 H62B 108.1 . . ?
C62 C63 C64 111.6(3) . . ?
C62 C63 H63A 109.3 . . ?
C64 C63 H63A 109.3 . . ?
C62 C63 H63B 109.3 . . ?
C64 C63 H63B 109.3 . . ?
H63A C63 H63B 108.0 . . ?
N13 C64 C59 112.0(2) . . ?
N13 C64 C63 114.2(3) . . ?
C59 C64 C63 111.1(2) . . ?
N13 C64 H64 106.3 . . ?
C59 C64 H64 106.3 . . ?
C63 C64 H64 106.3 . . ?
N13 C65 H65A 109.5 . . ?
N13 C65 H65B 109.5 . . ?
H65A C65 H65B 109.5 . . ?
N13 C65 H65C 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
N13 C66 H66A 109.5 . . ?
N13 C66 H66B 109.5 . . ?
H66A C66 H66B 109.5 . . ?
N13 C66 H66C 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
N14 C67 H67A 109.5 . . ?
N14 C67 H67B 109.5 . . ?
H67A C67 H67B 109.5 . . ?
N14 C67 H67C 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
N14 C68 H68A 109.5 . . ?
N14 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
N14 C68 H68C 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
N14 C69 C74 111.9(2) . . ?
N14 C69 C70 114.4(2) . . ?
C74 C69 C70 110.3(3) . . ?
N14 C69 H69 106.6 . . ?
C74 C69 H69 106.6 . . ?
C70 C69 H69 106.6 . . ?
C71 C70 C69 112.1(3) . . ?
C71 C70 H70A 109.2 . . ?
C69 C70 H70A 109.2 . . ?
C71 C70 H70B 109.2 . . ?
C69 C70 H70B 109.2 . . ?
H70A C70 H70B 107.9 . . ?
C72 C71 C70 109.4(3) . . ?
C72 C71 H71A 109.8 . . ?
C70 C71 H71A 109.8 . . ?
C72 C71 H71B 109.8 . . ?
C70 C71 H71B 109.8 . . ?
H71A C71 H71B 108.2 . . ?
C71 C72 C73 110.0(3) . . ?
C71 C72 H72A 109.7 . . ?
C73 C72 H72A 109.7 . . ?
C71 C72 H72B 109.7 . . ?
C73 C72 H72B 109.7 . . ?
H72A C72 H72B 108.2 . . ?
C72 C73 C74 111.6(3) . . ?
C72 C73 H73A 109.3 . . ?
C74 C73 H73A 109.3 . . ?
C72 C73 H73B 109.3 . . ?
C74 C73 H73B 109.3 . . ?
H73A C73 H73B 108.0 . . ?
N15 C74 C69 111.2(2) . . ?
N15 C74 C73 113.7(2) . . ?
C69 C74 C73 110.3(2) . . ?
N15 C74 H74 107.1 . . ?
C69 C74 H74 107.1 . . ?
C73 C74 H74 107.1 . . ?
N15 C75 H75A 109.5 . . ?
N15 C75 H75B 109.5 . . ?
H75A C75 H75B 109.5 . . ?
N15 C75 H75C 109.5 . . ?
H75A C75 H75C 109.5 . . ?
H75B C75 H75C 109.5 . . ?
N15 C76 H76A 109.5 . . ?
N15 C76 H76B 109.5 . . ?
H76A C76 H76B 109.5 . . ?
N15 C76 H76C 109.5 . . ?
H76A C76 H76C 109.5 . . ?
H76B C76 H76C 109.5 . . ?
C78 C77 H77A 109.5 . . ?
C78 C77 H77B 109.5 . . ?
H77A C77 H77B 109.5 . . ?
C78 C77 H77C 109.5 . . ?
H77A C77 H77C 109.5 . . ?
H77B C77 H77C 109.5 . . ?
C79 C78 C83 118.0(4) . . ?
C79 C78 C77 121.1(4) . . ?
C83 C78 C77 120.8(4) . . ?
C78 C79 C80 122.5(4) . . ?
C78 C79 H79 118.8 . . ?
C80 C79 H79 118.8 . . ?
C81 C80 C79 117.7(4) . . ?
C81 C80 H80 121.2 . . ?
C79 C80 H80 121.2 . . ?
C82 C81 C80 120.8(4) . . ?
C82 C81 H81 119.6 . . ?
C80 C81 H81 119.6 . . ?
C81 C82 C83 120.7(4) . . ?
C81 C82 H82 119.7 . . ?
C83 C82 H82 119.7 . . ?
C82 C83 C78 120.4(4) . . ?
C82 C83 H83 119.8 . . ?
C78 C83 H83 119.8 . . ?
C85 C84 H84A 109.5 . . ?
C85 C84 H84B 109.5 . . ?
H84A C84 H84B 109.5 . . ?
C85 C84 H84C 109.5 . . ?
H84A C84 H84C 109.5 . . ?
H84B C84 H84C 109.5 . . ?
C86 C85 C90 117.7(4) . . ?
C86 C85 C84 121.5(4) . . ?
C90 C85 C84 120.8(4) . . ?
C87 C86 C85 120.7(4) . . ?
C87 C86 H86 119.6 . . ?
C85 C86 H86 119.6 . . ?
C86 C87 C88 120.4(4) . . ?
C86 C87 H87 119.8 . . ?
C88 C87 H87 119.8 . . ?
C89 C88 C87 119.3(4) . . ?
C89 C88 H88 120.3 . . ?
C87 C88 H88 120.3 . . ?
C90 C89 C88 121.4(4) . . ?
C90 C89 H89 119.3 . . ?
C88 C89 H89 119.3 . . ?
C89 C90 C85 120.5(4) . . ?
C89 C90 H90 119.7 . . ?
C85 C90 H90 119.7 . . ?
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
Mg1 N3 2.022(2) . ?
Mg1 N2 2.023(3) . ?
Mg1 N1 2.027(3) . ?
Mg1 Si6 3.1834(13) . ?
Mg1 Si1 3.1866(12) . ?
Mg1 Si4 3.2058(13) . ?
Mg1 Si3 3.2140(13) . ?
Mg1 Si5 3.2213(12) . ?
Mg1 Si2 3.2214(14) . ?
Mg2 N11 2.018(2) . ?
Mg2 N9 2.031(3) . ?
Mg2 N10 2.036(2) . ?
Mg2 Si12 3.1755(14) . ?
Mg2 Si9 3.2002(12) . ?
Mg2 Si7 3.2111(13) . ?
Mg2 Si8 3.2171(13) . ?
Mg2 Si11 3.2300(12) . ?
Mg2 Si10 3.2307(14) . ?
Li1 N6 2.129(6) . ?
Li1 N7 2.133(6) . ?
Li1 N8 2.152(6) . ?
Li1 N5 2.153(5) . ?
Li2 N15 2.131(6) . ?
Li2 N13 2.160(6) . ?
Li2 N14 2.170(5) . ?
Li2 N12 2.199(6) . ?
Si1 N1 1.711(2) . ?
Si1 C1 1.865(3) . ?
Si1 C3 1.879(3) . ?
Si1 C2 1.891(3) . ?
Si2 N1 1.690(3) . ?
Si2 C4 1.882(3) . ?
Si2 C6 1.883(3) . ?
Si2 C5 1.893(3) . ?
Si3 N2 1.704(2) . ?
Si3 C8 1.873(3) . ?
Si3 C7 1.875(3) . ?
Si3 C9 1.892(3) . ?
Si4 N2 1.694(2) . ?
Si4 C12 1.864(3) . ?
Si4 C11 1.887(3) . ?
Si4 C10 1.889(3) . ?
Si5 N3 1.698(2) . ?
Si5 C14 1.869(3) . ?
Si5 C13 1.878(3) . ?
Si5 C15 1.887(3) . ?
Si6 N3 1.694(3) . ?
Si6 C18 1.864(3) . ?
Si6 C17 1.869(3) . ?
Si6 C16 1.883(3) . ?
Si7 N9 1.696(3) . ?
Si7 C39 1.859(3) . ?
Si7 C41 1.880(3) . ?
Si7 C40 1.881(3) . ?
Si8 N9 1.704(3) . ?
Si8 C44 1.870(3) . ?
Si8 C42 1.880(3) . ?
Si8 C43 1.893(3) . ?
Si9 N10 1.701(2) . ?
Si9 C45 1.869(3) . ?
Si9 C47 1.879(3) . ?
Si9 C46 1.887(3) . ?
Si10 N10 1.698(3) . ?
Si10 C48 1.880(3) . ?
Si10 C50 1.887(3) . ?
Si10 C49 1.893(3) . ?
Si11 N11 1.697(2) . ?
Si11 C52 1.875(3) . ?
Si11 C53 1.880(3) . ?
Si11 C51 1.882(3) . ?
Si12 N11 1.703(2) . ?
Si12 C56 1.873(3) . ?
Si12 C55 1.878(3) . ?
Si12 C54 1.885(3) . ?
N5 C19 1.471(4) . ?
N5 C20 1.476(4) . ?
N5 C21 1.497(4) . ?
N6 C28 1.467(4) . ?
N6 C27 1.480(3) . ?
N6 C26 1.494(3) . ?
N7 C29 1.470(4) . ?
N7 C30 1.491(3) . ?
N7 C31 1.494(4) . ?
N8 C37 1.474(4) . ?
N8 C38 1.479(4) . ?
N8 C36 1.496(4) . ?
N12 C57 1.471(4) . ?
N12 C58 1.484(4) . ?
N12 C59 1.493(4) . ?
N13 C66 1.473(3) . ?
N13 C65 1.480(4) . ?
N13 C64 1.484(4) . ?
N14 C68 1.472(4) . ?
N14 C69 1.480(4) . ?
N14 C67 1.490(4) . ?
N15 C76 1.457(4) . ?
N15 C75 1.474(4) . ?
N15 C74 1.501(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 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 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 C26 1.540(4) . ?
C21 C22 1.545(4) . ?
C21 H21 1.0000 . ?
C22 C23 1.528(4) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C23 C24 1.512(4) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C24 C25 1.525(4) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 C26 1.530(4) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26 1.0000 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C31 C36 1.530(4) . ?
C31 C32 1.535(4) . ?
C31 H31 1.0000 . ?
C32 C33 1.504(5) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C33 C34 1.515(5) . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C34 C35 1.524(5) . ?
C34 H34A 0.9900 . ?
C34 H34B 0.9900 . ?
C35 C36 1.529(4) . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 H36 1.0000 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C39 H39C 0.9800 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C41 H41A 0.9800 . ?
C41 H41B 0.9800 . ?
C41 H41C 0.9800 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 H43A 0.9800 . ?
C43 H43B 0.9800 . ?
C43 H43C 0.9800 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
C45 H45A 0.9800 . ?
C45 H45B 0.9800 . ?
C45 H45C 0.9800 . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C46 H46C 0.9800 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C47 H47C 0.9800 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
C49 H49A 0.9800 . ?
C49 H49B 0.9800 . ?
C49 H49C 0.9800 . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C51 H51A 0.9800 . ?
C51 H51B 0.9800 . ?
C51 H51C 0.9800 . ?
C52 H52A 0.9800 . ?
C52 H52B 0.9800 . ?
C52 H52C 0.9800 . ?
C53 H53A 0.9800 . ?
C53 H53B 0.9800 . ?
C53 H53C 0.9800 . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
C55 H55A 0.9800 . ?
C55 H55B 0.9800 . ?
C55 H55C 0.9800 . ?
C56 H56A 0.9800 . ?
C56 H56B 0.9800 . ?
C56 H56C 0.9800 . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
C59 C64 1.518(4) . ?
C59 C60 1.537(4) . ?
C59 H59 1.0000 . ?
C60 C61 1.525(4) . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C61 C62 1.509(5) . ?
C61 H61A 0.9900 . ?
C61 H61B 0.9900 . ?
C62 C63 1.514(4) . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C63 C64 1.541(4) . ?
C63 H63A 0.9900 . ?
C63 H63B 0.9900 . ?
C64 H64 1.0000 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C66 H66A 0.9800 . ?
C66 H66B 0.9800 . ?
C66 H66C 0.9800 . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
C69 C74 1.529(4) . ?
C69 C70 1.538(4) . ?
C69 H69 1.0000 . ?
C70 C71 1.527(5) . ?
C70 H70A 0.9900 . ?
C70 H70B 0.9900 . ?
C71 C72 1.502(5) . ?
C71 H71A 0.9900 . ?
C71 H71B 0.9900 . ?
C72 C73 1.527(4) . ?
C72 H72A 0.9900 . ?
C72 H72B 0.9900 . ?
C73 C74 1.531(4) . ?
C73 H73A 0.9900 . ?
C73 H73B 0.9900 . ?
C74 H74 1.0000 . ?
C75 H75A 0.9800 . ?
C75 H75B 0.9800 . ?
C75 H75C 0.9800 . ?
C76 H76A 0.9800 . ?
C76 H76B 0.9800 . ?
C76 H76C 0.9800 . ?
C77 C78 1.499(5) . ?
C77 H77A 0.9800 . ?
C77 H77B 0.9800 . ?
C77 H77C 0.9800 . ?
C78 C79 1.373(5) . ?
C78 C83 1.386(5) . ?
C79 C80 1.389(5) . ?
C79 H79 0.9500 . ?
C80 C81 1.385(6) . ?
C80 H80 0.9500 . ?
C81 C82 1.359(6) . ?
C81 H81 0.9500 . ?
C82 C83 1.376(5) . ?
C82 H82 0.9500 . ?
C83 H83 0.9500 . ?
C84 C85 1.507(5) . ?
C84 H84A 0.9800 . ?
C84 H84B 0.9800 . ?
C84 H84C 0.9800 . ?
C85 C86 1.391(5) . ?
C85 C90 1.398(5) . ?
C86 C87 1.367(5) . ?
C86 H86 0.9500 . ?
C87 C88 1.377(5) . ?
C87 H87 0.9500 . ?
C88 C89 1.358(5) . ?
C88 H88 0.9500 . ?
C89 C90 1.356(5) . ?
C89 H89 0.9500 . ?
C90 H90 0.9500 . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N3 Mg1 Si1 N1 80.53(18) . . . . ?
N2 Mg1 Si1 N1 -129.72(17) . . . . ?
Si6 Mg1 Si1 N1 87.45(15) . . . . ?
Si4 Mg1 Si1 N1 -158.05(15) . . . . ?
Si3 Mg1 Si1 N1 -103.47(15) . . . . ?
Si5 Mg1 Si1 N1 59.04(17) . . . . ?
Si2 Mg1 Si1 N1 0.19(15) . . . . ?
N3 Mg1 Si1 C1 -105.34(15) . . . . ?
N2 Mg1 Si1 C1 44.41(14) . . . . ?
N1 Mg1 Si1 C1 174.13(19) . . . . ?
Si6 Mg1 Si1 C1 -98.42(11) . . . . ?
Si4 Mg1 Si1 C1 16.08(12) . . . . ?
Si3 Mg1 Si1 C1 70.66(11) . . . . ?
Si5 Mg1 Si1 C1 -126.83(14) . . . . ?
Si2 Mg1 Si1 C1 174.32(12) . . . . ?
N3 Mg1 Si1 C3 -5.14(18) . . . . ?
N2 Mg1 Si1 C3 144.61(16) . . . . ?
N1 Mg1 Si1 C3 -85.7(2) . . . . ?
Si6 Mg1 Si1 C3 1.78(15) . . . . ?
Si4 Mg1 Si1 C3 116.28(14) . . . . ?
Si3 Mg1 Si1 C3 170.86(14) . . . . ?
Si5 Mg1 Si1 C3 -26.63(19) . . . . ?
Si2 Mg1 Si1 C3 -85.48(14) . . . . ?
N3 Mg1 Si1 C2 155.54(17) . . . . ?
N2 Mg1 Si1 C2 -54.70(17) . . . . ?
N1 Mg1 Si1 C2 75.0(2) . . . . ?
Si6 Mg1 Si1 C2 162.46(15) . . . . ?
Si4 Mg1 Si1 C2 -83.04(15) . . . . ?
Si3 Mg1 Si1 C2 -28.45(15) . . . . ?
Si5 Mg1 Si1 C2 134.06(17) . . . . ?
Si2 Mg1 Si1 C2 75.21(15) . . . . ?
N3 Mg1 Si2 N1 -128.60(17) . . . . ?
N2 Mg1 Si2 N1 79.32(18) . . . . ?
Si6 Mg1 Si2 N1 -101.90(16) . . . . ?
Si1 Mg1 Si2 N1 -0.20(15) . . . . ?
Si4 Mg1 Si2 N1 60.00(18) . . . . ?
Si3 Mg1 Si2 N1 86.20(16) . . . . ?
Si5 Mg1 Si2 N1 -156.77(16) . . . . ?
N3 Mg1 Si2 C4 -49.75(16) . . . . ?
N2 Mg1 Si2 C4 158.17(16) . . . . ?
N1 Mg1 Si2 C4 78.8(2) . . . . ?
Si6 Mg1 Si2 C4 -23.05(15) . . . . ?
Si1 Mg1 Si2 C4 78.65(14) . . . . ?
Si4 Mg1 Si2 C4 138.85(16) . . . . ?
Si3 Mg1 Si2 C4 165.05(14) . . . . ?
Si5 Mg1 Si2 C4 -77.92(15) . . . . ?
N3 Mg1 Si2 C6 51.21(13) . . . . ?
N2 Mg1 Si2 C6 -100.86(15) . . . . ?
N1 Mg1 Si2 C6 179.8(2) . . . . ?
Si6 Mg1 Si2 C6 77.92(11) . . . . ?
Si1 Mg1 Si2 C6 179.62(12) . . . . ?
Si4 Mg1 Si2 C6 -120.18(15) . . . . ?
Si3 Mg1 Si2 C6 -93.98(12) . . . . ?
Si5 Mg1 Si2 C6 23.05(12) . . . . ?
N3 Mg1 Si2 C5 151.25(17) . . . . ?
N2 Mg1 Si2 C5 -0.82(19) . . . . ?
N1 Mg1 Si2 C5 -80.1(2) . . . . ?
Si6 Mg1 Si2 C5 177.95(15) . . . . ?
Si1 Mg1 Si2 C5 -80.34(15) . . . . ?
Si4 Mg1 Si2 C5 -20.15(19) . . . . ?
Si3 Mg1 Si2 C5 6.05(16) . . . . ?
Si5 Mg1 Si2 C5 123.09(15) . . . . ?
N3 Mg1 Si3 N2 62.73(17) . . . . ?
N1 Mg1 Si3 N2 -141.25(15) . . . . ?
Si6 Mg1 Si3 N2 34.99(16) . . . . ?
Si1 Mg1 Si3 N2 -112.91(13) . . . . ?
Si4 Mg1 Si3 N2 -1.20(13) . . . . ?
Si5 Mg1 Si3 N2 75.19(13) . . . . ?
Si2 Mg1 Si3 N2 -168.79(14) . . . . ?
N3 Mg1 Si3 C8 -95.98(15) . . . . ?
N2 Mg1 Si3 C8 -158.71(17) . . . . ?
N1 Mg1 Si3 C8 60.04(13) . . . . ?
Si6 Mg1 Si3 C8 -123.72(16) . . . . ?
Si1 Mg1 Si3 C8 88.38(11) . . . . ?
Si4 Mg1 Si3 C8 -159.91(11) . . . . ?
Si5 Mg1 Si3 C8 -83.52(11) . . . . ?
Si2 Mg1 Si3 C8 32.50(11) . . . . ?
N3 Mg1 Si3 C7 161.77(16) . . . . ?
N2 Mg1 Si3 C7 99.04(18) . . . . ?
N1 Mg1 Si3 C7 -42.21(14) . . . . ?
Si6 Mg1 Si3 C7 134.04(15) . . . . ?
Si1 Mg1 Si3 C7 -13.87(12) . . . . ?
Si4 Mg1 Si3 C7 97.84(12) . . . . ?
Si5 Mg1 Si3 C7 174.23(12) . . . . ?
Si2 Mg1 Si3 C7 -69.75(12) . . . . ?
N3 Mg1 Si3 C9 6.8(2) . . . . ?
N2 Mg1 Si3 C9 -55.9(2) . . . . ?
N1 Mg1 Si3 C9 162.81(18) . . . . ?
Si6 Mg1 Si3 C9 -20.9(2) . . . . ?
Si1 Mg1 Si3 C9 -168.85(16) . . . . ?
Si4 Mg1 Si3 C9 -57.14(17) . . . . ?
Si5 Mg1 Si3 C9 19.25(17) . . . . ?
Si2 Mg1 Si3 C9 135.28(17) . . . . ?
N3 Mg1 Si4 N2 -138.94(15) . . . . ?
N1 Mg1 Si4 N2 67.56(17) . . . . ?
Si6 Mg1 Si4 N2 -166.32(14) . . . . ?
Si1 Mg1 Si4 N2 82.65(13) . . . . ?
Si3 Mg1 Si4 N2 1.21(13) . . . . ?
Si5 Mg1 Si4 N2 -112.77(13) . . . . ?
Si2 Mg1 Si4 N2 32.65(15) . . . . ?
N3 Mg1 Si4 C12 48.30(11) . . . . ?
N2 Mg1 Si4 C12 -172.76(16) . . . . ?
N1 Mg1 Si4 C12 -105.20(15) . . . . ?
Si6 Mg1 Si4 C12 20.91(9) . . . . ?
Si1 Mg1 Si4 C12 -90.11(9) . . . . ?
Si3 Mg1 Si4 C12 -171.55(9) . . . . ?
Si5 Mg1 Si4 C12 74.47(9) . . . . ?
Si2 Mg1 Si4 C12 -140.12(13) . . . . ?
N3 Mg1 Si4 C11 149.99(17) . . . . ?
N2 Mg1 Si4 C11 -71.1(2) . . . . ?
N1 Mg1 Si4 C11 -3.5(2) . . . . ?
Si6 Mg1 Si4 C11 122.61(15) . . . . ?
Si1 Mg1 Si4 C11 11.58(16) . . . . ?
Si3 Mg1 Si4 C11 -69.86(15) . . . . ?
Si5 Mg1 Si4 C11 176.16(15) . . . . ?
Si2 Mg1 Si4 C11 -38.42(19) . . . . ?
N3 Mg1 Si4 C10 -52.65(16) . . . . ?
N2 Mg1 Si4 C10 86.29(19) . . . . ?
N1 Mg1 Si4 C10 153.85(18) . . . . ?
Si6 Mg1 Si4 C10 -80.04(14) . . . . ?
Si1 Mg1 Si4 C10 168.93(14) . . . . ?
Si3 Mg1 Si4 C10 87.49(14) . . . . ?
Si5 Mg1 Si4 C10 -26.48(14) . . . . ?
Si2 Mg1 Si4 C10 118.93(16) . . . . ?
N2 Mg1 Si5 N3 -133.38(18) . . . . ?
N1 Mg1 Si5 N3 72.06(19) . . . . ?
Si6 Mg1 Si5 N3 3.55(15) . . . . ?
Si1 Mg1 Si5 N3 37.99(18) . . . . ?
Si4 Mg1 Si5 N3 -107.63(16) . . . . ?
Si3 Mg1 Si5 N3 -160.58(16) . . . . ?
Si2 Mg1 Si5 N3 86.21(15) . . . . ?
N3 Mg1 Si5 C14 -71.6(2) . . . . ?
N2 Mg1 Si5 C14 154.99(16) . . . . ?
N1 Mg1 Si5 C14 0.43(19) . . . . ?
Si6 Mg1 Si5 C14 -68.08(15) . . . . ?
Si1 Mg1 Si5 C14 -33.64(19) . . . . ?
Si4 Mg1 Si5 C14 -179.26(15) . . . . ?
Si3 Mg1 Si5 C14 127.79(15) . . . . ?
Si2 Mg1 Si5 C14 14.58(15) . . . . ?
N3 Mg1 Si5 C13 -173.91(19) . . . . ?
N2 Mg1 Si5 C13 52.71(13) . . . . ?
N1 Mg1 Si5 C13 -101.85(15) . . . . ?
Si6 Mg1 Si5 C13 -170.36(11) . . . . ?
Si1 Mg1 Si5 C13 -135.91(14) . . . . ?
Si4 Mg1 Si5 C13 78.46(11) . . . . ?
Si3 Mg1 Si5 C13 25.51(11) . . . . ?
Si2 Mg1 Si5 C13 -87.69(11) . . . . ?
N3 Mg1 Si5 C15 84.4(2) . . . . ?
N2 Mg1 Si5 C15 -49.02(15) . . . . ?
N1 Mg1 Si5 C15 156.43(16) . . . . ?
Si6 Mg1 Si5 C15 87.92(13) . . . . ?
Si1 Mg1 Si5 C15 122.36(15) . . . . ?
Si4 Mg1 Si5 C15 -23.27(13) . . . . ?
Si3 Mg1 Si5 C15 -76.21(13) . . . . ?
Si2 Mg1 Si5 C15 170.58(13) . . . . ?
N2 Mg1 Si6 N3 65.95(17) . . . . ?
N1 Mg1 Si6 N3 -139.60(17) . . . . ?
Si1 Mg1 Si6 N3 -168.67(15) . . . . ?
Si4 Mg1 Si6 N3 74.73(15) . . . . ?
Si3 Mg1 Si6 N3 44.13(18) . . . . ?
Si5 Mg1 Si6 N3 -3.45(14) . . . . ?
Si2 Mg1 Si6 N3 -112.76(15) . . . . ?
N3 Mg1 Si6 C18 103.87(18) . . . . ?
N2 Mg1 Si6 C18 169.82(14) . . . . ?
N1 Mg1 Si6 C18 -35.73(13) . . . . ?
Si1 Mg1 Si6 C18 -64.79(11) . . . . ?
Si4 Mg1 Si6 C18 178.60(11) . . . . ?
Si3 Mg1 Si6 C18 148.00(15) . . . . ?
Si5 Mg1 Si6 C18 100.43(11) . . . . ?
Si2 Mg1 Si6 C18 -8.89(11) . . . . ?
N3 Mg1 Si6 C17 -151.91(19) . . . . ?
N2 Mg1 Si6 C17 -85.96(16) . . . . ?
N1 Mg1 Si6 C17 68.48(14) . . . . ?
Si1 Mg1 Si6 C17 39.42(13) . . . . ?
Si4 Mg1 Si6 C17 -77.18(13) . . . . ?
Si3 Mg1 Si6 C17 -107.78(17) . . . . ?
Si5 Mg1 Si6 C17 -155.36(13) . . . . ?
Si2 Mg1 Si6 C17 95.33(13) . . . . ?
N3 Mg1 Si6 C16 -48.8(2) . . . . ?
N2 Mg1 Si6 C16 17.1(2) . . . . ?
N1 Mg1 Si6 C16 171.57(18) . . . . ?
Si1 Mg1 Si6 C16 142.51(17) . . . . ?
Si4 Mg1 Si6 C16 25.91(18) . . . . ?
Si3 Mg1 Si6 C16 -4.7(2) . . . . ?
Si5 Mg1 Si6 C16 -52.27(17) . . . . ?
Si2 Mg1 Si6 C16 -161.58(17) . . . . ?
N11 Mg2 Si7 N9 -64.87(17) . . . . ?
N10 Mg2 Si7 N9 140.46(15) . . . . ?
Si12 Mg2 Si7 N9 -37.95(17) . . . . ?
Si9 Mg2 Si7 N9 112.08(14) . . . . ?
Si8 Mg2 Si7 N9 1.85(13) . . . . ?
Si11 Mg2 Si7 N9 -76.69(14) . . . . ?
Si10 Mg2 Si7 N9 168.25(14) . . . . ?
N11 Mg2 Si7 C39 88.21(16) . . . . ?
N9 Mg2 Si7 C39 153.08(18) . . . . ?
N10 Mg2 Si7 C39 -66.45(13) . . . . ?
Si12 Mg2 Si7 C39 115.13(16) . . . . ?
Si9 Mg2 Si7 C39 -94.83(12) . . . . ?
Si8 Mg2 Si7 C39 154.93(12) . . . . ?
Si11 Mg2 Si7 C39 76.39(12) . . . . ?
Si10 Mg2 Si7 C39 -38.67(12) . . . . ?
N11 Mg2 Si7 C41 -14.5(2) . . . . ?
N9 Mg2 Si7 C41 50.4(2) . . . . ?
N10 Mg2 Si7 C41 -169.13(19) . . . . ?
Si12 Mg2 Si7 C41 12.5(2) . . . . ?
Si9 Mg2 Si7 C41 162.49(18) . . . . ?
Si8 Mg2 Si7 C41 52.26(18) . . . . ?
Si11 Mg2 Si7 C41 -26.28(19) . . . . ?
Si10 Mg2 Si7 C41 -141.34(18) . . . . ?
N11 Mg2 Si7 C40 -168.58(16) . . . . ?
N9 Mg2 Si7 C40 -103.71(18) . . . . ?
N10 Mg2 Si7 C40 36.76(14) . . . . ?
Si12 Mg2 Si7 C40 -141.66(16) . . . . ?
Si9 Mg2 Si7 C40 8.37(13) . . . . ?
Si8 Mg2 Si7 C40 -101.86(12) . . . . ?
Si11 Mg2 Si7 C40 179.60(12) . . . . ?
Si10 Mg2 Si7 C40 64.54(13) . . . . ?
N11 Mg2 Si8 N9 137.30(15) . . . . ?
N10 Mg2 Si8 N9 -70.15(17) . . . . ?
Si12 Mg2 Si8 N9 165.38(14) . . . . ?
Si9 Mg2 Si8 N9 -87.23(14) . . . . ?
Si7 Mg2 Si8 N9 -1.84(13) . . . . ?
Si11 Mg2 Si8 N9 111.34(13) . . . . ?
Si10 Mg2 Si8 N9 -33.55(15) . . . . ?
N11 Mg2 Si8 C44 -46.87(12) . . . . ?
N9 Mg2 Si8 C44 175.83(16) . . . . ?
N10 Mg2 Si8 C44 105.68(15) . . . . ?
Si12 Mg2 Si8 C44 -18.80(10) . . . . ?
Si9 Mg2 Si8 C44 88.59(10) . . . . ?
Si7 Mg2 Si8 C44 173.98(10) . . . . ?
Si11 Mg2 Si8 C44 -72.84(10) . . . . ?
Si10 Mg2 Si8 C44 142.27(12) . . . . ?
N11 Mg2 Si8 C42 -148.17(16) . . . . ?
N9 Mg2 Si8 C42 74.52(19) . . . . ?
N10 Mg2 Si8 C42 4.4(2) . . . . ?
Si12 Mg2 Si8 C42 -120.10(14) . . . . ?
Si9 Mg2 Si8 C42 -12.71(15) . . . . ?
Si7 Mg2 Si8 C42 72.68(14) . . . . ?
Si11 Mg2 Si8 C42 -174.14(14) . . . . ?
Si10 Mg2 Si8 C42 40.97(18) . . . . ?
N11 Mg2 Si8 C43 53.03(16) . . . . ?
N9 Mg2 Si8 C43 -84.27(19) . . . . ?
N10 Mg2 Si8 C43 -154.42(18) . . . . ?
Si12 Mg2 Si8 C43 81.10(15) . . . . ?
Si9 Mg2 Si8 C43 -171.51(14) . . . . ?
Si7 Mg2 Si8 C43 -86.11(14) . . . . ?
Si11 Mg2 Si8 C43 27.06(15) . . . . ?
Si10 Mg2 Si8 C43 -117.83(16) . . . . ?
N11 Mg2 Si9 N10 -84.32(17) . . . . ?
N9 Mg2 Si9 N10 125.08(17) . . . . ?
Si12 Mg2 Si9 N10 -91.14(15) . . . . ?
Si7 Mg2 Si9 N10 98.32(15) . . . . ?
Si8 Mg2 Si9 N10 154.21(15) . . . . ?
Si11 Mg2 Si9 N10 -65.13(17) . . . . ?
Si10 Mg2 Si9 N10 -0.41(15) . . . . ?
N11 Mg2 Si9 C45 -152.59(16) . . . . ?
N9 Mg2 Si9 C45 56.80(17) . . . . ?
N10 Mg2 Si9 C45 -68.3(2) . . . . ?
Si12 Mg2 Si9 C45 -159.42(14) . . . . ?
Si7 Mg2 Si9 C45 30.05(15) . . . . ?
Si8 Mg2 Si9 C45 85.93(15) . . . . ?
Si11 Mg2 Si9 C45 -133.41(15) . . . . ?
Si10 Mg2 Si9 C45 -68.68(15) . . . . ?
N11 Mg2 Si9 C47 107.40(14) . . . . ?
N9 Mg2 Si9 C47 -43.21(14) . . . . ?
N10 Mg2 Si9 C47 -168.29(19) . . . . ?
Si12 Mg2 Si9 C47 100.57(11) . . . . ?
Si7 Mg2 Si9 C47 -69.96(11) . . . . ?
Si8 Mg2 Si9 C47 -14.08(11) . . . . ?
Si11 Mg2 Si9 C47 126.58(13) . . . . ?
Si10 Mg2 Si9 C47 -168.69(11) . . . . ?
N11 Mg2 Si9 C46 5.21(16) . . . . ?
N9 Mg2 Si9 C46 -145.39(15) . . . . ?
N10 Mg2 Si9 C46 89.53(19) . . . . ?
Si12 Mg2 Si9 C46 -1.61(13) . . . . ?
Si7 Mg2 Si9 C46 -172.15(12) . . . . ?
Si8 Mg2 Si9 C46 -116.26(13) . . . . ?
Si11 Mg2 Si9 C46 24.40(16) . . . . ?
Si10 Mg2 Si9 C46 89.12(13) . . . . ?
N11 Mg2 Si10 N10 123.90(17) . . . . ?
N9 Mg2 Si10 N10 -84.67(17) . . . . ?
Si12 Mg2 Si10 N10 96.69(16) . . . . ?
Si9 Mg2 Si10 N10 0.42(15) . . . . ?
Si7 Mg2 Si10 N10 -91.62(16) . . . . ?
Si8 Mg2 Si10 N10 -65.43(17) . . . . ?
Si11 Mg2 Si10 N10 151.85(16) . . . . ?
N11 Mg2 Si10 C48 -48.10(13) . . . . ?
N9 Mg2 Si10 C48 103.33(14) . . . . ?
N10 Mg2 Si10 C48 -172.00(19) . . . . ?
Si12 Mg2 Si10 C48 -75.32(11) . . . . ?
Si9 Mg2 Si10 C48 -171.59(11) . . . . ?
Si7 Mg2 Si10 C48 96.37(11) . . . . ?
Si8 Mg2 Si10 C48 122.57(13) . . . . ?
Si11 Mg2 Si10 C48 -20.16(11) . . . . ?
N11 Mg2 Si10 C50 52.78(15) . . . . ?
N9 Mg2 Si10 C50 -155.79(15) . . . . ?
N10 Mg2 Si10 C50 -71.1(2) . . . . ?
Si12 Mg2 Si10 C50 25.57(14) . . . . ?
Si9 Mg2 Si10 C50 -70.70(14) . . . . ?
Si7 Mg2 Si10 C50 -162.74(13) . . . . ?
Si8 Mg2 Si10 C50 -136.54(15) . . . . ?
Si11 Mg2 Si10 C50 80.73(14) . . . . ?
N11 Mg2 Si10 C49 -149.99(14) . . . . ?
N9 Mg2 Si10 C49 1.44(15) . . . . ?
N10 Mg2 Si10 C49 86.11(19) . . . . ?
Si12 Mg2 Si10 C49 -177.20(11) . . . . ?
Si9 Mg2 Si10 C49 86.53(12) . . . . ?
Si7 Mg2 Si10 C49 -5.51(12) . . . . ?
Si8 Mg2 Si10 C49 20.68(15) . . . . ?
Si11 Mg2 Si10 C49 -122.04(12) . . . . ?
N9 Mg2 Si11 N11 134.06(17) . . . . ?
N10 Mg2 Si11 N11 -70.83(18) . . . . ?
Si12 Mg2 Si11 N11 -4.14(15) . . . . ?
Si9 Mg2 Si11 N11 -35.99(16) . . . . ?
Si7 Mg2 Si11 N11 161.51(15) . . . . ?
Si8 Mg2 Si11 N11 107.79(15) . . . . ?
Si10 Mg2 Si11 N11 -87.59(15) . . . . ?
N11 Mg2 Si11 C52 74.6(2) . . . . ?
N9 Mg2 Si11 C52 -151.33(16) . . . . ?
N10 Mg2 Si11 C52 3.78(18) . . . . ?
Si12 Mg2 Si11 C52 70.47(14) . . . . ?
Si9 Mg2 Si11 C52 38.62(17) . . . . ?
Si7 Mg2 Si11 C52 -123.88(14) . . . . ?
Si8 Mg2 Si11 C52 -177.60(14) . . . . ?
Si10 Mg2 Si11 C52 -12.98(15) . . . . ?
N11 Mg2 Si11 C53 -82.59(19) . . . . ?
N9 Mg2 Si11 C53 51.46(15) . . . . ?
N10 Mg2 Si11 C53 -153.42(16) . . . . ?
Si12 Mg2 Si11 C53 -86.73(13) . . . . ?
Si9 Mg2 Si11 C53 -118.58(15) . . . . ?
Si7 Mg2 Si11 C53 78.91(13) . . . . ?
Si8 Mg2 Si11 C53 25.20(13) . . . . ?
Si10 Mg2 Si11 C53 -170.19(13) . . . . ?
N11 Mg2 Si11 C51 175.39(19) . . . . ?
N9 Mg2 Si11 C51 -50.56(14) . . . . ?
N10 Mg2 Si11 C51 104.56(15) . . . . ?
Si12 Mg2 Si11 C51 171.24(11) . . . . ?
Si9 Mg2 Si11 C51 139.40(13) . . . . ?
Si7 Mg2 Si11 C51 -23.11(11) . . . . ?
Si8 Mg2 Si11 C51 -76.83(11) . . . . ?
Si10 Mg2 Si11 C51 87.79(11) . . . . ?
N9 Mg2 Si12 N11 -65.73(17) . . . . ?
N10 Mg2 Si12 N11 140.03(16) . . . . ?
Si9 Mg2 Si12 N11 168.40(14) . . . . ?
Si7 Mg2 Si12 N11 -41.54(17) . . . . ?
Si8 Mg2 Si12 N11 -75.44(14) . . . . ?
Si11 Mg2 Si12 N11 3.92(14) . . . . ?
Si10 Mg2 Si12 N11 112.76(14) . . . . ?
N11 Mg2 Si12 C56 40.8(2) . . . . ?
N9 Mg2 Si12 C56 -24.9(2) . . . . ?
N10 Mg2 Si12 C56 -179.15(18) . . . . ?
Si9 Mg2 Si12 C56 -150.78(17) . . . . ?
Si7 Mg2 Si12 C56 -0.7(2) . . . . ?
Si8 Mg2 Si12 C56 -34.62(18) . . . . ?
Si11 Mg2 Si12 C56 44.73(17) . . . . ?
Si10 Mg2 Si12 C56 153.57(17) . . . . ?
N11 Mg2 Si12 C55 -109.15(18) . . . . ?
N9 Mg2 Si12 C55 -174.87(14) . . . . ?
N10 Mg2 Si12 C55 30.89(13) . . . . ?
Si9 Mg2 Si12 C55 59.26(11) . . . . ?
Si7 Mg2 Si12 C55 -150.68(15) . . . . ?
Si8 Mg2 Si12 C55 175.42(11) . . . . ?
Si11 Mg2 Si12 C55 -105.23(11) . . . . ?
Si10 Mg2 Si12 C55 3.61(11) . . . . ?
N11 Mg2 Si12 C54 145.59(18) . . . . ?
N9 Mg2 Si12 C54 79.87(15) . . . . ?
N10 Mg2 Si12 C54 -74.37(13) . . . . ?
Si9 Mg2 Si12 C54 -46.00(11) . . . . ?
Si7 Mg2 Si12 C54 104.06(16) . . . . ?
Si8 Mg2 Si12 C54 70.16(11) . . . . ?
Si11 Mg2 Si12 C54 149.51(11) . . . . ?
Si10 Mg2 Si12 C54 -101.65(11) . . . . ?
C4 Si2 N1 Si1 58.6(2) . . . . ?
C6 Si2 N1 Si1 179.44(17) . . . . ?
C5 Si2 N1 Si1 -61.8(2) . . . . ?
Mg1 Si2 N1 Si1 179.6(3) . . . . ?
C4 Si2 N1 Mg1 -120.99(17) . . . . ?
C6 Si2 N1 Mg1 -0.2(2) . . . . ?
C5 Si2 N1 Mg1 118.53(18) . . . . ?
C1 Si1 N1 Si2 174.27(17) . . . . ?
C3 Si1 N1 Si2 -66.8(2) . . . . ?
C2 Si1 N1 Si2 55.8(2) . . . . ?
Mg1 Si1 N1 Si2 -179.6(3) . . . . ?
C1 Si1 N1 Mg1 -6.1(2) . . . . ?
C3 Si1 N1 Mg1 112.89(17) . . . . ?
C2 Si1 N1 Mg1 -124.56(16) . . . . ?
N3 Mg1 N1 Si2 60.82(19) . . . . ?
N2 Mg1 N1 Si2 -119.74(15) . . . . ?
Si6 Mg1 N1 Si2 81.48(15) . . . . ?
Si1 Mg1 N1 Si2 179.7(3) . . . . ?
Si4 Mg1 N1 Si2 -149.81(10) . . . . ?
Si3 Mg1 N1 Si2 -99.84(14) . . . . ?
Si5 Mg1 N1 Si2 30.6(2) . . . . ?
N3 Mg1 N1 Si1 -118.83(14) . . . . ?
N2 Mg1 N1 Si1 60.60(19) . . . . ?
Si6 Mg1 N1 Si1 -98.17(13) . . . . ?
Si4 Mg1 N1 Si1 30.5(2) . . . . ?
Si3 Mg1 N1 Si1 80.50(14) . . . . ?
Si5 Mg1 N1 Si1 -149.01(10) . . . . ?
Si2 Mg1 N1 Si1 -179.7(3) . . . . ?
C12 Si4 N2 Si3 -170.03(13) . . . . ?
C11 Si4 N2 Si3 -50.6(2) . . . . ?
C10 Si4 N2 Si3 70.28(19) . . . . ?
Mg1 Si4 N2 Si3 -177.8(2) . . . . ?
C12 Si4 N2 Mg1 7.76(17) . . . . ?
C11 Si4 N2 Mg1 127.19(16) . . . . ?
C10 Si4 N2 Mg1 -111.93(16) . . . . ?
C8 Si3 N2 Si4 -159.61(15) . . . . ?
C7 Si3 N2 Si4 81.21(18) . . . . ?
C9 Si3 N2 Si4 -40.41(19) . . . . ?
Mg1 Si3 N2 Si4 177.8(2) . . . . ?
C8 Si3 N2 Mg1 22.60(18) . . . . ?
C7 Si3 N2 Mg1 -96.58(16) . . . . ?
C9 Si3 N2 Mg1 141.80(14) . . . . ?
N3 Mg1 N2 Si4 47.67(17) . . . . ?
N1 Mg1 N2 Si4 -131.77(13) . . . . ?
Si6 Mg1 N2 Si4 18.33(18) . . . . ?
Si1 Mg1 N2 Si4 -106.16(11) . . . . ?
Si3 Mg1 N2 Si4 -177.9(2) . . . . ?
Si5 Mg1 N2 Si4 69.92(12) . . . . ?
Si2 Mg1 N2 Si4 -163.38(8) . . . . ?
N3 Mg1 N2 Si3 -134.46(13) . . . . ?
N1 Mg1 N2 Si3 46.09(17) . . . . ?
Si6 Mg1 N2 Si3 -163.81(8) . . . . ?
Si1 Mg1 N2 Si3 71.70(12) . . . . ?
Si4 Mg1 N2 Si3 177.9(2) . . . . ?
Si5 Mg1 N2 Si3 -112.22(11) . . . . ?
Si2 Mg1 N2 Si3 14.49(17) . . . . ?
C18 Si6 N3 Si5 83.98(19) . . . . ?
C17 Si6 N3 Si5 -156.09(18) . . . . ?
C16 Si6 N3 Si5 -38.1(2) . . . . ?
Mg1 Si6 N3 Si5 173.6(3) . . . . ?
C18 Si6 N3 Mg1 -89.65(16) . . . . ?
C17 Si6 N3 Mg1 30.3(2) . . . . ?
C16 Si6 N3 Mg1 148.30(15) . . . . ?
C14 Si5 N3 Si6 -47.6(2) . . . . ?
C13 Si5 N3 Si6 -167.05(16) . . . . ?
C15 Si5 N3 Si6 72.9(2) . . . . ?
Mg1 Si5 N3 Si6 -173.5(3) . . . . ?
C14 Si5 N3 Mg1 125.93(17) . . . . ?
C13 Si5 N3 Mg1 6.4(2) . . . . ?
C15 Si5 N3 Mg1 -113.57(17) . . . . ?
N2 Mg1 N3 Si6 -131.88(14) . . . . ?
N1 Mg1 N3 Si6 47.57(19) . . . . ?
Si1 Mg1 N3 Si6 14.46(19) . . . . ?
Si4 Mg1 N3 Si6 -111.65(13) . . . . ?
Si3 Mg1 N3 Si6 -159.89(9) . . . . ?
Si5 Mg1 N3 Si6 173.8(3) . . . . ?
Si2 Mg1 N3 Si6 71.82(14) . . . . ?
N2 Mg1 N3 Si5 54.32(19) . . . . ?
N1 Mg1 N3 Si5 -126.23(15) . . . . ?
Si6 Mg1 N3 Si5 -173.8(3) . . . . ?
Si1 Mg1 N3 Si5 -159.34(10) . . . . ?
Si4 Mg1 N3 Si5 74.55(14) . . . . ?
Si3 Mg1 N3 Si5 26.3(2) . . . . ?
Si2 Mg1 N3 Si5 -101.98(14) . . . . ?
N6 Li1 N5 C19 103.7(3) . . . . ?
N7 Li1 N5 C19 -128.6(3) . . . . ?
N8 Li1 N5 C19 -23.6(4) . . . . ?
N6 Li1 N5 C20 -136.6(2) . . . . ?
N7 Li1 N5 C20 -8.8(4) . . . . ?
N8 Li1 N5 C20 96.1(4) . . . . ?
N6 Li1 N5 C21 -16.8(3) . . . . ?
N7 Li1 N5 C21 110.9(3) . . . . ?
N8 Li1 N5 C21 -144.2(3) . . . . ?
N7 Li1 N6 C28 -11.7(4) . . . . ?
N8 Li1 N6 C28 -118.2(3) . . . . ?
N5 Li1 N6 C28 110.6(2) . . . . ?
N7 Li1 N6 C27 106.7(3) . . . . ?
N8 Li1 N6 C27 0.3(4) . . . . ?
N5 Li1 N6 C27 -130.9(2) . . . . ?
N7 Li1 N6 C26 -132.9(3) . . . . ?
N8 Li1 N6 C26 120.7(3) . . . . ?
N5 Li1 N6 C26 -10.5(3) . . . . ?
N6 Li1 N7 C29 85.3(4) . . . . ?
N8 Li1 N7 C29 -149.2(3) . . . . ?
N5 Li1 N7 C29 -20.1(4) . . . . ?
N6 Li1 N7 C30 -33.8(4) . . . . ?
N8 Li1 N7 C30 91.7(2) . . . . ?
N5 Li1 N7 C30 -139.1(3) . . . . ?
N6 Li1 N7 C31 -151.6(3) . . . . ?
N8 Li1 N7 C31 -26.1(2) . . . . ?
N5 Li1 N7 C31 103.1(3) . . . . ?
N6 Li1 N8 C37 5.6(4) . . . . ?
N7 Li1 N8 C37 -122.4(2) . . . . ?
N5 Li1 N8 C37 115.7(3) . . . . ?
N6 Li1 N8 C38 -111.2(3) . . . . ?
N7 Li1 N8 C38 120.8(2) . . . . ?
N5 Li1 N8 C38 -1.1(4) . . . . ?
N6 Li1 N8 C36 129.2(3) . . . . ?
N7 Li1 N8 C36 1.2(2) . . . . ?
N5 Li1 N8 C36 -120.7(3) . . . . ?
C39 Si7 N9 Si8 154.54(16) . . . . ?
C41 Si7 N9 Si8 37.0(2) . . . . ?
C40 Si7 N9 Si8 -85.86(19) . . . . ?
Mg2 Si7 N9 Si8 -176.6(2) . . . . ?
C39 Si7 N9 Mg2 -28.86(19) . . . . ?
C41 Si7 N9 Mg2 -146.40(15) . . . . ?
C40 Si7 N9 Mg2 90.74(17) . . . . ?
C44 Si8 N9 Si7 172.17(14) . . . . ?
C42 Si8 N9 Si7 53.1(2) . . . . ?
C43 Si8 N9 Si7 -68.9(2) . . . . ?
Mg2 Si8 N9 Si7 176.6(2) . . . . ?
C44 Si8 N9 Mg2 -4.44(17) . . . . ?
C42 Si8 N9 Mg2 -123.51(16) . . . . ?
C43 Si8 N9 Mg2 114.45(16) . . . . ?
N11 Mg2 N9 Si7 133.13(13) . . . . ?
N10 Mg2 N9 Si7 -47.14(18) . . . . ?
Si12 Mg2 N9 Si7 163.24(8) . . . . ?
Si9 Mg2 N9 Si7 -74.06(13) . . . . ?
Si8 Mg2 N9 Si7 -176.7(2) . . . . ?
Si11 Mg2 N9 Si7 111.16(12) . . . . ?
Si10 Mg2 N9 Si7 -14.81(17) . . . . ?
N11 Mg2 N9 Si8 -50.14(17) . . . . ?
N10 Mg2 N9 Si8 129.59(13) . . . . ?
Si12 Mg2 N9 Si8 -20.02(19) . . . . ?
Si9 Mg2 N9 Si8 102.67(12) . . . . ?
Si7 Mg2 N9 Si8 176.7(2) . . . . ?
Si11 Mg2 N9 Si8 -72.10(12) . . . . ?
Si10 Mg2 N9 Si8 161.92(8) . . . . ?
C48 Si10 N10 Si9 -170.85(16) . . . . ?
C50 Si10 N10 Si9 -50.5(2) . . . . ?
C49 Si10 N10 Si9 69.4(2) . . . . ?
Mg2 Si10 N10 Si9 -179.2(3) . . . . ?
C48 Si10 N10 Mg2 8.4(2) . . . . ?
C50 Si10 N10 Mg2 128.72(15) . . . . ?
C49 Si10 N10 Mg2 -111.33(16) . . . . ?
C45 Si9 N10 Si10 -49.5(2) . . . . ?
C47 Si9 N10 Si10 -168.50(16) . . . . ?
C46 Si9 N10 Si10 70.8(2) . . . . ?
Mg2 Si9 N10 Si10 179.2(3) . . . . ?
C45 Si9 N10 Mg2 131.23(15) . . . . ?
C47 Si9 N10 Mg2 12.3(2) . . . . ?
C46 Si9 N10 Mg2 -108.45(17) . . . . ?
N11 Mg2 N10 Si10 -65.92(18) . . . . ?
N9 Mg2 N10 Si10 114.35(15) . . . . ?
Si12 Mg2 N10 Si10 -86.43(14) . . . . ?
Si9 Mg2 N10 Si10 -179.3(3) . . . . ?
Si7 Mg2 N10 Si10 94.09(14) . . . . ?
Si8 Mg2 N10 Si10 145.22(10) . . . . ?
Si11 Mg2 N10 Si10 -36.8(2) . . . . ?
N11 Mg2 N10 Si9 113.35(15) . . . . ?
N9 Mg2 N10 Si9 -66.39(18) . . . . ?
Si12 Mg2 N10 Si9 92.83(13) . . . . ?
Si7 Mg2 N10 Si9 -86.64(14) . . . . ?
Si8 Mg2 N10 Si9 -35.5(2) . . . . ?
Si11 Mg2 N10 Si9 142.51(10) . . . . ?
Si10 Mg2 N10 Si9 179.3(3) . . . . ?
C52 Si11 N11 Si12 48.6(2) . . . . ?
C53 Si11 N11 Si12 -72.8(2) . . . . ?
C51 Si11 N11 Si12 167.60(16) . . . . ?
Mg2 Si11 N11 Si12 172.5(3) . . . . ?
C52 Si11 N11 Mg2 -123.88(17) . . . . ?
C53 Si11 N11 Mg2 114.73(17) . . . . ?
C51 Si11 N11 Mg2 -4.9(2) . . . . ?
C56 Si12 N11 Si11 32.6(2) . . . . ?
C55 Si12 N11 Si11 -89.60(18) . . . . ?
C54 Si12 N11 Si11 149.86(17) . . . . ?
Mg2 Si12 N11 Si11 -172.7(3) . . . . ?
C56 Si12 N11 Mg2 -154.67(14) . . . . ?
C55 Si12 N11 Mg2 83.14(17) . . . . ?
C54 Si12 N11 Mg2 -37.40(18) . . . . ?
N9 Mg2 N11 Si11 -53.95(19) . . . . ?
N10 Mg2 N11 Si11 126.31(14) . . . . ?
Si12 Mg2 N11 Si11 172.9(2) . . . . ?
Si9 Mg2 N11 Si11 158.63(10) . . . . ?
Si7 Mg2 N11 Si11 -25.1(2) . . . . ?
Si8 Mg2 N11 Si11 -75.20(14) . . . . ?
Si10 Mg2 N11 Si11 100.67(13) . . . . ?
N9 Mg2 N11 Si12 133.19(13) . . . . ?
N10 Mg2 N11 Si12 -46.55(18) . . . . ?
Si9 Mg2 N11 Si12 -14.24(18) . . . . ?
Si7 Mg2 N11 Si12 162.03(8) . . . . ?
Si8 Mg2 N11 Si12 111.94(12) . . . . ?
Si11 Mg2 N11 Si12 -172.9(2) . . . . ?
Si10 Mg2 N11 Si12 -72.20(13) . . . . ?
N15 Li2 N12 C57 -1.3(4) . . . . ?
N13 Li2 N12 C57 -133.4(2) . . . . ?
N14 Li2 N12 C57 105.2(4) . . . . ?
N15 Li2 N12 C58 -118.7(3) . . . . ?
N13 Li2 N12 C58 109.1(2) . . . . ?
N14 Li2 N12 C58 -12.3(4) . . . . ?
N15 Li2 N12 C59 122.1(3) . . . . ?
N13 Li2 N12 C59 -10.1(2) . . . . ?
N14 Li2 N12 C59 -131.5(3) . . . . ?
N15 Li2 N13 C66 -14.4(4) . . . . ?
N14 Li2 N13 C66 -122.2(3) . . . . ?
N12 Li2 N13 C66 104.8(2) . . . . ?
N15 Li2 N13 C65 102.2(3) . . . . ?
N14 Li2 N13 C65 -5.6(4) . . . . ?
N12 Li2 N13 C65 -138.6(2) . . . . ?
N15 Li2 N13 C64 -134.0(3) . . . . ?
N14 Li2 N13 C64 118.1(3) . . . . ?
N12 Li2 N13 C64 -14.8(2) . . . . ?
N15 Li2 N14 C68 112.6(2) . . . . ?
N13 Li2 N14 C68 -114.0(3) . . . . ?
N12 Li2 N14 C68 -7.9(4) . . . . ?
N15 Li2 N14 C69 -6.9(3) . . . . ?
N13 Li2 N14 C69 126.5(3) . . . . ?
N12 Li2 N14 C69 -127.4(3) . . . . ?
N15 Li2 N14 C67 -129.9(2) . . . . ?
N13 Li2 N14 C67 3.5(4) . . . . ?
N12 Li2 N14 C67 109.6(4) . . . . ?
N13 Li2 N15 C76 -21.6(4) . . . . ?
N14 Li2 N15 C76 100.9(2) . . . . ?
N12 Li2 N15 C76 -125.9(3) . . . . ?
N13 Li2 N15 C75 96.3(4) . . . . ?
N14 Li2 N15 C75 -141.2(2) . . . . ?
N12 Li2 N15 C75 -8.0(4) . . . . ?
N13 Li2 N15 C74 -141.0(3) . . . . ?
N14 Li2 N15 C74 -18.5(2) . . . . ?
N12 Li2 N15 C74 114.7(3) . . . . ?
C19 N5 C21 C26 -76.7(3) . . . . ?
C20 N5 C21 C26 163.2(2) . . . . ?
Li1 N5 C21 C26 41.2(3) . . . . ?
C19 N5 C21 C22 48.9(3) . . . . ?
C20 N5 C21 C22 -71.2(3) . . . . ?
Li1 N5 C21 C22 166.8(2) . . . . ?
N5 C21 C22 C23 -179.4(3) . . . . ?
C26 C21 C22 C23 -54.2(4) . . . . ?
C21 C22 C23 C24 60.0(4) . . . . ?
C22 C23 C24 C25 -60.8(4) . . . . ?
C23 C24 C25 C26 57.9(4) . . . . ?
C28 N6 C26 C25 46.4(3) . . . . ?
C27 N6 C26 C25 -74.9(3) . . . . ?
Li1 N6 C26 C25 163.2(3) . . . . ?
C28 N6 C26 C21 -80.6(3) . . . . ?
C27 N6 C26 C21 158.1(3) . . . . ?
Li1 N6 C26 C21 36.2(3) . . . . ?
C24 C25 C26 N6 -179.6(2) . . . . ?
C24 C25 C26 C21 -53.0(4) . . . . ?
N5 C21 C26 N6 -54.1(3) . . . . ?
C22 C21 C26 N6 178.7(2) . . . . ?
N5 C21 C26 C25 177.5(2) . . . . ?
C22 C21 C26 C25 50.3(3) . . . . ?
C29 N7 C31 C36 173.4(3) . . . . ?
C30 N7 C31 C36 -65.6(3) . . . . ?
Li1 N7 C31 C36 47.3(3) . . . . ?
C29 N7 C31 C32 -60.7(3) . . . . ?
C30 N7 C31 C32 60.2(3) . . . . ?
Li1 N7 C31 C32 173.1(2) . . . . ?
N7 C31 C32 C33 179.6(3) . . . . ?
C36 C31 C32 C33 -54.3(3) . . . . ?
C31 C32 C33 C34 56.9(4) . . . . ?
C32 C33 C34 C35 -57.7(4) . . . . ?
C33 C34 C35 C36 58.0(4) . . . . ?
C37 N8 C36 C35 -81.4(3) . . . . ?
C38 N8 C36 C35 37.6(3) . . . . ?
Li1 N8 C36 C35 151.1(2) . . . . ?
C37 N8 C36 C31 151.7(3) . . . . ?
C38 N8 C36 C31 -89.4(3) . . . . ?
Li1 N8 C36 C31 24.2(3) . . . . ?
C34 C35 C36 N8 176.6(3) . . . . ?
C34 C35 C36 C31 -56.4(3) . . . . ?
N7 C31 C36 N8 -49.4(3) . . . . ?
C32 C31 C36 N8 -177.8(2) . . . . ?
N7 C31 C36 C35 -178.4(2) . . . . ?
C32 C31 C36 C35 53.2(3) . . . . ?
C57 N12 C59 C64 159.9(3) . . . . ?
C58 N12 C59 C64 -79.0(3) . . . . ?
Li2 N12 C59 C64 33.7(3) . . . . ?
C57 N12 C59 C60 -72.9(3) . . . . ?
C58 N12 C59 C60 48.2(3) . . . . ?
Li2 N12 C59 C60 160.9(2) . . . . ?
N12 C59 C60 C61 177.5(3) . . . . ?
C64 C59 C60 C61 -54.7(3) . . . . ?
C59 C60 C61 C62 57.7(4) . . . . ?
C60 C61 C62 C63 -59.0(4) . . . . ?
C61 C62 C63 C64 57.9(4) . . . . ?
C66 N13 C64 C59 -75.9(3) . . . . ?
C65 N13 C64 C59 163.4(2) . . . . ?
Li2 N13 C64 C59 38.0(3) . . . . ?
C66 N13 C64 C63 51.4(3) . . . . ?
C65 N13 C64 C63 -69.3(3) . . . . ?
Li2 N13 C64 C63 165.3(2) . . . . ?
N12 C59 C64 N13 -50.0(3) . . . . ?
C60 C59 C64 N13 -178.5(2) . . . . ?
N12 C59 C64 C63 -179.0(2) . . . . ?
C60 C59 C64 C63 52.6(3) . . . . ?
C62 C63 C64 N13 177.4(3) . . . . ?
C62 C63 C64 C59 -54.8(3) . . . . ?
C68 N14 C69 C74 -81.5(3) . . . . ?
C67 N14 C69 C74 157.6(2) . . . . ?
Li2 N14 C69 C74 31.6(3) . . . . ?
C68 N14 C69 C70 44.8(4) . . . . ?
C67 N14 C69 C70 -76.1(3) . . . . ?
Li2 N14 C69 C70 157.8(3) . . . . ?
N14 C69 C70 C71 177.3(3) . . . . ?
C74 C69 C70 C71 -55.6(4) . . . . ?
C69 C70 C71 C72 58.3(4) . . . . ?
C70 C71 C72 C73 -59.0(4) . . . . ?
C71 C72 C73 C74 59.3(4) . . . . ?
C76 N15 C74 C69 -71.7(3) . . . . ?
C75 N15 C74 C69 167.8(3) . . . . ?
Li2 N15 C74 C69 41.2(3) . . . . ?
C76 N15 C74 C73 53.6(4) . . . . ?
C75 N15 C74 C73 -66.9(3) . . . . ?
Li2 N15 C74 C73 166.5(3) . . . . ?
N14 C69 C74 N15 -50.8(3) . . . . ?
C70 C69 C74 N15 -179.2(2) . . . . ?
N14 C69 C74 C73 -177.9(2) . . . . ?
C70 C69 C74 C73 53.6(3) . . . . ?
C72 C73 C74 N15 177.9(3) . . . . ?
C72 C73 C74 C69 -56.3(4) . . . . ?
C83 C78 C79 C80 1.4(5) . . . . ?
C77 C78 C79 C80 -177.5(3) . . . . ?
C78 C79 C80 C81 -2.0(5) . . . . ?
C79 C80 C81 C82 1.6(5) . . . . ?
C80 C81 C82 C83 -0.6(6) . . . . ?
C81 C82 C83 C78 -0.2(5) . . . . ?
C79 C78 C83 C82 -0.2(5) . . . . ?
C77 C78 C83 C82 178.6(3) . . . . ?
C90 C85 C86 C87 -0.3(4) . . . . ?
C84 C85 C86 C87 -179.3(3) . . . . ?
C85 C86 C87 C88 0.4(5) . . . . ?
C86 C87 C88 C89 -1.0(5) . . . . ?
C87 C88 C89 C90 1.6(5) . . . . ?
C88 C89 C90 C85 -1.6(5) . . . . ?
C86 C85 C90 C89 0.9(5) . . . . ?
C84 C85 C90 C89 179.9(3) . . . . ?
