data_222
_audit_creation_date               2024-12-11
_audit_creation_method
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number       '2018/3'
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.

Sheldrick, G.M. (2015). Acta Cryst. C71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           'Li Mg4 O12 V3'
_chemical_formula_sum              'Li Mg4 O12 V3'
_chemical_formula_weight           449.00
_chemical_absolute_configuration   ?
_chemical_melting_point            ?
loop_
  _atom_type_symbol
  _atom_type_description
  _atom_type_scat_dispersion_real
  _atom_type_scat_dispersion_imag
  _atom_type_scat_source
 'Li' 'Li' -0.0003 0.0001
 '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'
 'O' 'O' 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'V' 'V' 0.3005 0.5294 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system        'tetragonal'
_space_group_IT_number             122
_space_group_name_H-M_alt          'I -4 2 d'
_space_group_name_Hall             'I -4 2bw'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'
 '-x, -y, z'
 'y, -x, -z'
 '-y, x, -z'
 '-x+1/2, y, -z+3/4'
 'x+1/2, -y, -z+3/4'
 '-y+1/2, -x, z+3/4'
 'y+1/2, x, z+3/4'
 'x+1/2, y+1/2, z+1/2'
 '-x+1/2, -y+1/2, z+1/2'
 'y+1/2, -x+1/2, -z+1/2'
 '-y+1/2, x+1/2, -z+1/2'
 '-x+1, y+1/2, -z+5/4'
 'x+1, -y+1/2, -z+5/4'
 '-y+1, -x+1/2, z+5/4'
 'y+1, x+1/2, z+5/4'

_cell_length_a                     6.8673(6)
_cell_length_b                     6.8673(6)
_cell_length_c                     18.968(2)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       894.55(19)
_cell_formula_units_Z              4
_cell_measurement_reflns_used      5106
_cell_measurement_temperature      287.00
_cell_measurement_theta_max        27.48
_cell_measurement_theta_min        3.155
_shelx_estimated_absorpt_T_max     0.726
_shelx_estimated_absorpt_T_min     0.684
_exptl_absorpt_coefficient_mu      3.422
_exptl_absorpt_correction_T_max    0.7455
_exptl_absorpt_correction_T_min    0.6142
_exptl_absorpt_correction_type     none
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1778 before and 0.0631 after correction.
The Ratio of minimum to maximum transmission is 0.8239.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              'clear light colourless'
_exptl_crystal_colour_lustre       clear
_exptl_crystal_colour_modifier     light
_exptl_crystal_colour_primary      colourless
_exptl_crystal_density_diffrn      3.334
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         block
_exptl_crystal_F_000               864
_exptl_crystal_size_max            0.12
_exptl_crystal_size_mid            0.11
_exptl_crystal_size_min            0.1
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0458
_diffrn_reflns_av_unetI/netI       0.0318
_diffrn_reflns_Laue_measured_fraction_full  0.952
_diffrn_reflns_Laue_measured_fraction_max  0.961
_diffrn_reflns_limit_h_max         8
_diffrn_reflns_limit_h_min         -8
_diffrn_reflns_limit_k_max         8
_diffrn_reflns_limit_k_min         -8
_diffrn_reflns_limit_l_max         24
_diffrn_reflns_limit_l_min         -24
_diffrn_reflns_number              2887
_diffrn_reflns_point_group_measured_fraction_full  0.956
_diffrn_reflns_point_group_measured_fraction_max  0.965
_diffrn_reflns_theta_full          25.242
_diffrn_reflns_theta_max           27.477
_diffrn_reflns_theta_min           3.155
_diffrn_ambient_temperature        287.00
_diffrn_detector_area_resol_mean   ?
_diffrn_measured_fraction_theta_full  0.952
_diffrn_measured_fraction_theta_max  0.961
_diffrn_measurement_device_type    'Bruker APEX-II CCD'
_diffrn_measurement_method         'φ and ω scans'
_diffrn_radiation_type             MoK\a
_diffrn_radiation_wavelength       0.71073
_diffrn_source                     ?
_diffrn_source_current             1.4
_diffrn_source_power               0.07
_diffrn_source_voltage             50.0
_diffrn_standards_number           0
_reflns_Friedel_coverage           0.677
_reflns_Friedel_fraction_full      0.963
_reflns_Friedel_fraction_max       0.971
_reflns_number_gt                  491
_reflns_number_total               498
_reflns_special_details
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression       'I > 2σ(I)'
_computing_cell_refinement         'SAINT V8.40B (?, 2016)'
_computing_data_collection         ?
_computing_data_reduction          'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics      'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement    'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution      'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max           0.255
_refine_diff_density_min           -0.319
_refine_diff_density_rms           0.076
_refine_ls_abs_structure_details
;
 Flack x determined using 191 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack     0.01(2)
_refine_ls_extinction_coef         .
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.180
_refine_ls_hydrogen_treatment      undef
_refine_ls_matrix_type             full
_refine_ls_number_parameters       47
_refine_ls_number_reflns           498
_refine_ls_number_restraints       0
_refine_ls_R_factor_all            0.0187
_refine_ls_R_factor_gt             0.0184
_refine_ls_restrained_S_all        1.180
_refine_ls_shift/su_max            0.000
_refine_ls_shift/su_mean           0.000
_refine_ls_structure_factor_coef   Fsqd
_refine_ls_weighting_details      
 'w=1/[σ²(Fo²)+1.9130P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.0468
_refine_ls_wR_factor_ref           0.0470
_refine_special_details            ?
_olex2_refinement_description
;
;
_atom_sites_solution_hydrogens     .
_atom_sites_solution_primary       dual
_atom_sites_solution_secondary     ?
loop_
  _atom_site_label
  _atom_site_type_symbol
  _atom_site_fract_x
  _atom_site_fract_y
  _atom_site_fract_z
  _atom_site_U_iso_or_equiv
  _atom_site_adp_type
  _atom_site_occupancy
  _atom_site_site_symmetry_order
  _atom_site_calc_flag
  _atom_site_refinement_flags_posn
  _atom_site_refinement_flags_adp
  _atom_site_refinement_flags_occupancy
  _atom_site_disorder_assembly
  _atom_site_disorder_group
 V2 V 0.500000 0.000000 0.250000 0.0056(3) Uani 1 4 d S T P . .
 V1 V 0.250000 0.35023(12) 0.375000 0.0062(2) Uani 1 2 d S T P . .
 Mg2 Mg 1.000000 0.000000 0.27444(9) 0.0085(4) Uani 1 2 d S T P . .
 Mg1 Mg 0.750000 0.2421(3) 0.375000 0.0079(4) Uani 1 2 d S T P . .
 O1 O 0.2094(4) 0.5092(4) 0.44344(13) 0.0098(6) Uani 1 1 d . . . . .
 O2 O 0.4572(3) 0.2275(4) 0.39882(14) 0.0104(5) Uani 1 1 d . . . . .
 O3 O 0.7084(4) 0.0534(4) 0.29549(13) 0.0091(6) Uani 1 1 d . . . . .
 Li1 Li 0.500000 0.500000 0.500000 0.013(3) Uani 1 4 d S T P . .


_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
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
 V2 Mg1 3.3665(9) 12_545 ?
 V2 Mg1 3.3665(9) . ?
 V2 Mg1 3.3665(9) 2_655 ?
 V2 Mg1 3.3665(9) 11 ?
 V2 O3 1.711(3) 11 ?
 V2 O3 1.711(3) 12_545 ?
 V2 O3 1.711(3) . ?
 V2 O3 1.711(3) 2_655 ?
 V1 Mg1 2.800(2) 2_665 ?
 V1 O1 1.719(3) 5 ?
 V1 O1 1.719(3) . ?
 V1 O2 1.714(2) 5 ?
 V1 O2 1.715(2) . ?
 V1 Li1 3.1028(4) . ?
 V1 Li1 3.1028(4) 5 ?
 Mg2 Mg1 3.0577(15) . ?
 Mg2 Mg1 3.0577(15) 2_755 ?
 Mg2 O1 2.105(3) 8_554 ?
 Mg2 O1 2.105(3) 7_654 ?
 Mg2 O2 2.155(3) 6 ?
 Mg2 O2 2.155(3) 5_655 ?
 Mg2 O3 2.074(3) 2_755 ?
 Mg2 O3 2.074(3) . ?
 Mg2 Li1 3.4648(4) 5_645 ?
 Mg2 Li1 3.4648(4) 5_655 ?
 Mg1 O1 2.163(3) 6_565 ?
 Mg1 O1 2.163(3) 2_665 ?
 Mg1 O2 2.063(2) 5_655 ?
 Mg1 O2 2.063(2) . ?
 Mg1 O3 2.009(3) 5_655 ?
 Mg1 O3 2.009(3) . ?
 Mg1 Li1 3.4215(9) . ?
 O1 Li1 2.267(3) . ?

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
 Mg1 V2 Mg1 90.45(3) 11 12_545 ?
 Mg1 V2 Mg1 119.739(18) 11 2_655 ?
 Mg1 V2 Mg1 119.739(18) 12_545 2_655 ?
 Mg1 V2 Mg1 90.45(3) 2_655 . ?
 Mg1 V2 Mg1 119.739(18) 11 . ?
 Mg1 V2 Mg1 119.739(18) 12_545 . ?
 O3 V2 Mg1 131.23(9) 2_655 11 ?
 O3 V2 Mg1 131.23(9) 11 . ?
 O3 V2 Mg1 131.23(9) . 12_545 ?
 O3 V2 Mg1 100.21(9) 11 12_545 ?
 O3 V2 Mg1 131.23(9) 12_545 2_655 ?
 O3 V2 Mg1 92.94(9) 2_655 12_545 ?
 O3 V2 Mg1 27.43(9) 12_545 12_545 ?
 O3 V2 Mg1 92.94(9) . 11 ?
 O3 V2 Mg1 100.21(9) . 2_655 ?
 O3 V2 Mg1 92.94(9) 12_545 . ?
 O3 V2 Mg1 27.43(9) 2_655 2_655 ?
 O3 V2 Mg1 92.94(9) 11 2_655 ?
 O3 V2 Mg1 100.21(9) 2_655 . ?
 O3 V2 Mg1 100.21(9) 12_545 11 ?
 O3 V2 Mg1 27.43(9) 11 11 ?
 O3 V2 Mg1 27.43(8) . . ?
 O3 V2 O3 119.43(17) 2_655 . ?
 O3 V2 O3 104.73(8) 12_545 . ?
 O3 V2 O3 119.43(17) 11 12_545 ?
 O3 V2 O3 104.73(8) 11 . ?
 O3 V2 O3 104.73(8) 11 2_655 ?
 O3 V2 O3 104.73(8) 2_655 12_545 ?
 Mg1 V1 Li1 70.641(14) 2_665 . ?
 Mg1 V1 Li1 70.641(14) 2_665 5 ?
 O1 V1 Mg1 50.57(9) . 2_665 ?
 O1 V1 Mg1 50.57(9) 5 2_665 ?
 O1 V1 O1 101.14(18) . 5 ?
 O1 V1 Li1 45.75(9) 5 5 ?
 O1 V1 Li1 106.06(9) . 5 ?
 O1 V1 Li1 45.75(9) . . ?
 O1 V1 Li1 106.07(9) 5 . ?
 O2 V1 Mg1 119.45(9) . 2_665 ?
 O2 V1 Mg1 119.45(9) 5 2_665 ?
 O2 V1 O1 104.36(13) . . ?
 O2 V1 O1 112.12(12) . 5 ?
 O2 V1 O1 112.12(12) 5 . ?
 O2 V1 O1 104.36(13) 5 5 ?
 O2 V1 O2 121.10(18) 5 . ?
 O2 V1 Li1 145.45(9) . 5 ?
 O2 V1 Li1 60.15(9) . . ?
 O2 V1 Li1 145.45(9) 5 . ?
 O2 V1 Li1 60.15(9) 5 5 ?
 Li1 V1 Li1 141.28(3) . 5 ?
 Mg1 Mg2 Mg1 102.81(6) 2_755 . ?
 Mg1 Mg2 Li1 128.48(4) 2_755 5_655 ?
 Mg1 Mg2 Li1 128.48(4) . 5_645 ?
 Mg1 Mg2 Li1 62.91(3) . 5_655 ?
 Mg1 Mg2 Li1 62.91(3) 2_755 5_645 ?
 O1 Mg2 Mg1 144.07(8) 7_654 . ?
 O1 Mg2 Mg1 95.79(8) 8_554 . ?
 O1 Mg2 Mg1 144.07(8) 8_554 2_755 ?
 O1 Mg2 Mg1 95.79(8) 7_654 2_755 ?
 O1 Mg2 O1 86.25(15) 7_654 8_554 ?
 O1 Mg2 O2 89.64(10) 8_554 5_655 ?
 O1 Mg2 O2 172.74(10) 7_654 5_655 ?
 O1 Mg2 O2 89.64(10) 7_654 6 ?
 O1 Mg2 O2 172.74(10) 8_554 6 ?
 O1 Mg2 Li1 125.39(9) 7_654 5_655 ?
 O1 Mg2 Li1 39.24(7) 8_554 5_655 ?
 O1 Mg2 Li1 39.24(7) 7_654 5_645 ?
 O1 Mg2 Li1 125.39(9) 8_554 5_645 ?
 O2 Mg2 Mg1 84.05(9) 5_655 2_755 ?
 O2 Mg2 Mg1 84.05(9) 6 . ?
 O2 Mg2 Mg1 42.37(7) 6 2_755 ?
 O2 Mg2 Mg1 42.37(7) 5_655 . ?
 O2 Mg2 O2 95.04(16) 5_655 6 ?
 O2 Mg2 Li1 51.10(7) 5_655 5_655 ?
 O2 Mg2 Li1 143.97(9) 6 5_655 ?
 O2 Mg2 Li1 51.10(7) 6 5_645 ?
 O2 Mg2 Li1 143.97(9) 5_655 5_645 ?
 O3 Mg2 Mg1 121.20(9) 2_755 . ?
 O3 Mg2 Mg1 40.70(7) . . ?
 O3 Mg2 Mg1 40.70(7) 2_755 2_755 ?
 O3 Mg2 Mg1 121.19(9) . 2_755 ?
 O3 Mg2 O1 103.43(10) . 7_654 ?
 O3 Mg2 O1 92.80(10) 2_755 7_654 ?
 O3 Mg2 O1 92.80(10) . 8_554 ?
 O3 Mg2 O1 103.42(11) 2_755 8_554 ?
 O3 Mg2 O2 82.73(10) 2_755 6 ?
 O3 Mg2 O2 82.33(10) . 6 ?
 O3 Mg2 O2 82.33(10) 2_755 5_655 ?
 O3 Mg2 O2 82.73(10) . 5_655 ?
 O3 Mg2 O3 157.80(16) 2_755 . ?
 O3 Mg2 Li1 101.59(7) 2_755 5_655 ?
 O3 Mg2 Li1 81.41(7) . 5_655 ?
 O3 Mg2 Li1 81.41(7) 2_755 5_645 ?
 O3 Mg2 Li1 101.59(7) . 5_645 ?
 Li1 Mg2 Li1 164.62(5) 5_645 5_655 ?
 V2 Mg1 V2 120.81(5) . 5_655 ?
 V2 Mg1 Li1 119.198(4) . . ?
 V2 Mg1 Li1 91.344(8) 5_655 . ?
 V1 Mg1 V2 119.59(3) 2_665 . ?
 V1 Mg1 V2 119.59(3) 2_665 5_655 ?
 V1 Mg1 Mg2 122.94(3) 2_665 5_655 ?
 V1 Mg1 Mg2 122.94(3) 2_665 . ?
 V1 Mg1 Li1 58.82(3) 2_665 . ?
 Mg2 Mg1 V2 65.07(3) 5_655 5_655 ?
 Mg2 Mg1 V2 65.07(3) . . ?
 Mg2 Mg1 V2 83.37(4) . 5_655 ?
 Mg2 Mg1 V2 83.37(4) 5_655 . ?
 Mg2 Mg1 Mg2 114.13(6) . 5_655 ?
 Mg2 Mg1 Li1 174.55(3) . . ?
 Mg2 Mg1 Li1 64.368(15) 5_655 . ?
 O1 Mg1 V2 151.44(8) 2_665 . ?
 O1 Mg1 V2 84.34(7) 2_665 5_655 ?
 O1 Mg1 V2 151.44(8) 6_565 5_655 ?
 O1 Mg1 V2 84.34(7) 6_565 . ?
 O1 Mg1 V1 37.86(7) 6_565 2_665 ?
 O1 Mg1 V1 37.86(7) 2_665 2_665 ?
 O1 Mg1 Mg2 136.98(7) 2_665 . ?
 O1 Mg1 Mg2 136.98(7) 6_565 5_655 ?
 O1 Mg1 Mg2 97.32(7) 6_565 . ?
 O1 Mg1 Mg2 97.31(7) 2_665 5_655 ?
 O1 Mg1 O1 75.73(15) 2_665 6_565 ?
 O1 Mg1 Li1 86.70(8) 6_565 . ?
 O1 Mg1 Li1 40.55(7) 2_665 . ?
 O2 Mg1 V2 68.49(8) . . ?
 O2 Mg1 V2 68.49(8) 5_655 5_655 ?
 O2 Mg1 V2 108.59(8) 5_655 . ?
 O2 Mg1 V2 108.59(8) . 5_655 ?
 O2 Mg1 V1 92.79(9) . 2_665 ?
 O2 Mg1 V1 92.78(9) 5_655 2_665 ?
 O2 Mg1 Mg2 131.10(10) . . ?
 O2 Mg1 Mg2 131.10(10) 5_655 5_655 ?
 O2 Mg1 Mg2 44.75(7) . 5_655 ?
 O2 Mg1 Mg2 44.75(7) 5_655 . ?
 O2 Mg1 O1 91.87(11) . 2_665 ?
 O2 Mg1 O1 92.53(10) . 6_565 ?
 O2 Mg1 O1 92.53(11) 5_655 2_665 ?
 O2 Mg1 O1 91.87(11) 5_655 6_565 ?
 O2 Mg1 O2 174.43(18) . 5_655 ?
 O2 Mg1 Li1 131.75(8) 5_655 . ?
 O2 Mg1 Li1 52.00(8) . . ?
 O3 Mg1 V2 23.10(7) 5_655 5_655 ?
 O3 Mg1 V2 106.42(9) . 5_655 ?
 O3 Mg1 V2 106.42(10) 5_655 . ?
 O3 Mg1 V2 23.10(7) . . ?
 O3 Mg1 V1 130.18(8) . 2_665 ?
 O3 Mg1 V1 130.17(8) 5_655 2_665 ?
 O3 Mg1 Mg2 92.17(9) . 5_655 ?
 O3 Mg1 Mg2 42.33(8) 5_655 5_655 ?
 O3 Mg1 Mg2 92.17(9) 5_655 . ?
 O3 Mg1 Mg2 42.33(8) . . ?
 O3 Mg1 O1 168.00(12) 5_655 6_565 ?
 O3 Mg1 O1 168.00(12) . 2_665 ?
 O3 Mg1 O1 92.32(10) 5_655 2_665 ?
 O3 Mg1 O1 92.32(10) . 6_565 ?
 O3 Mg1 O2 86.71(11) 5_655 . ?
 O3 Mg1 O2 89.69(11) 5_655 5_655 ?
 O3 Mg1 O2 89.69(11) . . ?
 O3 Mg1 O2 86.71(11) . 5_655 ?
 O3 Mg1 O3 99.65(17) . 5_655 ?
 O3 Mg1 Li1 83.39(7) 5_655 . ?
 O3 Mg1 Li1 141.53(8) . . ?
 V1 O1 Mg2 130.01(15) . 15_464 ?
 V1 O1 Mg1 91.57(12) . 2_665 ?
 V1 O1 Li1 101.35(12) . . ?
 Mg2 O1 Mg1 123.35(13) 15_464 2_665 ?
 Mg2 O1 Li1 104.78(11) 15_464 . ?
 Mg1 O1 Li1 101.10(10) 2_665 . ?
 V1 O2 Mg2 130.35(13) . 5_655 ?
 V1 O2 Mg1 136.65(15) . . ?
 Mg1 O2 Mg2 92.88(10) . 5_655 ?
 V2 O3 Mg2 132.26(14) . . ?
 V2 O3 Mg1 129.47(14) . . ?
 Mg1 O3 Mg2 96.97(11) . . ?
 V1 Li1 V1 125.729(9) 3_566 2_665 ?
 V1 Li1 V1 125.729(8) . 3_566 ?
 V1 Li1 V1 80.334(14) . 2_665 ?
 V1 Li1 V1 125.729(9) 4_656 2_665 ?
 V1 Li1 V1 80.334(14) 3_566 4_656 ?
 V1 Li1 V1 125.730(8) . 4_656 ?
 V1 Li1 Mg1 50.53(3) 2_665 . ?
 V1 Li1 Mg1 169.214(17) 3_566 . ?
 V1 Li1 Mg1 94.40(2) 4_656 . ?
 V1 Li1 Mg1 50.53(3) 3_566 4_656 ?
 V1 Li1 Mg1 169.214(17) 2_665 3_566 ?
 V1 Li1 Mg1 64.943(9) 2_665 2_665 ?
 V1 Li1 Mg1 64.943(9) 3_566 3_566 ?
 V1 Li1 Mg1 169.213(17) . 4_656 ?
 V1 Li1 Mg1 94.40(2) . 3_566 ?
 V1 Li1 Mg1 50.53(3) 4_656 3_566 ?
 V1 Li1 Mg1 64.943(10) 4_656 4_656 ?
 V1 Li1 Mg1 64.943(10) . . ?
 V1 Li1 Mg1 50.53(3) . 2_665 ?
 V1 Li1 Mg1 94.40(2) 3_566 2_665 ?
 V1 Li1 Mg1 169.214(17) 4_656 2_665 ?
 V1 Li1 Mg1 94.40(2) 2_665 4_656 ?
 Mg1 Li1 Mg1 92.26(3) . 2_665 ?
 Mg1 Li1 Mg1 118.701(18) . 4_656 ?
 Mg1 Li1 Mg1 92.27(3) 4_656 3_566 ?
 Mg1 Li1 Mg1 118.701(17) 2_665 3_566 ?
 Mg1 Li1 Mg1 118.701(18) 4_656 2_665 ?
 Mg1 Li1 Mg1 118.701(17) . 3_566 ?
 O1 Li1 V1 96.68(6) . 2_665 ?
 O1 Li1 V1 131.99(7) . 4_656 ?
 O1 Li1 V1 131.99(7) 4_656 2_665 ?
 O1 Li1 V1 131.99(7) 3_566 . ?
 O1 Li1 V1 96.68(6) 2_665 . ?
 O1 Li1 V1 93.12(7) . 3_566 ?
 O1 Li1 V1 93.12(7) 3_566 2_665 ?
 O1 Li1 V1 96.68(6) 3_566 4_656 ?
 O1 Li1 V1 32.90(7) 4_656 4_656 ?
 O1 Li1 V1 32.90(7) 2_665 2_665 ?
 O1 Li1 V1 32.90(7) . . ?
 O1 Li1 V1 93.12(7) 4_656 . ?
 O1 Li1 V1 32.90(7) 3_566 3_566 ?
 O1 Li1 V1 93.12(7) 2_665 4_656 ?
 O1 Li1 V1 96.68(6) 4_656 3_566 ?
 O1 Li1 V1 131.99(7) 2_665 3_566 ?
 O1 Li1 Mg1 38.35(7) 2_665 . ?
 O1 Li1 Mg1 38.35(7) . 2_665 ?
 O1 Li1 Mg1 140.33(7) 3_566 . ?
 O1 Li1 Mg1 140.33(7) 2_665 3_566 ?
 O1 Li1 Mg1 140.33(7) 4_656 2_665 ?
 O1 Li1 Mg1 83.46(7) 4_656 . ?
 O1 Li1 Mg1 97.37(6) 4_656 4_656 ?
 O1 Li1 Mg1 38.35(7) 4_656 3_566 ?
 O1 Li1 Mg1 83.47(7) . 3_566 ?
 O1 Li1 Mg1 97.37(6) . . ?
 O1 Li1 Mg1 97.37(6) 3_566 3_566 ?
 O1 Li1 Mg1 83.46(7) 2_665 4_656 ?
 O1 Li1 Mg1 97.37(6) 2_665 2_665 ?
 O1 Li1 Mg1 38.35(7) 3_566 4_656 ?
 O1 Li1 Mg1 83.46(7) 3_566 2_665 ?
 O1 Li1 Mg1 140.33(7) . 4_656 ?
 O1 Li1 O1 123.51(13) 3_566 4_656 ?
 O1 Li1 O1 102.94(5) 4_656 2_665 ?
 O1 Li1 O1 102.94(6) 4_656 . ?
 O1 Li1 O1 123.51(13) 2_665 . ?
 O1 Li1 O1 102.94(5) 3_566 . ?
 O1 Li1 O1 102.94(6) 3_566 2_665 ?

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
 Mg1 V2 O3 Mg2 -88.76(19) 12_545 . . . ?
 Mg1 V2 O3 Mg2 4.42(18) 11 . . . ?
 Mg1 V2 O3 Mg2 125.35(17) 2_655 . . . ?
 Mg1 V2 O3 Mg2 -163.9(3) . . . . ?
 Mg1 V2 O3 Mg1 -70.76(19) 2_655 . . . ?
 Mg1 V2 O3 Mg1 75.1(2) 12_545 . . . ?
 Mg1 V2 O3 Mg1 168.31(17) 11 . . . ?
 Mg1 V1 O1 Mg2 137.8(2) 2_665 . . 15_464 ?
 Mg1 V1 O1 Li1 -101.65(12) 2_665 . . . ?
 Mg1 V1 O2 Mg2 127.77(15) 2_665 . . 5_655 ?
 Mg1 V1 O2 Mg1 -47.2(2) 2_665 . . . ?
 O1 V1 O1 Mg2 137.8(2) 5 . . 15_464 ?
 O1 V1 O1 Mg1 0.000(0) 5 . . 2_665 ?
 O1 V1 O1 Li1 -101.65(12) 5 . . . ?
 O1 V1 O2 Mg2 75.2(2) . . . 5_655 ?
 O1 V1 O2 Mg2 -176.13(17) 5 . . 5_655 ?
 O1 V1 O2 Mg1 8.9(3) 5 . . . ?
 O1 V1 O2 Mg1 -99.7(2) . . . . ?
 O2 V1 O1 Mg2 27.2(2) 5 . . 15_464 ?
 O2 V1 O1 Mg2 -105.66(19) . . . 15_464 ?
 O2 V1 O1 Mg1 -110.66(12) 5 . . 2_665 ?
 O2 V1 O1 Mg1 116.52(11) . . . 2_665 ?
 O2 V1 O1 Li1 147.69(11) 5 . . . ?
 O2 V1 O1 Li1 14.88(14) . . . . ?
 O2 V1 O2 Mg2 -52.23(15) 5 . . 5_655 ?
 O2 V1 O2 Mg1 132.8(2) 5 . . . ?
 O3 V2 O3 Mg2 29.5(2) 11 . . . ?
 O3 V2 O3 Mg2 146.3(2) 2_655 . . . ?
 O3 V2 O3 Mg2 -96.9(2) 12_545 . . . ?
 O3 V2 O3 Mg1 -49.81(15) 2_655 . . . ?
 O3 V2 O3 Mg1 -166.6(2) 11 . . . ?
 O3 V2 O3 Mg1 66.95(10) 12_545 . . . ?
 Li1 V1 O1 Mg2 90.93(18) 5 . . 15_464 ?
 Li1 V1 O1 Mg2 -120.5(2) . . . 15_464 ?
 Li1 V1 O1 Mg1 -46.89(9) 5 . . 2_665 ?
 Li1 V1 O1 Mg1 101.65(12) . . . 2_665 ?
 Li1 V1 O1 Li1 -148.54(7) 5 . . . ?
 Li1 V1 O2 Mg2 87.49(18) . . . 5_655 ?
 Li1 V1 O2 Mg2 -133.68(13) 5 . . 5_655 ?
 Li1 V1 O2 Mg1 51.3(3) 5 . . . ?
 Li1 V1 O2 Mg1 -87.5(2) . . . . ?

_olex2_submission_special_instructions  'No special instructions were received'
