#------------------------------------------------------------------------------
#$Date: 2025-07-01 14:36:35 +0300 (Tue, 01 Jul 2025) $
#$Revision: 1301 $
#$URL: svn://crystallography.net/testcod/cif/1/00/00/1000025.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_1000025
loop_
_publ_author_name
'Weidner, Eveline'
'Dolci, Francesco'
'Hu, Jianjiang'
'Lohstroh, Wiebke'
'Hansen, Thomas'
'Bull, Daniel J.'
'Fichtner, Maximilian'
_publ_section_title
;
 Hydrogenation Reaction Pathway in Li2Mg(NH)2
;
_journal_issue                   35
_journal_name_full               'The Journal of Physical Chemistry C'
_journal_page_first              15772
_journal_page_last               15777
_journal_paper_doi               10.1021/jp9034997
_journal_volume                  113
_journal_year                    2009
_chemical_formula_sum            'H4 Li2.79 Mg2.66 N4'
_chemical_formula_weight         144.04
_space_group_IT_number           121
_space_group_name_Hall           'I -4 2'
_space_group_name_H-M_alt        'I -4 2 m'
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_H-M   'I -4 2 m'
_audit_creation_date             2009-01-26T14:57
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2009-01-26T14:57  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            2
_cell_length_a                   5.12981(22)
_cell_length_b                   5.12981
_cell_length_c                   9.6191(7)
_cell_volume                     253.13(2)
_computing_structure_refinement  GSAS
_diffrn_radiation_polarisn_ratio 0.7
_diffrn_radiation_probe          x-ray
_exptl_absorpt_correction_T_max  0.61193
_exptl_absorpt_correction_T_min  0.59617
_exptl_absorpt_process_details
;   GSAS Absorption/surface roughness correction: function number 0
 Debye-Scherrer absorption correction
Term (= MU.r/wave) =     0.20000    
Correction is not refined.
;
_pd_block_id
2009-01-26T14:57|LI2MG2N3H3_XRAY_TETR|Li2Mg2N3H3|Bruker_D8
_pd_calc_method                  'Rietveld Refinement'
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.05
_pd_meas_2theta_range_max        89.85
_pd_meas_2theta_range_min        10.05
_pd_meas_number_of_points        1597
_pd_phase_name                   Li2Mg2N3H3
_pd_proc_2theta_range_inc        0.05
_pd_proc_2theta_range_max        89.9054
_pd_proc_2theta_range_min        10.1054
_pd_proc_info_datetime           2009-01-26T14:57:15
_pd_proc_info_excluded_regions   ' ?'
_pd_proc_ls_background_function
;   GSAS Background function number 1 with  6 terms.
 Shifted Chebyshev function of 1st kind
      1:    48.9703     2:    1.06925     3:   -13.8808     4:    6.67673    
      5:   0.678183     6:   -4.33426    
;
_pd_proc_ls_peak_cutoff          0.00050
_pd_proc_ls_profile_function
;
 CW Profile function number 5 with  15 terms
 Profile function not installed.
 This is an error & should not happen!
 Peak tails are ignored  where the intensity is below 0.0005 times the peak
   Aniso. broadening axis   0.0   0.0   1.0
;
_pd_proc_ls_prof_R_factor        0.1210
_pd_proc_ls_prof_wR_expected     0.0968
_pd_proc_ls_prof_wR_factor       0.1609
_pd_proc_number_of_points        1597
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   1.67
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_constraints    2
_refine_ls_number_parameters     16
_refine_ls_number_restraints     0
_refine_ls_R_Fsqd_factor         0.17219
_refine_ls_shift/su_max          0.07
_refine_ls_shift/su_mean         0.02
_refine_ls_weighting_scheme      sigma
_reflns_d_resolution_high        1.116
_reflns_d_resolution_low         4.810
_reflns_limit_h_max              5
_reflns_limit_h_min              0
_reflns_limit_k_max              3
_reflns_limit_k_min              0
_reflns_limit_l_max              9
_reflns_limit_l_min              0
_reflns_number_total             88
_cod_data_source_file            jp9034997_si_001.cif
_cod_data_source_block           LI2MG2N3H3_XRAY_TETR_publ
_cod_original_cell_volume        253.125(29)
_cod_original_formula_sum        'H4.00 Li2.79 Mg2.66 N4'
_cod_database_code               1000025
_gsas_exptl_extinct_corr_t_min   1.00000
_gsas_exptl_extinct_corr_t_max   1.00000
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +x,+y,+z
2 +y,-x,-z
3 -x,-y,+z
4 -y,+x,-z
5 -x,+y,-z
6 +y,+x,+z
7 +x,-y,-z
8 -y,-x,+z
101 +x+1/2,+y+1/2,+z+1/2
102 +y+1/2,-x+1/2,-z+1/2
103 -x+1/2,-y+1/2,+z+1/2
104 -y+1/2,+x+1/2,-z+1/2
105 -x+1/2,+y+1/2,-z+1/2
106 +y+1/2,+x+1/2,+z+1/2
107 +x+1/2,-y+1/2,-z+1/2
108 -y+1/2,-x+1/2,+z+1/2
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_thermal_displace_type
_atom_site_U_iso_or_equiv
_atom_site_symmetry_multiplicity
Li Li2 0.0 0.5 0.0 0.224(27) Uiso 0.025 4
N N 0.2691(7) 0.2691(7) 0.1371(5) 1.0 Uiso 0.0115(17) 8
Li Li3 0.0 0.5 0.25 0.171(7) Uiso 0.0376(15) 4
Li Li5 0.0 0.0 0.76156 1.0 Uiso 0.064(8) 4
Mg Mg3 0.0 0.5 0.25 0.829(7) Uiso 0.0376(15) 4
Mg Mg4 0.0 0.0 0.5 1.0 Uiso 0.0333(18) 2
H H 0.22477 0.14472 0.07203 0.5 Uiso 0.025 16
loop_
_atom_type_symbol
_atom_type_number_in_cell
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
N 8.0 0.000 0.000 12.2126 0.00570 3.13220 9.89330 2.01250 28.9975 1.16630
0.58260 -11.529 International_Tables_Vol_C
Li 5.577 0.000 0.000 1.12820 3.95460 0.75080 1.05240 0.61750 85.3905 0.46530
168.261 0.03770 International_Tables_Vol_C
H 8.0 0.000 0.000 0.49300 10.5109 0.32291 26.1257 0.14019 3.14236 0.04081
57.7997 0.00304 International_Tables_Vol_C
Mg 5.318 0.000 0.000 5.42040 2.82750 2.17350 79.2611 1.22690 0.38080 2.30730
7.19370 0.85840 International_Tables_Vol_C
loop_
_diffrn_radiation_wavelength
_diffrn_radiation_wavelength_wt
_diffrn_radiation_type
_diffrn_radiation_wavelength_id
1.540500 1.000 K\a~1~ 1
1.544300 0.500 K\a~2~ 2
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_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N Li2 N 104.19(26) 1_555 . 2_565 N
N Li2 N 108.11(21) 1_555 . 3_565 N
N Li2 N 116.36(25) 1_555 . 4_555 N
N Li2 Li3 54.05(10) 1_555 . 1_555 N
N Li2 Li3 125.95(10) 1_555 . 5_555 N
N Li2 Mg3 54.05(10) 1_555 . 1_555 N
N Li2 Mg3 125.95(10) 1_555 . 5_555 N
N Li2 Mg4 127.90(13) 1_555 . 101_454 N
N Li2 Mg4 52.10(13) 1_555 . 101_554 N
N Li2 H 23.58(12) 1_555 . 1_555 N
N Li2 H 113.56(13) 1_555 . 2_565 N
N Li2 H 123.88(10) 1_555 . 3_565 N
N Li2 H 93.90(13) 1_555 . 4_555 N
N Li2 H 93.90(13) 1_555 . 5_555 N
N Li2 H 22.46(12) 1_555 . 6_555 N
N Li2 H 106.92(13) 1_555 . 7_565 N
N Li2 H 117.16(11) 1_555 . 8_565 N
N Li2 N 116.36(25) 2_565 . 3_565 N
N Li2 N 108.11(21) 2_565 . 4_555 N
N Li2 Li3 125.95(10) 2_565 . 1_555 N
N Li2 Li3 54.05(10) 2_565 . 5_555 N
N Li2 Mg3 125.95(10) 2_565 . 1_555 N
N Li2 Mg3 54.05(10) 2_565 . 5_555 N
N Li2 Mg4 127.90(13) 2_565 . 101_454 N
N Li2 Mg4 52.10(13) 2_565 . 101_554 N
N Li2 H 106.92(13) 2_565 . 1_555 N
N Li2 H 22.46(12) 2_565 . 2_565 N
N Li2 H 93.90(13) 2_565 . 3_565 N
N Li2 H 117.16(11) 2_565 . 4_555 N
N Li2 H 123.88(10) 2_565 . 5_555 N
N Li2 H 113.56(13) 2_565 . 6_555 N
N Li2 H 23.58(12) 2_565 . 7_565 N
N Li2 H 93.90(13) 2_565 . 8_565 N
N Li2 N 104.19(26) 3_565 . 4_555 N
N Li2 Li3 54.05(10) 3_565 . 1_555 N
N Li2 Li3 125.95(10) 3_565 . 5_555 N
N Li2 Mg3 54.05(10) 3_565 . 1_555 N
N Li2 Mg3 125.95(10) 3_565 . 5_555 N
N Li2 Mg4 52.10(13) 3_565 . 101_454 N
N Li2 Mg4 127.90(13) 3_565 . 101_554 N
N Li2 H 123.88(10) 3_565 . 1_555 N
N Li2 H 93.90(13) 3_565 . 2_565 N
N Li2 H 23.58(12) 3_565 . 3_565 N
N Li2 H 113.56(13) 3_565 . 4_555 N
N Li2 H 106.92(13) 3_565 . 5_555 N
N Li2 H 117.16(11) 3_565 . 6_555 N
N Li2 H 93.90(13) 3_565 . 7_565 N
N Li2 H 22.46(12) 3_565 . 8_565 N
N Li2 Li3 125.95(10) 4_555 . 1_555 N
N Li2 Li3 54.05(10) 4_555 . 5_555 N
N Li2 Mg3 125.95(10) 4_555 . 1_555 N
N Li2 Mg3 54.05(10) 4_555 . 5_555 N
N Li2 Mg4 52.10(13) 4_555 . 101_454 N
N Li2 Mg4 127.90(13) 4_555 . 101_554 N
N Li2 H 93.90(13) 4_555 . 1_555 N
N Li2 H 117.16(11) 4_555 . 2_565 N
N Li2 H 106.92(13) 4_555 . 3_565 N
N Li2 H 22.46(12) 4_555 . 4_555 N
N Li2 H 23.58(12) 4_555 . 5_555 N
N Li2 H 93.90(13) 4_555 . 6_555 N
N Li2 H 123.88(10) 4_555 . 7_565 N
N Li2 H 113.56(13) 4_555 . 8_565 N
Li3 Li2 Li3 180.0 1_555 . 5_555 N
Li3 Li2 Mg3 0.0 1_555 . 1_555 N
Li3 Li2 Mg3 180.0 1_555 . 5_555 N
Li3 Li2 Mg4 90.0 1_555 . 101_454 N
Li3 Li2 Mg4 90.0 1_555 . 101_554 N
Li3 Li2 H 72.1902(15) 1_555 . 1_555 N
Li3 Li2 H 113.4766(18) 1_555 . 2_565 N
Li3 Li2 H 72.1902(15) 1_555 . 3_565 N
Li3 Li2 H 113.4766(18) 1_555 . 4_555 N
Li3 Li2 H 107.8097(15) 1_555 . 5_555 N
Li3 Li2 H 66.5234(18) 1_555 . 6_555 N
Li3 Li2 H 107.8097(15) 1_555 . 7_565 N
Li3 Li2 H 66.5234(18) 1_555 . 8_565 N
Li3 Li2 Mg3 180.0 5_555 . 1_555 N
Li3 Li2 Mg3 0.0 5_555 . 5_555 N
Li3 Li2 Mg4 90.0 5_555 . 101_454 N
Li3 Li2 Mg4 90.0 5_555 . 101_554 N
Li3 Li2 H 107.8097(15) 5_555 . 1_555 N
Li3 Li2 H 66.5234(18) 5_555 . 2_565 N
Li3 Li2 H 107.8097(15) 5_555 . 3_565 N
Li3 Li2 H 66.5234(18) 5_555 . 4_555 N
Li3 Li2 H 72.1902(15) 5_555 . 5_555 N
Li3 Li2 H 113.4766(18) 5_555 . 6_555 N
Li3 Li2 H 72.1902(15) 5_555 . 7_565 N
Li3 Li2 H 113.4766(18) 5_555 . 8_565 N
Mg3 Li2 Mg3 180.0 1_555 . 5_555 N
Mg3 Li2 Mg4 90.0 1_555 . 101_454 N
Mg3 Li2 Mg4 90.0 1_555 . 101_554 N
Mg3 Li2 H 72.1902(15) 1_555 . 1_555 N
Mg3 Li2 H 113.4766(18) 1_555 . 2_565 N
Mg3 Li2 H 72.1902(15) 1_555 . 3_565 N
Mg3 Li2 H 113.4766(18) 1_555 . 4_555 N
Mg3 Li2 H 107.8097(15) 1_555 . 5_555 N
Mg3 Li2 H 66.5234(18) 1_555 . 6_555 N
Mg3 Li2 H 107.8097(15) 1_555 . 7_565 N
Mg3 Li2 H 66.5234(18) 1_555 . 8_565 N
Mg3 Li2 Mg4 90.0 5_555 . 101_454 N
Mg3 Li2 Mg4 90.0 5_555 . 101_554 N
Mg3 Li2 H 107.8097(15) 5_555 . 1_555 N
Mg3 Li2 H 66.5234(18) 5_555 . 2_565 N
Mg3 Li2 H 107.8097(15) 5_555 . 3_565 N
Mg3 Li2 H 66.5234(18) 5_555 . 4_555 N
Mg3 Li2 H 72.1902(15) 5_555 . 5_555 N
Mg3 Li2 H 113.4766(18) 5_555 . 6_555 N
Mg3 Li2 H 72.1902(15) 5_555 . 7_565 N
Mg3 Li2 H 113.4766(18) 5_555 . 8_565 N
Mg4 Li2 Mg4 180.0 101_454 . 101_554 N
Mg4 Li2 H 120.59860(30) 101_454 . 1_555 N
Mg4 Li2 H 115.2693(4) 101_454 . 2_565 N
Mg4 Li2 H 59.40140(30) 101_454 . 3_565 N
Mg4 Li2 H 64.7307(4) 101_454 . 4_555 N
Mg4 Li2 H 59.40140(30) 101_454 . 5_555 N
Mg4 Li2 H 115.2693(4) 101_454 . 6_555 N
Mg4 Li2 H 120.59860(30) 101_454 . 7_565 N
Mg4 Li2 H 64.7307(4) 101_454 . 8_565 N
Mg4 Li2 H 59.40140(30) 101_554 . 1_555 N
Mg4 Li2 H 64.7307(4) 101_554 . 2_565 N
Mg4 Li2 H 120.59860(30) 101_554 . 3_565 N
Mg4 Li2 H 115.2693(4) 101_554 . 4_555 N
Mg4 Li2 H 120.59860(30) 101_554 . 5_555 N
Mg4 Li2 H 64.7307(4) 101_554 . 6_555 N
Mg4 Li2 H 59.40140(30) 101_554 . 7_565 N
Mg4 Li2 H 115.2693(4) 101_554 . 8_565 N
H Li2 H 123.9000(6) 1_555 . 2_565 N
H Li2 H 144.3805(29) 1_555 . 3_565 N
H Li2 H 71.6963(17) 1_555 . 4_555 N
H Li2 H 72.8605(13) 1_555 . 5_555 N
H Li2 H 7.10550(30) 1_555 . 6_555 N
H Li2 H 118.8028(6) 1_555 . 7_565 N
H Li2 H 138.4717(33) 1_555 . 8_565 N
H Li2 H 71.6963(17) 2_565 . 3_565 N
H Li2 H 133.047(4) 2_565 . 4_555 N
H Li2 H 138.4717(33) 2_565 . 5_555 N
H Li2 H 129.4614(8) 2_565 . 6_555 N
H Li2 H 7.10550(30) 2_565 . 7_565 N
H Li2 H 71.4487(22) 2_565 . 8_565 N
H Li2 H 123.9000(6) 3_565 . 4_555 N
H Li2 H 118.8028(6) 3_565 . 5_555 N
H Li2 H 138.4717(33) 3_565 . 6_555 N
H Li2 H 72.8605(13) 3_565 . 7_565 N
H Li2 H 7.10550(30) 3_565 . 8_565 N
H Li2 H 7.10560(30) 4_555 . 5_555 N
H Li2 H 71.4487(22) 4_555 . 6_555 N
H Li2 H 138.4717(33) 4_555 . 7_565 N
H Li2 H 129.4614(8) 4_555 . 8_565 N
H Li2 H 71.6963(17) 5_555 . 6_555 N
H Li2 H 144.3805(29) 5_555 . 7_565 N
H Li2 H 123.9000(6) 5_555 . 8_565 N
H Li2 H 123.9000(6) 6_555 . 7_565 N
H Li2 H 133.047(4) 6_555 . 8_565 N
H Li2 H 71.6963(17) 7_565 . 8_565 N
Li2 N Li2 107.65(20) 1_555 . 2_555 N
Li2 N Li3 66.782(18) 1_555 . 1_555 N
Li2 N Li3 171.11(26) 1_555 . 6_555 N
Li2 N Li5 101.96(16) 1_555 . 2_556 N
Li2 N Li5 113.04(16) 1_555 . 101_554 N
Li2 N Mg3 66.782(18) 1_555 . 1_555 N
Li2 N Mg3 171.11(26) 1_555 . 6_555 N
Li2 N Mg4 71.66(13) 1_555 . 101_554 N
Li2 N H 79.33(23) 1_555 . 1_555 N
Li2 N H 46.09(12) 1_555 . 6_555 N
Li2 N Li3 171.11(26) 2_555 . 1_555 N
Li2 N Li3 66.782(18) 2_555 . 6_555 N
Li2 N Li5 101.96(16) 2_555 . 2_556 N
Li2 N Li5 113.04(16) 2_555 . 101_554 N
Li2 N Mg3 171.11(26) 2_555 . 1_555 N
Li2 N Mg3 66.782(18) 2_555 . 6_555 N
Li2 N Mg4 71.66(13) 2_555 . 101_554 N
Li2 N H 46.09(12) 2_555 . 1_555 N
Li2 N H 79.33(23) 2_555 . 6_555 N
Li3 N Li3 117.77(23) 1_555 . 6_555 N
Li3 N Li5 73.30(14) 1_555 . 2_556 N
Li3 N Li5 75.83(14) 1_555 . 101_554 N
Li3 N Mg3 0.0 1_555 . 1_555 N
Li3 N Mg3 117.77(23) 1_555 . 6_555 N
Li3 N Mg4 111.62(15) 1_555 . 101_554 N
Li3 N H 125.04(30) 1_555 . 1_555 N
Li3 N H 92.01(14) 1_555 . 6_555 N
Li3 N Li5 73.30(14) 6_555 . 2_556 N
Li3 N Li5 75.83(14) 6_555 . 101_554 N
Li3 N Mg3 117.77(23) 6_555 . 1_555 N
Li3 N Mg3 0.0 6_555 . 6_555 N
Li3 N Mg4 111.62(15) 6_555 . 101_554 N
Li3 N H 92.01(14) 6_555 . 1_555 N
Li3 N H 125.04(30) 6_555 . 6_555 N
Li5 N Li5 117.92(23) 2_556 . 101_554 N
Li5 N Mg3 73.30(14) 2_556 . 1_555 N
Li5 N Mg3 73.30(14) 2_556 . 6_555 N
Li5 N Mg4 168.32(27) 2_556 . 101_554 N
Li5 N H 73.13(31) 2_556 . 1_555 N
Li5 N H 73.13(31) 2_556 . 6_555 N
Li5 N Mg3 75.83(14) 101_554 . 1_555 N
Li5 N Mg3 75.83(14) 101_554 . 6_555 N
Li5 N Mg4 73.76(17) 101_554 . 101_554 N
Li5 N H 159.13(24) 101_554 . 1_555 N
Li5 N H 159.13(24) 101_554 . 6_555 N
Mg3 N Mg3 117.77(23) 1_555 . 6_555 N
Mg3 N Mg4 111.62(15) 1_555 . 101_554 N
Mg3 N H 125.04(30) 1_555 . 1_555 N
Mg3 N H 92.01(14) 1_555 . 6_555 N
Mg3 N Mg4 111.62(15) 6_555 . 101_554 N
Mg3 N H 92.01(14) 6_555 . 1_555 N
Mg3 N H 125.04(30) 6_555 . 6_555 N
Mg4 N H 95.81(35) 101_554 . 1_555 N
Mg4 N H 95.81(35) 101_554 . 6_555 N
H N H 36.70(20) 1_555 . 6_555 N
Li2 Li3 Li2 180.0 1_555 . 102_455 N
Li2 Li3 N 59.16(12) 1_555 . 1_555 N
Li2 Li3 N 59.16(12) 1_555 . 3_565 N
Li2 Li3 N 120.84(12) 1_555 . 102_455 N
Li2 Li3 N 120.84(12) 1_555 . 104_555 N
Li2 Li3 Li5 87.51720(20) 1_555 . 2_556 N
Li2 Li3 Li5 87.51720(20) 1_555 . 2_566 N
Li2 Li3 Li5 92.48280(20) 1_555 . 101_454 N
Li2 Li3 Li5 92.48280(20) 1_555 . 101_554 N
Li2 Li3 H 42.9777(25) 1_555 . 6_555 N
Li2 Li3 H 42.9777(25) 1_555 . 8_565 N
Li2 Li3 H 137.0223(25) 1_555 . 105_555 N
Li2 Li3 H 137.0223(25) 1_555 . 107_455 N
Li2 Li3 N 120.84(12) 102_455 . 1_555 N
Li2 Li3 N 120.84(12) 102_455 . 3_565 N
Li2 Li3 N 59.16(12) 102_455 . 102_455 N
Li2 Li3 N 59.16(12) 102_455 . 104_555 N
Li2 Li3 Li5 92.48280(20) 102_455 . 2_556 N
Li2 Li3 Li5 92.48280(20) 102_455 . 2_566 N
Li2 Li3 Li5 87.51720(20) 102_455 . 101_454 N
Li2 Li3 Li5 87.51720(20) 102_455 . 101_554 N
Li2 Li3 H 137.0223(25) 102_455 . 6_555 N
Li2 Li3 H 137.0223(25) 102_455 . 8_565 N
Li2 Li3 H 42.9777(25) 102_455 . 105_555 N
Li2 Li3 H 42.9777(25) 102_455 . 107_455 N
N Li3 N 118.33(23) 1_555 . 3_565 N
N Li3 N 105.23(11) 1_555 . 102_455 N
N Li3 N 105.23(11) 1_555 . 104_555 N
N Li3 Li5 54.49(14) 1_555 . 2_556 N
N Li3 Li5 122.44(13) 1_555 . 2_566 N
N Li3 Li5 132.31(14) 1_555 . 101_454 N
N Li3 Li5 51.04(14) 1_555 . 101_554 N
N Li3 H 23.20(13) 1_555 . 6_555 N
N Li3 H 99.74(12) 1_555 . 8_565 N
N Li3 H 99.17(13) 1_555 . 105_555 N
N Li3 H 126.21(13) 1_555 . 107_455 N
N Li3 N 105.23(11) 3_565 . 102_455 N
N Li3 N 105.23(11) 3_565 . 104_555 N
N Li3 Li5 122.44(13) 3_565 . 2_556 N
N Li3 Li5 54.49(14) 3_565 . 2_566 N
N Li3 Li5 51.04(14) 3_565 . 101_454 N
N Li3 Li5 132.31(14) 3_565 . 101_554 N
N Li3 H 99.74(12) 3_565 . 6_555 N
N Li3 H 23.20(13) 3_565 . 8_565 N
N Li3 H 126.21(13) 3_565 . 105_555 N
N Li3 H 99.17(13) 3_565 . 107_455 N
N Li3 N 118.33(23) 102_455 . 104_555 N
N Li3 Li5 51.04(14) 102_455 . 2_556 N
N Li3 Li5 132.31(14) 102_455 . 2_566 N
N Li3 Li5 54.49(14) 102_455 . 101_454 N
N Li3 Li5 122.44(13) 102_455 . 101_554 N
N Li3 H 99.17(13) 102_455 . 6_555 N
N Li3 H 126.21(13) 102_455 . 8_565 N
N Li3 H 99.74(12) 102_455 . 105_555 N
N Li3 H 23.20(13) 102_455 . 107_455 N
N Li3 Li5 132.31(14) 104_555 . 2_556 N
N Li3 Li5 51.04(14) 104_555 . 2_566 N
N Li3 Li5 122.44(13) 104_555 . 101_454 N
N Li3 Li5 54.49(14) 104_555 . 101_554 N
N Li3 H 126.21(13) 104_555 . 6_555 N
N Li3 H 99.17(13) 104_555 . 8_565 N
N Li3 H 23.20(13) 104_555 . 105_555 N
N Li3 H 99.74(12) 104_555 . 107_455 N
Li5 Li3 Li5 175.0345(4) 2_556 . 2_566 N
Li5 Li3 Li5 90.1075 2_556 . 101_454 N
Li5 Li3 Li5 90.1075 2_556 . 101_554 N
Li5 Li3 H 50.6161(18) 2_556 . 6_555 N
Li5 Li3 H 124.8288(23) 2_556 . 8_565 N
Li5 Li3 H 110.4056(7) 2_556 . 105_555 N
Li5 Li3 H 73.4246(11) 2_556 . 107_455 N
Li5 Li3 Li5 90.1075 2_566 . 101_454 N
Li5 Li3 Li5 90.1075 2_566 . 101_554 N
Li5 Li3 H 124.8288(23) 2_566 . 6_555 N
Li5 Li3 H 50.6161(18) 2_566 . 8_565 N
Li5 Li3 H 73.4246(11) 2_566 . 105_555 N
Li5 Li3 H 110.4056(7) 2_566 . 107_455 N
Li5 Li3 Li5 175.0345(4) 101_454 . 101_554 N
Li5 Li3 H 110.4056(7) 101_454 . 6_555 N
Li5 Li3 H 73.4246(11) 101_454 . 8_565 N
Li5 Li3 H 124.8288(23) 101_454 . 105_555 N
Li5 Li3 H 50.6161(18) 101_454 . 107_455 N
Li5 Li3 H 73.4246(11) 101_554 . 6_555 N
Li5 Li3 H 110.4056(7) 101_554 . 8_565 N
Li5 Li3 H 50.6161(18) 101_554 . 105_555 N
Li5 Li3 H 124.8288(23) 101_554 . 107_455 N
H Li3 H 85.955(5) 6_555 . 8_565 N
H Li3 H 122.3620(30) 6_555 . 105_555 N
H Li3 H 122.3620(30) 6_555 . 107_455 N
H Li3 H 122.3620(30) 8_565 . 105_555 N
H Li3 H 122.3620(30) 8_565 . 107_455 N
H Li3 H 85.955(5) 105_555 . 107_455 N
N Li5 N 126.93(26) 2_556 . 4_556 N
N Li5 N 105.05(11) 2_556 . 101_445 N
N Li5 N 105.05(11) 2_556 . 103_555 N
N Li5 Li3 130.65(5) 2_556 . 2_456 N
N Li5 Li3 52.22(6) 2_556 . 2_556 N
N Li5 Li3 52.22(6) 2_556 . 5_546 N
N Li5 Li3 130.65(5) 2_556 . 5_556 N
N Li5 Mg3 130.65(5) 2_556 . 2_456 N
N Li5 Mg3 52.22(6) 2_556 . 2_556 N
N Li5 Mg3 52.22(6) 2_556 . 5_546 N
N Li5 Mg3 130.65(5) 2_556 . 5_556 N
N Li5 Mg4 116.53(13) 2_556 . 1_555 N
N Li5 H 24.75(12) 2_556 . 2_556 N
N Li5 H 103.28(13) 2_556 . 4_556 N
N Li5 H 103.28(13) 2_556 . 5_556 N
N Li5 H 24.75(12) 2_556 . 7_556 N
N Li5 N 105.05(11) 4_556 . 101_445 N
N Li5 N 105.05(11) 4_556 . 103_555 N
N Li5 Li3 52.22(6) 4_556 . 2_456 N
N Li5 Li3 130.65(5) 4_556 . 2_556 N
N Li5 Li3 130.65(5) 4_556 . 5_546 N
N Li5 Li3 52.22(6) 4_556 . 5_556 N
N Li5 Mg3 52.22(6) 4_556 . 2_456 N
N Li5 Mg3 130.65(5) 4_556 . 2_556 N
N Li5 Mg3 130.65(5) 4_556 . 5_546 N
N Li5 Mg3 52.22(6) 4_556 . 5_556 N
N Li5 Mg4 116.53(13) 4_556 . 1_555 N
N Li5 H 103.28(13) 4_556 . 2_556 N
N Li5 H 24.75(12) 4_556 . 4_556 N
N Li5 H 24.75(12) 4_556 . 5_556 N
N Li5 H 103.28(13) 4_556 . 7_556 N
N Li5 N 108.91(28) 101_445 . 103_555 N
N Li5 Li3 53.13(7) 101_445 . 2_456 N
N Li5 Li3 123.34(8) 101_445 . 2_556 N
N Li5 Li3 53.13(7) 101_445 . 5_546 N
N Li5 Li3 123.34(8) 101_445 . 5_556 N
N Li5 Mg3 53.13(7) 101_445 . 2_456 N
N Li5 Mg3 123.34(8) 101_445 . 2_556 N
N Li5 Mg3 53.13(7) 101_445 . 5_546 N
N Li5 Mg3 123.34(8) 101_445 . 5_556 N
N Li5 Mg4 54.45(14) 101_445 . 1_555 N
N Li5 H 109.23(10) 101_445 . 2_556 N
N Li5 H 123.61(9) 101_445 . 4_556 N
N Li5 H 109.23(10) 101_445 . 5_556 N
N Li5 H 123.61(9) 101_445 . 7_556 N
N Li5 Li3 123.34(8) 103_555 . 2_456 N
N Li5 Li3 53.13(7) 103_555 . 2_556 N
N Li5 Li3 123.34(8) 103_555 . 5_546 N
N Li5 Li3 53.13(7) 103_555 . 5_556 N
N Li5 Mg3 123.34(8) 103_555 . 2_456 N
N Li5 Mg3 53.13(7) 103_555 . 2_556 N
N Li5 Mg3 123.34(8) 103_555 . 5_546 N
N Li5 Mg3 53.13(7) 103_555 . 5_556 N
N Li5 Mg4 54.45(14) 103_555 . 1_555 N
N Li5 H 123.61(9) 103_555 . 2_556 N
N Li5 H 109.23(10) 103_555 . 4_556 N
N Li5 H 123.61(9) 103_555 . 5_556 N
N Li5 H 109.23(10) 103_555 . 7_556 N
Li3 Li5 Li3 175.0345(4) 2_456 . 2_556 N
Li3 Li5 Li3 89.8925 2_456 . 5_546 N
Li3 Li5 Li3 89.8925 2_456 . 5_556 N
Li3 Li5 Mg3 0.0 2_456 . 2_456 N
Li3 Li5 Mg3 175.0345(4) 2_456 . 2_556 N
Li3 Li5 Mg3 89.8925 2_456 . 5_546 N
Li3 Li5 Mg3 89.8925 2_456 . 5_556 N
Li3 Li5 Mg4 87.51720(20) 2_456 . 1_555 N
Li3 Li5 H 112.6296(9) 2_456 . 2_556 N
Li3 Li5 H 71.3990(13) 2_456 . 4_556 N
Li3 Li5 H 59.0955(21) 2_456 . 5_556 N
Li3 Li5 H 125.4087(17) 2_456 . 7_556 N
Li3 Li5 Li3 89.8925 2_556 . 5_546 N
Li3 Li5 Li3 89.8925 2_556 . 5_556 N
Li3 Li5 Mg3 175.0345(4) 2_556 . 2_456 N
Li3 Li5 Mg3 0.0 2_556 . 2_556 N
Li3 Li5 Mg3 89.8925 2_556 . 5_546 N
Li3 Li5 Mg3 89.8925 2_556 . 5_556 N
Li3 Li5 Mg4 87.51720(20) 2_556 . 1_555 N
Li3 Li5 H 71.3990(13) 2_556 . 2_556 N
Li3 Li5 H 112.6296(9) 2_556 . 4_556 N
Li3 Li5 H 125.4087(17) 2_556 . 5_556 N
Li3 Li5 H 59.0955(21) 2_556 . 7_556 N
Li3 Li5 Li3 175.0345(4) 5_546 . 5_556 N
Li3 Li5 Mg3 89.8925 5_546 . 2_456 N
Li3 Li5 Mg3 89.8925 5_546 . 2_556 N
Li3 Li5 Mg3 0.0 5_546 . 5_546 N
Li3 Li5 Mg3 175.0345(4) 5_546 . 5_556 N
Li3 Li5 Mg4 87.51720(20) 5_546 . 1_555 N
Li3 Li5 H 59.0955(21) 5_546 . 2_556 N
Li3 Li5 H 125.4087(17) 5_546 . 4_556 N
Li3 Li5 H 112.6296(9) 5_546 . 5_556 N
Li3 Li5 H 71.3990(13) 5_546 . 7_556 N
Li3 Li5 Mg3 89.8925 5_556 . 2_456 N
Li3 Li5 Mg3 89.8925 5_556 . 2_556 N
Li3 Li5 Mg3 175.0345(4) 5_556 . 5_546 N
Li3 Li5 Mg3 0.0 5_556 . 5_556 N
Li3 Li5 Mg4 87.51720(20) 5_556 . 1_555 N
Li3 Li5 H 125.4087(17) 5_556 . 2_556 N
Li3 Li5 H 59.0955(21) 5_556 . 4_556 N
Li3 Li5 H 71.3990(13) 5_556 . 5_556 N
Li3 Li5 H 112.6296(9) 5_556 . 7_556 N
Mg3 Li5 Mg3 175.0345(4) 2_456 . 2_556 N
Mg3 Li5 Mg3 89.8925 2_456 . 5_546 N
Mg3 Li5 Mg3 89.8925 2_456 . 5_556 N
Mg3 Li5 Mg4 87.51720(20) 2_456 . 1_555 N
Mg3 Li5 H 112.6296(9) 2_456 . 2_556 N
Mg3 Li5 H 71.3990(13) 2_456 . 4_556 N
Mg3 Li5 H 59.0955(21) 2_456 . 5_556 N
Mg3 Li5 H 125.4087(17) 2_456 . 7_556 N
Mg3 Li5 Mg3 89.8925 2_556 . 5_546 N
Mg3 Li5 Mg3 89.8925 2_556 . 5_556 N
Mg3 Li5 Mg4 87.51720(20) 2_556 . 1_555 N
Mg3 Li5 H 71.3990(13) 2_556 . 2_556 N
Mg3 Li5 H 112.6296(9) 2_556 . 4_556 N
Mg3 Li5 H 125.4087(17) 2_556 . 5_556 N
Mg3 Li5 H 59.0955(21) 2_556 . 7_556 N
Mg3 Li5 Mg3 175.0345(4) 5_546 . 5_556 N
Mg3 Li5 Mg4 87.51720(20) 5_546 . 1_555 N
Mg3 Li5 H 59.0955(21) 5_546 . 2_556 N
Mg3 Li5 H 125.4087(17) 5_546 . 4_556 N
Mg3 Li5 H 112.6296(9) 5_546 . 5_556 N
Mg3 Li5 H 71.3990(13) 5_546 . 7_556 N
Mg3 Li5 Mg4 87.51720(20) 5_556 . 1_555 N
Mg3 Li5 H 125.4087(17) 5_556 . 2_556 N
Mg3 Li5 H 59.0955(21) 5_556 . 4_556 N
Mg3 Li5 H 71.3990(13) 5_556 . 5_556 N
Mg3 Li5 H 112.6296(9) 5_556 . 7_556 N
Mg4 Li5 H 139.4132(25) 1_555 . 2_556 N
Mg4 Li5 H 139.4132(25) 1_555 . 4_556 N
Mg4 Li5 H 139.4132(25) 1_555 . 5_556 N
Mg4 Li5 H 139.4132(25) 1_555 . 7_556 N
H Li5 H 81.174(5) 2_556 . 4_556 N
H Li5 H 78.966(5) 2_556 . 5_556 N
H Li5 H 15.8359(8) 2_556 . 7_556 N
H Li5 H 15.8359(8) 4_556 . 5_556 N
H Li5 H 78.966(5) 4_556 . 7_556 N
H Li5 H 81.174(5) 5_556 . 7_556 N
Li2 Mg3 Li2 180.0 1_555 . 102_455 N
Li2 Mg3 N 59.16(12) 1_555 . 1_555 N
Li2 Mg3 N 59.16(12) 1_555 . 3_565 N
Li2 Mg3 N 120.84(12) 1_555 . 102_455 N
Li2 Mg3 N 120.84(12) 1_555 . 104_555 N
Li2 Mg3 Li5 87.51720(20) 1_555 . 2_556 N
Li2 Mg3 Li5 87.51720(20) 1_555 . 2_566 N
Li2 Mg3 Li5 92.48280(20) 1_555 . 101_454 N
Li2 Mg3 Li5 92.48280(20) 1_555 . 101_554 N
Li2 Mg3 H 42.9777(25) 1_555 . 6_555 N
Li2 Mg3 H 42.9777(25) 1_555 . 8_565 N
Li2 Mg3 H 137.0223(25) 1_555 . 105_555 N
Li2 Mg3 H 137.0223(25) 1_555 . 107_455 N
Li2 Mg3 N 120.84(12) 102_455 . 1_555 N
Li2 Mg3 N 120.84(12) 102_455 . 3_565 N
Li2 Mg3 N 59.16(12) 102_455 . 102_455 N
Li2 Mg3 N 59.16(12) 102_455 . 104_555 N
Li2 Mg3 Li5 92.48280(20) 102_455 . 2_556 N
Li2 Mg3 Li5 92.48280(20) 102_455 . 2_566 N
Li2 Mg3 Li5 87.51720(20) 102_455 . 101_454 N
Li2 Mg3 Li5 87.51720(20) 102_455 . 101_554 N
Li2 Mg3 H 137.0223(25) 102_455 . 6_555 N
Li2 Mg3 H 137.0223(25) 102_455 . 8_565 N
Li2 Mg3 H 42.9777(25) 102_455 . 105_555 N
Li2 Mg3 H 42.9777(25) 102_455 . 107_455 N
N Mg3 N 118.33(23) 1_555 . 3_565 N
N Mg3 N 105.23(11) 1_555 . 102_455 N
N Mg3 N 105.23(11) 1_555 . 104_555 N
N Mg3 Li5 54.49(14) 1_555 . 2_556 N
N Mg3 Li5 122.44(13) 1_555 . 2_566 N
N Mg3 Li5 132.31(14) 1_555 . 101_454 N
N Mg3 Li5 51.04(14) 1_555 . 101_554 N
N Mg3 H 23.20(13) 1_555 . 6_555 N
N Mg3 H 99.74(12) 1_555 . 8_565 N
N Mg3 H 99.17(13) 1_555 . 105_555 N
N Mg3 H 126.21(13) 1_555 . 107_455 N
N Mg3 N 105.23(11) 3_565 . 102_455 N
N Mg3 N 105.23(11) 3_565 . 104_555 N
N Mg3 Li5 122.44(13) 3_565 . 2_556 N
N Mg3 Li5 54.49(14) 3_565 . 2_566 N
N Mg3 Li5 51.04(14) 3_565 . 101_454 N
N Mg3 Li5 132.31(14) 3_565 . 101_554 N
N Mg3 H 99.74(12) 3_565 . 6_555 N
N Mg3 H 23.20(13) 3_565 . 8_565 N
N Mg3 H 126.21(13) 3_565 . 105_555 N
N Mg3 H 99.17(13) 3_565 . 107_455 N
N Mg3 N 118.33(23) 102_455 . 104_555 N
N Mg3 Li5 51.04(14) 102_455 . 2_556 N
N Mg3 Li5 132.31(14) 102_455 . 2_566 N
N Mg3 Li5 54.49(14) 102_455 . 101_454 N
N Mg3 Li5 122.44(13) 102_455 . 101_554 N
N Mg3 H 99.17(13) 102_455 . 6_555 N
N Mg3 H 126.21(13) 102_455 . 8_565 N
N Mg3 H 99.74(12) 102_455 . 105_555 N
N Mg3 H 23.20(13) 102_455 . 107_455 N
N Mg3 Li5 132.31(14) 104_555 . 2_556 N
N Mg3 Li5 51.04(14) 104_555 . 2_566 N
N Mg3 Li5 122.44(13) 104_555 . 101_454 N
N Mg3 Li5 54.49(14) 104_555 . 101_554 N
N Mg3 H 126.21(13) 104_555 . 6_555 N
N Mg3 H 99.17(13) 104_555 . 8_565 N
N Mg3 H 23.20(13) 104_555 . 105_555 N
N Mg3 H 99.74(12) 104_555 . 107_455 N
Li5 Mg3 Li5 175.0345(4) 2_556 . 2_566 N
Li5 Mg3 Li5 90.1075 2_556 . 101_454 N
Li5 Mg3 Li5 90.1075 2_556 . 101_554 N
Li5 Mg3 H 50.6161(18) 2_556 . 6_555 N
Li5 Mg3 H 124.8288(23) 2_556 . 8_565 N
Li5 Mg3 H 110.4056(7) 2_556 . 105_555 N
Li5 Mg3 H 73.4246(11) 2_556 . 107_455 N
Li5 Mg3 Li5 90.1075 2_566 . 101_454 N
Li5 Mg3 Li5 90.1075 2_566 . 101_554 N
Li5 Mg3 H 124.8288(23) 2_566 . 6_555 N
Li5 Mg3 H 50.6161(18) 2_566 . 8_565 N
Li5 Mg3 H 73.4246(11) 2_566 . 105_555 N
Li5 Mg3 H 110.4056(7) 2_566 . 107_455 N
Li5 Mg3 Li5 175.0345(4) 101_454 . 101_554 N
Li5 Mg3 H 110.4056(7) 101_454 . 6_555 N
Li5 Mg3 H 73.4246(11) 101_454 . 8_565 N
Li5 Mg3 H 124.8288(23) 101_454 . 105_555 N
Li5 Mg3 H 50.6161(18) 101_454 . 107_455 N
Li5 Mg3 H 73.4246(11) 101_554 . 6_555 N
Li5 Mg3 H 110.4056(7) 101_554 . 8_565 N
Li5 Mg3 H 50.6161(18) 101_554 . 105_555 N
Li5 Mg3 H 124.8288(23) 101_554 . 107_455 N
H Mg3 H 85.955(5) 6_555 . 8_565 N
H Mg3 H 122.3620(30) 6_555 . 105_555 N
H Mg3 H 122.3620(30) 6_555 . 107_455 N
H Mg3 H 122.3620(30) 8_565 . 105_555 N
H Mg3 H 122.3620(30) 8_565 . 107_455 N
H Mg3 H 85.955(5) 105_555 . 107_455 N
Li2 Mg4 Li2 180.0 101_445 . 101_545 N
Li2 Mg4 Li2 90.0 101_445 . 102_445 N
Li2 Mg4 Li2 90.0 101_445 . 102_455 N
Li2 Mg4 N 56.25(7) 101_445 . 101_445 N
Li2 Mg4 N 56.25(7) 101_445 . 102_455 N
Li2 Mg4 N 123.75(7) 101_445 . 103_555 N
Li2 Mg4 N 123.75(7) 101_445 . 104_545 N
Li2 Mg4 Li5 90.0 101_445 . 1_555 N
Li2 Mg4 Li5 90.0 101_445 . 2_556 N
Li2 Mg4 Li2 90.0 101_545 . 102_445 N
Li2 Mg4 Li2 90.0 101_545 . 102_455 N
Li2 Mg4 N 123.75(7) 101_545 . 101_445 N
Li2 Mg4 N 123.75(7) 101_545 . 102_455 N
Li2 Mg4 N 56.25(7) 101_545 . 103_555 N
Li2 Mg4 N 56.25(7) 101_545 . 104_545 N
Li2 Mg4 Li5 90.0 101_545 . 1_555 N
Li2 Mg4 Li5 90.0 101_545 . 2_556 N
Li2 Mg4 Li2 180.0 102_445 . 102_455 N
Li2 Mg4 N 56.25(7) 102_445 . 101_445 N
Li2 Mg4 N 123.75(7) 102_445 . 102_455 N
Li2 Mg4 N 123.75(7) 102_445 . 103_555 N
Li2 Mg4 N 56.25(7) 102_445 . 104_545 N
Li2 Mg4 Li5 90.0 102_445 . 1_555 N
Li2 Mg4 Li5 90.0 102_445 . 2_556 N
Li2 Mg4 N 123.75(7) 102_455 . 101_445 N
Li2 Mg4 N 56.25(7) 102_455 . 102_455 N
Li2 Mg4 N 56.25(7) 102_455 . 103_555 N
Li2 Mg4 N 123.75(7) 102_455 . 104_545 N
Li2 Mg4 Li5 90.0 102_455 . 1_555 N
Li2 Mg4 Li5 90.0 102_455 . 2_556 N
N Mg4 N 112.50(14) 101_445 . 102_455 N
N Mg4 N 103.58(27) 101_445 . 103_555 N
N Mg4 N 112.50(14) 101_445 . 104_545 N
N Mg4 Li5 51.79(14) 101_445 . 1_555 N
N Mg4 Li5 128.21(14) 101_445 . 2_556 N
N Mg4 N 112.50(14) 102_455 . 103_555 N
N Mg4 N 103.58(27) 102_455 . 104_545 N
N Mg4 Li5 128.21(14) 102_455 . 1_555 N
N Mg4 Li5 51.79(14) 102_455 . 2_556 N
N Mg4 N 112.50(14) 103_555 . 104_545 N
N Mg4 Li5 51.79(14) 103_555 . 1_555 N
N Mg4 Li5 128.21(14) 103_555 . 2_556 N
N Mg4 Li5 128.21(14) 104_545 . 1_555 N
N Mg4 Li5 51.79(14) 104_545 . 2_556 N
Li5 Mg4 Li5 180.0 1_555 . 2_556 N
Li2 H Li2 129.4088(26) 1_555 . 2_555 N
Li2 H N 77.09(15) 1_555 . 1_555 N
Li2 H Li3 141.8294(4) 1_555 . 6_555 N
Li2 H Li5 103.7218(16) 1_555 . 2_556 N
Li2 H Mg3 141.8294(4) 1_555 . 6_555 N
Li2 H H 21.7428(12) 1_555 . 6_555 N
Li2 H N 111.45(19) 2_555 . 1_555 N
Li2 H Li3 70.499(4) 2_555 . 6_555 N
Li2 H Li5 126.6037(10) 2_555 . 2_556 N
Li2 H Mg3 70.499(4) 2_555 . 6_555 N
Li2 H H 151.1516(14) 2_555 . 6_555 N
N H Li3 64.79(15) 1_555 . 6_555 N
N H Li5 82.12(32) 1_555 . 2_556 N
N H Mg3 64.79(15) 1_555 . 6_555 N
N H H 71.65(10) 1_555 . 6_555 N
Li3 H Li5 70.288(4) 6_555 . 2_556 N
Li3 H Mg3 0.0 6_555 . 6_555 N
Li3 H H 130.6171(23) 6_555 . 6_555 N
Li5 H Mg3 70.288(4) 2_556 . 6_555 N
Li5 H H 82.0820(4) 2_556 . 6_555 N
Mg3 H H 130.6171(23) 6_555 . 6_555 N
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Li2 N 2.2468(29) . 1_555 N
Li2 N 2.2468(29) . 2_565 N
Li2 N 2.2468(29) . 3_565 N
Li2 N 2.2468(29) . 4_555 N
Li2 Li3 2.40476(18) . 1_555 N
Li2 Li3 2.40476(18) . 5_555 N
Li2 Li5 3.44080(14) . 1_554 N
Li2 Li5 3.44080(14) . 1_564 N
Li2 Li5 3.44080(14) . 2_556 N
Li2 Li5 3.44080(14) . 2_566 N
Li2 Mg3 2.40476(18) . 1_555 N
Li2 Mg3 2.40476(18) . 5_555 N
Li2 Mg4 2.56490(11) . 101_454 N
Li2 Mg4 2.56490(11) . 101_554 N
Li2 H 2.26518(9) . 1_555 N
Li2 H 1.73912(7) . 2_565 N
Li2 H 2.26518(9) . 3_565 N
Li2 H 1.73912(7) . 4_555 N
Li2 H 2.26518(9) . 5_555 N
Li2 H 1.73912(7) . 6_555 N
Li2 H 2.26518(9) . 7_565 N
Li2 H 1.73912(7) . 8_565 N
N Li2 2.2468(29) . 1_555 N
N Li2 2.2468(29) . 2_555 N
N Li3 2.1184(26) . 1_555 N
N Li3 2.1184(26) . 6_555 N
N Li5 2.182(5) . 2_556 N
N Li5 2.059(5) . 101_554 N
N Mg3 2.1184(26) . 1_555 N
N Mg3 2.1184(26) . 6_555 N
N Mg4 2.132(5) . 101_554 N
N H 0.922(5) . 1_555 N
N H 0.922(5) . 6_555 N
Li3 Li2 2.40476(18) . 1_555 N
Li3 Li2 2.40476(18) . 102_455 N
Li3 N 2.1184(26) . 1_555 N
Li3 N 2.1184(26) . 3_565 N
Li3 N 2.1184(26) . 102_455 N
Li3 N 2.1184(26) . 104_555 N
Li3 Li5 2.56731(11) . 2_556 N
Li3 Li5 2.56731(11) . 2_566 N
Li3 Li5 2.56731(11) . 101_454 N
Li3 Li5 2.56731(11) . 101_554 N
Li3 Mg4 3.51591(15) . 1_555 N
Li3 Mg4 3.51591(15) . 1_565 N
Li3 Mg4 3.51591(15) . 101_454 N
Li3 Mg4 3.51591(15) . 101_554 N
Li3 H 2.33993(11) . 6_555 N
Li3 H 2.33993(11) . 8_565 N
Li3 H 2.33993(11) . 105_555 N
Li3 H 2.33993(11) . 107_455 N
Li5 Li2 3.44080(14) . 1_546 N
Li5 Li2 3.44080(14) . 1_556 N
Li5 Li2 3.44080(14) . 2_456 N
Li5 Li2 3.44080(14) . 2_556 N
Li5 N 2.182(5) . 2_556 N
Li5 N 2.182(5) . 4_556 N
Li5 N 2.059(5) . 101_445 N
Li5 N 2.059(5) . 103_555 N
Li5 Li3 2.56731(11) . 2_456 N
Li5 Li3 2.56731(11) . 2_556 N
Li5 Li3 2.56731(11) . 5_546 N
Li5 Li3 2.56731(11) . 5_556 N
Li5 Mg3 2.56731(11) . 2_456 N
Li5 Mg3 2.56731(11) . 2_556 N
Li5 Mg3 2.56731(11) . 5_546 N
Li5 Mg3 2.56731(11) . 5_556 N
Li5 Mg4 2.51598(19) . 1_555 N
Li5 H 2.10782(10) . 2_556 N
Li5 H 2.10782(10) . 4_556 N
Li5 H 2.10782(10) . 5_556 N
Li5 H 2.10782(10) . 7_556 N
Mg3 Li2 2.40476(18) . 1_555 N
Mg3 Li2 2.40476(18) . 102_455 N
Mg3 N 2.1184(26) . 1_555 N
Mg3 N 2.1184(26) . 3_565 N
Mg3 N 2.1184(26) . 102_455 N
Mg3 N 2.1184(26) . 104_555 N
Mg3 Li5 2.56731(11) . 2_556 N
Mg3 Li5 2.56731(11) . 2_566 N
Mg3 Li5 2.56731(11) . 101_454 N
Mg3 Li5 2.56731(11) . 101_554 N
Mg3 Mg4 3.51591(15) . 1_555 N
Mg3 Mg4 3.51591(15) . 1_565 N
Mg3 Mg4 3.51591(15) . 101_454 N
Mg3 Mg4 3.51591(15) . 101_554 N
Mg3 H 2.75350(11) . 1_555 N
Mg3 H 2.75350(11) . 3_565 N
Mg3 H 2.33993(11) . 6_555 N
Mg3 H 2.33993(11) . 8_565 N
Mg3 H 2.75350(11) . 102_455 N
Mg3 H 2.75350(11) . 104_555 N
Mg3 H 2.33993(11) . 105_555 N
Mg3 H 2.33993(11) . 107_455 N
Mg4 Li2 2.56490(11) . 101_445 N
Mg4 Li2 2.56490(11) . 101_545 N
Mg4 Li2 2.56490(11) . 102_445 N
Mg4 Li2 2.56490(11) . 102_455 N
Mg4 N 2.132(5) . 101_445 N
Mg4 N 2.132(5) . 102_455 N
Mg4 N 2.132(5) . 103_555 N
Mg4 N 2.132(5) . 104_545 N
Mg4 Li3 3.51591(15) . 1_545 N
Mg4 Li3 3.51591(15) . 1_555 N
Mg4 Li3 3.51591(15) . 2_456 N
Mg4 Li3 3.51591(15) . 2_556 N
Mg4 Li3 3.51591(15) . 5_546 N
Mg4 Li3 3.51591(15) . 5_556 N
Mg4 Li3 3.51591(15) . 6_455 N
Mg4 Li3 3.51591(15) . 6_555 N
Mg4 Li5 2.51598(19) . 1_555 N
Mg4 Li5 2.51598(19) . 2_556 N
Mg4 Mg3 3.51591(15) . 1_545 N
Mg4 Mg3 3.51591(15) . 1_555 N
Mg4 Mg3 3.51591(15) . 2_456 N
Mg4 Mg3 3.51591(15) . 2_556 N
Mg4 Mg3 3.51591(15) . 5_546 N
Mg4 Mg3 3.51591(15) . 5_556 N
Mg4 Mg3 3.51591(15) . 6_455 N
Mg4 Mg3 3.51591(15) . 6_555 N
Mg4 H 2.40728(10) . 101_445 N
Mg4 H 2.40728(10) . 102_455 N
Mg4 H 2.40728(10) . 103_555 N
Mg4 H 2.40728(10) . 104_545 N
Mg4 H 2.40728(10) . 105_545 N
Mg4 H 2.40728(10) . 106_445 N
Mg4 H 2.40728(10) . 107_455 N
Mg4 H 2.40728(10) . 108_555 N
H Li2 2.26518(9) . 1_555 N
H Li2 1.73912(7) . 2_555 N
H N 0.922(5) . 1_555 N
H Li3 2.33993(11) . 6_555 N
H Li5 2.10782(10) . 2_556 N
H Mg3 2.75350(11) . 1_555 N
H Mg3 2.33993(11) . 6_555 N
H Mg4 2.40728(10) . 101_554 N
H H 0.580730(30) . 6_555 N
loop_
_pd_meas_counts_total
_pd_proc_ls_weight
_pd_proc_intensity_bkg_calc
_pd_calc_intensity_total
31.0 0.03226 32.35592 32.35592
27.0 0.0370 32.35331 32.35331
27.0 0.0370 32.35180 32.35180
44.0 0.02273 32.35139 32.35139
33.0 0.03030 32.35206 32.35206
31.0 0.03226 32.35381 32.35381
28.0 0.0357 32.35664 32.35664
27.0 0.0370 32.36053 32.36053
33.0 0.03030 32.36549 32.36549
32.0 0.03125 32.37149 32.37149
25.0 0.0400 32.37855 32.37855
25.0 0.0400 32.38663 32.38663
26.0 0.0385 32.39576 32.39576
20.0 0.0500 32.40591 32.40591
23.0 0.0435 32.41707 32.41707
29.0 0.03448 32.42925 32.42925
25.0 0.0400 32.44243 32.44243
28.0 0.0357 32.45661 32.45661
32.0 0.03125 32.47179 32.47179
29.0 0.03448 32.48794 32.48794
39.0 0.02564 32.50507 32.50507
33.0 0.03030 32.52317 32.52317
25.0 0.0400 32.54224 32.54224
32.0 0.03125 32.56227 32.56227
25.0 0.0400 32.58324 32.58324
28.0 0.0357 32.60516 32.60516
27.0 0.0370 32.62802 32.62802
31.0 0.03226 32.65181 32.65181
38.0 0.02632 32.67652 32.67652
29.0 0.03448 32.70215 32.70215
29.0 0.03448 32.72869 32.72869
32.0 0.03125 32.75614 32.75614
27.0 0.0370 32.78448 32.78448
33.0 0.03030 32.81372 32.81372
25.0 0.0400 32.84385 32.84385
28.0 0.0357 32.87484 32.87484
34.0 0.02941 32.90671 32.90671
36.0 0.02778 32.93945 32.93945
27.0 0.0370 32.97306 32.97306
38.0 0.02632 33.00750 33.00750
28.0 0.0357 33.04280 33.04280
35.0 0.02857 33.07895 33.07895
39.0 0.02564 33.11592 33.11592
32.0 0.03125 33.15372 33.15372
41.0 0.02439 33.19235 33.19235
33.0 0.03030 33.23179 33.23179
33.0 0.03030 33.27204 33.27204
33.0 0.03030 33.31309 33.31309
38.0 0.02632 33.35494 33.35494
33.0 0.03030 33.39758 33.39758
33.0 0.03030 33.44100 33.44100
28.0 0.0357 33.48521 33.48521
34.0 0.02941 33.53019 33.53019
41.0 0.02439 33.57593 33.57593
35.0 0.02857 33.62243 33.62243
38.0 0.02632 33.66969 33.66969
35.0 0.02857 33.71770 33.71770
47.0 0.02128 33.76645 33.76645
26.0 0.0385 33.81593 33.81593
34.0 0.02941 33.86615 33.86615
22.0 0.0455 33.91709 33.91709
34.0 0.02941 33.96875 33.96875
38.0 0.02632 34.02111 34.02111
34.0 0.02941 34.07419 34.07419
32.0 0.03125 34.12798 34.12798
26.0 0.0385 34.18245 34.18245
34.0 0.02941 34.23761 34.23761
40.0 0.02500 34.29346 34.29346
40.0 0.02500 34.34998 34.34998
37.0 0.02703 34.40717 34.40717
34.0 0.02941 34.46504 34.61236
41.0 0.02439 34.52356 34.74741
31.0 0.03226 34.58274 34.81137
31.0 0.03226 34.64257 34.87612
37.0 0.02703 34.70304 34.94168
47.0 0.02128 34.76415 35.00806
29.0 0.03448 34.82589 35.07523
36.0 0.02778 34.88825 35.14321
44.0 0.02273 34.95124 35.21202
40.0 0.02500 35.01484 35.28163
41.0 0.02439 35.07906 35.35207
34.0 0.02941 35.14388 35.42333
35.0 0.02857 35.20929 35.49541
36.0 0.02778 35.27529 35.56834
38.0 0.02632 35.34189 35.64210
41.0 0.02439 35.40907 35.71672
53.0 0.01887 35.47682 35.79219
45.0 0.02222 35.54515 35.86852
49.0 0.02041 35.61404 35.94573
36.0 0.02778 35.68349 36.02383
34.0 0.02941 35.75350 36.10283
36.0 0.02778 35.82406 36.18273
43.0 0.02326 35.89516 36.26355
40.0 0.02500 35.96680 36.34532
37.0 0.02703 36.03897 36.82183
41.0 0.02439 36.11168 37.10992
39.0 0.02564 36.18491 37.20747
24.0 0.0417 36.25866 37.30647
36.0 0.02778 36.33291 37.40692
32.0 0.03125 36.40768 37.50892
38.0 0.02632 36.48294 37.61248
46.0 0.02174 36.55871 37.71768
52.0 0.01923 36.63497 37.82457
44.0 0.02273 36.71171 37.93319
43.0 0.02326 36.78894 38.04362
29.0 0.03448 36.86664 38.15596
41.0 0.02439 36.94482 38.27025
35.0 0.02857 37.02346 38.38659
36.0 0.02778 37.10256 38.50507
50.0 0.02000 37.18213 38.62579
33.0 0.03030 37.26214 38.74885
54.0 0.01852 37.34259 38.87437
37.0 0.02703 37.42350 39.00249
48.0 0.02083 37.50483 39.13334
36.0 0.02778 37.58660 39.26706
33.0 0.03030 37.66879 39.40382
39.0 0.02564 37.75141 39.54381
39.0 0.02564 37.83445 39.68721
49.0 0.02041 37.91789 39.83424
33.0 0.03030 38.00175 39.98515
49.0 0.02041 38.08600 40.14020
44.0 0.02273 38.17066 40.29966
41.0 0.02439 38.25571 40.46387
50.0 0.02000 38.34114 40.63316
46.0 0.02174 38.42696 40.80795
53.0 0.01887 38.51316 40.98864
47.0 0.02128 38.59973 41.17575
46.0 0.02174 38.68667 41.36982
60.0 0.01667 38.77398 41.57144
51.0 0.01961 38.86165 41.78132
50.0 0.02000 38.94966 42.00020
42.0 0.02381 39.03804 42.22900
55.0 0.01818 39.12675 42.46870
47.0 0.02128 39.21582 42.72045
38.0 0.02632 39.30521 42.98552
40.0 0.02500 39.39494 43.26545
43.0 0.02326 39.48500 43.56196
52.0 0.01923 39.57537 43.87704
54.0 0.01852 39.66608 44.21309
52.0 0.01923 39.75708 44.57281
43.0 0.02326 39.84841 44.95951
54.0 0.01852 39.94004 45.37703
54.0 0.01852 40.03197 45.83001
46.0 0.02174 40.12419 46.32401
57.0 0.01754 40.21671 46.86583
53.0 0.01887 40.30951 47.46375
55.0 0.01818 40.40260 48.12808
57.0 0.01754 40.49597 48.87162
58.0 0.01724 40.58962 49.71060
55.0 0.01818 40.68353 50.66574
51.0 0.01961 40.77770 51.76394
61.0 0.01639 40.87214 53.04051
46.0 0.02174 40.96684 54.54269
69.0 0.01449 41.06180 56.33474
80.0 0.01250 41.15699 58.50592
70.0 0.01429 41.25244 61.18361
91.0 0.01099 41.34813 64.55827
67.0 0.01493 41.44405 68.94273
96.0 0.01042 41.54020 74.93730
95.0 0.01053 41.63659 83.86684
135.0 0.00741 41.73319 98.69476
164.0 0.00610 41.83002 125.24181
223.0 0.00448 41.92706 172.42886
243.0 0.00412 42.02432 249.23669
338.0 0.002959 42.12177 356.58270
402.0 0.002488 42.21944 472.33109
510.0 0.001961 42.31730 537.71259
462.0 0.002165 42.41536 503.28314
390.0 0.002564 42.51361 398.85135
269.0 0.00372 42.61205 287.20984
168.0 0.00595 42.71067 201.93907
140.0 0.00714 42.80948 147.98340
98.0 0.01020 42.90845 118.02449
90.0 0.01111 43.00760 102.71970
105.0 0.00952 43.10693 95.26899
90.0 0.01111 43.20640 92.00353
84.0 0.01190 43.30605 91.32195
100.0 0.01000 43.40584 92.65202
115.0 0.00870 43.50580 95.90401
94.0 0.01064 43.60590 101.28719
136.0 0.00735 43.70613 109.33335
134.0 0.00746 43.80652 121.14994
159.0 0.00629 43.90704 139.20316
197.0 0.00508 44.00770 169.21651
276.0 0.00362 44.10848 223.39423
358.0 0.002793 44.20939 322.91504
475.0 0.002105 44.31043 494.05670
724.0 0.001381 44.41158 751.68524
878.0 0.001139 44.51285 1064.95886
1100.0 0.000909 44.61423 1306.73438
1203.0 0.000831 44.71572 1304.95044
990.0 0.001010 44.81731 1065.58496
703.0 0.001422 44.91900 754.78180
444.0 0.002252 45.02079 496.61896
310.0 0.003226 45.12267 323.89954
232.0 0.00431 45.22464 222.65231
178.0 0.00562 45.32670 166.92998
152.0 0.00658 45.42884 135.59035
130.0 0.00769 45.53106 116.29061
109.0 0.00917 45.63335 103.13708
104.0 0.00962 45.73572 93.52079
108.0 0.00926 45.83816 86.20345
108.0 0.00926 45.94066 80.49728
98.0 0.01020 46.04322 75.96661
96.0 0.01042 46.14584 72.31536
90.0 0.01111 46.24852 69.33485
78.0 0.01282 46.35125 66.87452
90.0 0.01111 46.45403 64.82365
89.0 0.01124 46.55685 63.09939
80.0 0.01250 46.65971 61.63875
63.0 0.01587 46.76262 60.39326
73.0 0.01370 46.86555 59.32505
47.0 0.02128 46.96852 58.40424
93.0 0.01075 47.07152 57.60700
82.0 0.01220 47.17455 56.91412
63.0 0.01587 47.27758 56.31001
55.0 0.01818 47.38065 55.78188
65.0 0.01538 47.48372 55.31916
77.0 0.01299 47.58681 54.91310
58.0 0.01724 47.68991 54.55633
66.0 0.01515 47.79302 54.24266
71.0 0.01408 47.89613 53.96684
69.0 0.01449 47.99924 53.72444
72.0 0.01389 48.10235 53.51159
61.0 0.01639 48.20544 53.32503
71.0 0.01408 48.30853 53.16191
72.0 0.01389 48.41161 53.01978
61.0 0.01639 48.51466 52.89648
71.0 0.01408 48.61770 52.79015
56.0 0.01786 48.72073 52.69914
72.0 0.01389 48.82372 52.62199
57.0 0.01754 48.92668 52.55743
54.0 0.01852 49.02962 52.50434
72.0 0.01389 49.13252 52.46170
63.0 0.01587 49.23538 52.42863
71.0 0.01408 49.33820 52.40430
66.0 0.01515 49.44099 52.38805
58.0 0.01724 49.54372 52.37920
61.0 0.01639 49.64641 52.37720
61.0 0.01639 49.74905 52.38152
56.0 0.01786 49.85163 52.39170
73.0 0.01370 49.95415 52.40734
62.0 0.01613 50.05662 52.42804
58.0 0.01724 50.15902 52.45346
51.0 0.01961 50.26136 52.48334
61.0 0.01639 50.36362 52.51735
73.0 0.01370 50.46582 52.55527
58.0 0.01724 50.56794 52.59688
59.0 0.01695 50.66999 52.64198
59.0 0.01695 50.77195 52.69041
66.0 0.01515 50.87383 52.74200
52.0 0.01923 50.97564 52.79664
60.0 0.01667 51.07734 52.85419
43.0 0.02326 51.17897 52.91460
49.0 0.02041 51.28050 52.97776
77.0 0.01299 51.38193 53.04365
64.0 0.01563 51.48326 53.11223
63.0 0.01587 51.58450 53.18351
44.0 0.02273 51.68563 53.25750
76.0 0.01316 51.78665 53.33426
53.0 0.01887 51.88756 53.41388
64.0 0.01563 51.98837 53.34693
64.0 0.01563 52.08906 53.36151
57.0 0.01754 52.18964 53.45521
67.0 0.01493 52.29009 53.55243
55.0 0.01818 52.39042 53.65360
62.0 0.01613 52.49063 53.75918
64.0 0.01563 52.59072 53.86980
55.0 0.01818 52.69068 53.98625
56.0 0.01786 52.79050 54.10954
63.0 0.01587 52.89019 54.24098
55.0 0.01818 52.98975 54.38226
60.0 0.01667 53.08916 54.53560
63.0 0.01587 53.18844 54.70398
57.0 0.01754 53.28757 54.89140
57.0 0.01754 53.38655 55.10336
70.0 0.01429 53.48539 55.34761
60.0 0.01667 53.58408 55.63518
63.0 0.01587 53.68262 55.98248
50.0 0.02000 53.78100 56.41525
59.0 0.01695 53.87922 56.97919
65.0 0.01538 53.97728 57.76984
63.0 0.01587 54.07518 59.00616
69.0 0.01449 54.17292 61.15693
65.0 0.01538 54.27049 65.03345
79.0 0.01266 54.36790 71.22430
75.0 0.01333 54.46513 80.73634
107.0 0.00935 54.56219 91.75228
114.0 0.00877 54.65907 98.22186
117.0 0.00855 54.75578 95.29265
95.0 0.01053 54.85230 85.72496
73.0 0.01370 54.94865 75.40528
75.0 0.01333 55.04481 67.69704
69.0 0.01449 55.14079 62.94754
61.0 0.01639 55.23658 60.32821
62.0 0.01613 55.33217 58.93262
43.0 0.02326 55.42758 58.15481
58.0 0.01724 55.52279 57.68302
51.0 0.01961 55.61781 57.37721
62.0 0.01613 55.71262 57.17371
63.0 0.01587 55.80723 57.03941
42.0 0.02381 55.90165 56.95430
48.0 0.02083 55.99586 56.90523
54.0 0.01852 56.08986 56.88312
57.0 0.01754 56.18365 56.88156
45.0 0.02222 56.27724 56.89591
54.0 0.01852 56.37061 56.92275
47.0 0.02128 56.46377 56.95950
55.0 0.01818 56.55671 57.00423
50.0 0.02000 56.64943 57.05541
55.0 0.01818 56.74194 57.11189
53.0 0.01887 56.83422 57.17272
67.0 0.01493 56.92627 57.23716
63.0 0.01587 57.01810 57.30461
55.0 0.01818 57.10971 57.37459
57.0 0.01754 57.20108 57.44670
48.0 0.02083 57.29222 57.52058
58.0 0.01724 57.38313 57.59600
45.0 0.02222 57.47381 57.67270
57.0 0.01754 57.56425 58.88350
57.0 0.01754 57.65445 58.98631
51.0 0.01961 57.74442 59.65960
61.0 0.01639 57.83413 59.77760
51.0 0.01961 57.92361 59.89741
53.0 0.01887 58.01284 60.01897
47.0 0.02128 58.10182 60.14230
48.0 0.02083 58.19056 60.26735
56.0 0.01786 58.27904 60.39415
48.0 0.02083 58.36728 60.52272
67.0 0.01493 58.45525 60.65306
54.0 0.01852 58.54297 60.78522
50.0 0.02000 58.63044 60.91924
69.0 0.01449 58.71765 61.05519
55.0 0.01818 58.80460 61.19312
63.0 0.01587 58.89128 61.33309
48.0 0.02083 58.97770 61.47519
36.0 0.02778 59.06386 61.61951
49.0 0.02041 59.14975 61.76614
60.0 0.01667 59.23537 61.91520
62.0 0.01613 59.32072 62.06679
58.0 0.01724 59.40581 62.22104
56.0 0.01786 59.49062 62.37809
48.0 0.02083 59.57516 62.53810
56.0 0.01786 59.65942 62.70122
57.0 0.01754 59.74340 62.86761
52.0 0.01923 59.82710 63.03749
54.0 0.01852 59.91053 63.21105
64.0 0.01563 59.99367 63.38848
43.0 0.02326 60.07653 63.57006
54.0 0.01852 60.15910 63.75603
63.0 0.01587 60.24139 63.94666
50.0 0.02000 60.32340 64.14227
62.0 0.01613 60.40511 64.34316
40.0 0.02500 60.48654 64.54971
66.0 0.01515 60.56767 64.76227
57.0 0.01754 60.64851 64.98127
56.0 0.01786 60.72906 65.20718
67.0 0.01493 60.80931 65.44045
49.0 0.02041 60.88926 65.68166
74.0 0.01351 60.96892 65.93135
42.0 0.02381 61.04827 66.24886
58.0 0.01724 61.12734 66.51877
58.0 0.01724 61.20609 66.82870
58.0 0.01724 61.28454 67.12134
44.0 0.02273 61.36269 67.42641
51.0 0.01961 61.44053 67.74490
61.0 0.01639 61.51807 68.07796
70.0 0.01429 61.59530 68.42679
56.0 0.01786 61.67222 68.79282
63.0 0.01587 61.74883 69.17751
67.0 0.01493 61.82513 69.58260
57.0 0.01754 61.90112 70.00993
48.0 0.02083 61.97679 70.46165
69.0 0.01449 62.05215 70.94012
49.0 0.02041 62.12719 71.44794
63.0 0.01587 62.20192 71.98814
66.0 0.01515 62.27633 72.56406
68.0 0.01471 62.35041 73.17952
50.0 0.02000 62.42418 73.83887
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47.0 . . .
