#------------------------------------------------------------------------------
#$Date: 2021-04-29 12:23:44 +0300 (Thu, 29 Apr 2021) $
#$Revision: 264694 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/22/1562281.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_1562281
loop_
_publ_author_name
'Mosymow, E.'
'Glaum, R.'
'Kremer, R.K.'
_publ_section_title
;
 Searching for “LiCrIIPO4”
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              131
_journal_page_last               140
_journal_paper_doi               10.1016/j.jssc.2014.06.020
_journal_volume                  218
_journal_year                    2014
_chemical_compound_source        'synthesis as described'
_chemical_formula_moiety         'Cr3 Li5 O16 P4'
_chemical_formula_sum            'Cr3 Li5 O16 P4'
_chemical_formula_weight         570.58
_chemical_name_systematic
;
 lithium chromium (II / III) phosphate
;
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                109.981(18)
_cell_angle_beta                 90.713(15)
_cell_angle_gamma                104.914(14)
_cell_formula_units_Z            1
_cell_length_a                   4.9379(7)
_cell_length_b                   7.9166(17)
_cell_length_c                   8.4262(16)
_cell_measurement_reflns_used    5593
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.53
_cell_measurement_theta_min      3.10
_cell_measurement_wavelength     0.71073
_cell_volume                     297.30(10)
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1986)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0314
_diffrn_reflns_av_unetI/netI     0.0242
_diffrn_reflns_limit_h_max       5
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       11
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            4069
_diffrn_reflns_theta_full        29.1
_diffrn_reflns_theta_max         29.1
_diffrn_reflns_theta_min         3.09
_exptl_absorpt_coefficient_mu    3.334
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            green-grey
_exptl_crystal_density_diffrn    3.187
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             275
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.481
_refine_diff_density_min         -0.461
_refine_diff_density_rms         0.103
_refine_ls_extinction_coef       0.032(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.135
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     131
_refine_ls_number_reflns         1594
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.135
_refine_ls_R_factor_all          0.0241
_refine_ls_R_factor_gt           0.0222
_refine_ls_shift/su_max          0
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0337P)²+0.2732P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0665
_refine_ls_wR_factor_ref         0.0671
_reflns_number_gt                1467
_reflns_number_total             1594
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            JSSC-2014-218-131.cif
_cod_data_source_block           2015
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_geom_angle_publ_flag' value 'N' was changed to 'n' in
accordance with the built-in table derived from the CIF Core
dictionary named 'cif_core.dic' version 2.4.5 last updated on
2014-11-21 (256 times).

data item '_geom_bond_publ_flag' value 'Y' was changed to 'y' in
accordance with the built-in table derived from the CIF Core
dictionary named 'cif_core.dic' version 2.4.5 last updated on
2014-11-21 (69 times).

Automatic conversion script
Id: cif_fix_values 8369 2020-08-20 11:38:08Z andrius 
;
_cod_database_code               1562281
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cr1 Cr 0.5 0.5 0.5 0.00752(12) Uani 1 2 d S . .
Cr2 Cr 1 0.5 0 0.01357(13) Uani 1 2 d S . .
Cr3 Cr 0.40652(13) 0.24558(8) 0.72031(7) 0.01178(14) Uani 0.5 1 d P . .
Li3 Li 0.40652(13) 0.24558(8) 0.72031(7) 0.01178(14) Uani 0.5 1 d P . .
Li4 Li 0.8274(9) 0.1003(6) 0.1036(5) 0.0204(8) Uani 1 1 d . . .
Li5 Li -0.2429(11) -0.0168(7) 0.7112(6) 0.0293(10) Uani 1 1 d . . .
P1 P 0.41199(10) 0.30355(6) 0.09434(6) 0.00822(13) Uani 1 1 d . . .
P2 P -0.12798(10) 0.20734(7) 0.46882(6) 0.00849(13) Uani 1 1 d . . .
O1 O 0.2581(3) 0.11787(19) 0.11025(18) 0.0124(3) Uani 1 1 d . . .
O2 O 0.4117(3) 0.4703(2) 0.25764(17) 0.0116(3) Uani 1 1 d . . .
O3 O 0.7105(3) 0.2980(2) 0.04926(19) 0.0123(3) Uani 1 1 d . . .
O4 O -0.2452(3) 0.3468(2) 0.42452(18) 0.0121(3) Uani 1 1 d . . .
O5 O 0.2009(3) 0.26883(19) 0.49188(18) 0.0109(3) Uani 1 1 d . . .
O6 O -0.2100(3) 0.0246(2) 0.31179(19) 0.0154(3) Uani 1 1 d . . .
O7 O 0.2546(3) 0.33127(19) -0.05107(17) 0.0104(3) Uani 1 1 d . . .
O8 O -0.2354(3) 0.1762(2) 0.62832(19) 0.0144(3) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Cr Cr 0.3209 0.6236 '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'
O O 0.0106 0.006 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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
O4 Cr1 O4 180.0000(10) 1_655 2_566 n
O4 Cr1 O2 88.43(6) 1_655 . n
O4 Cr1 O2 91.57(6) 2_566 . n
O4 Cr1 O2 91.57(6) 1_655 2_666 n
O4 Cr1 O2 88.43(6) 2_566 2_666 n
O2 Cr1 O2 180 . 2_666 n
O4 Cr1 O5 91.46(6) 1_655 2_666 n
O4 Cr1 O5 88.54(6) 2_566 2_666 n
O2 Cr1 O5 84.29(6) . 2_666 n
O2 Cr1 O5 95.71(6) 2_666 2_666 n
O4 Cr1 O5 88.54(6) 1_655 . n
O4 Cr1 O5 91.46(6) 2_566 . n
O2 Cr1 O5 95.71(6) . . n
O2 Cr1 O5 84.29(6) 2_666 . n
O5 Cr1 O5 180 2_666 . n
O4 Cr1 Li3 104.22(5) 1_655 2_666 n
O4 Cr1 Li3 75.78(5) 2_566 2_666 n
O2 Cr1 Li3 42.47(4) . 2_666 n
O2 Cr1 Li3 137.53(4) 2_666 2_666 n
O5 Cr1 Li3 45.71(4) 2_666 2_666 n
O5 Cr1 Li3 134.29(4) . 2_666 n
O7 Cr2 O7 180 2_665 1_655 n
O7 Cr2 O3 88.21(6) 2_665 2_765 n
O7 Cr2 O3 91.79(6) 1_655 2_765 n
O7 Cr2 O3 91.79(6) 2_665 . n
O7 Cr2 O3 88.21(6) 1_655 . n
O3 Cr2 O3 180 2_765 . n
O6 Cr3 O7 89.94(6) 2_556 1_556 n
O6 Cr3 O8 91.59(7) 2_556 1_655 n
O7 Cr3 O8 137.80(7) 1_556 1_655 n
O6 Cr3 O2 175.79(7) 2_556 2_666 n
O7 Cr3 O2 90.73(6) 1_556 2_666 n
O8 Cr3 O2 90.69(6) 1_655 2_666 n
O6 Cr3 O5 100.30(6) 2_556 . n
O7 Cr3 O5 119.85(6) 1_556 . n
O8 Cr3 O5 101.31(6) 1_655 . n
O2 Cr3 O5 75.78(6) 2_666 . n
O6 Cr3 Li5 60.88(10) 2_556 1_655 n
O7 Cr3 Li5 111.21(10) 1_556 1_655 n
O8 Cr3 Li5 37.96(9) 1_655 1_655 n
O2 Cr3 Li5 122.59(10) 2_666 1_655 n
O5 Cr3 Li5 125.56(10) . 1_655 n
O1 Li4 O3 105.45(19) 2_655 . n
O1 Li4 O6 112.3(2) 2_655 1_655 n
O3 Li4 O6 131.4(2) . 1_655 n
O1 Li4 O1 91.55(17) 2_655 1_655 n
O3 Li4 O1 116.7(2) . 1_655 n
O6 Li4 O1 92.16(17) 1_655 1_655 n
O1 Li4 Li4 47.54(13) 2_655 2_755 n
O3 Li4 Li4 121.1(3) . 2_755 n
O6 Li4 Li4 107.0(2) 1_655 2_755 n
O1 Li4 Li4 44.01(12) 1_655 2_755 n
O1 Li4 P2 143.07(19) 2_655 1_655 n
O3 Li4 P2 106.86(16) . 1_655 n
O6 Li4 P2 30.79(7) 1_655 1_655 n
O1 Li4 P2 89.59(14) 1_655 1_655 n
Li4 Li4 P2 123.4(2) 2_755 1_655 n
O1 Li4 Li5 101.38(19) 2_655 2_656 n
O3 Li4 Li5 146.1(2) . 2_656 n
O6 Li4 Li5 50.96(13) 1_655 2_656 n
O1 Li4 Li5 41.56(12) 1_655 2_656 n
Li4 Li4 Li5 65.47(18) 2_755 2_656 n
P2 Li4 Li5 57.93(12) 1_655 2_656 n
O1 Li4 P1 106.19(16) 2_655 . n
O3 Li4 P1 29.04(7) . . n
O6 Li4 P1 108.57(17) 1_655 . n
O1 Li4 P1 144.19(18) 1_655 . n
Li4 Li4 P1 142.4(2) 2_755 . n
P2 Li4 P1 93.82(12) 1_655 . n
Li5 Li4 P1 150.96(18) 2_656 . n
O1 Li4 P1 103.89(17) 2_655 1_655 n
O3 Li4 P1 87.32(15) . 1_655 n
O6 Li4 P1 111.15(16) 1_655 1_655 n
O1 Li4 P1 29.62(7) 1_655 1_655 n
Li4 Li4 P1 61.66(15) 2_755 1_655 n
P2 Li4 P1 95.02(12) 1_655 1_655 n
Li5 Li4 P1 66.12(12) 2_656 1_655 n
P1 Li4 P1 114.63(13) . 1_655 n
O1 Li4 P1 27.73(7) 2_655 2_655 n
O3 Li4 P1 122.80(17) . 2_655 n
O6 Li4 P1 85.50(14) 1_655 2_655 n
O1 Li4 P1 99.98(15) 1_655 2_655 n
Li4 Li4 P1 60.84(14) 2_755 2_655 n
P2 Li4 P1 116.14(14) 1_655 2_655 n
Li5 Li4 P1 90.22(15) 2_656 2_655 n
P1 Li4 P1 110.23(13) . 2_655 n
P1 Li4 P1 122.49(14) 1_655 2_655 n
O1 Li4 Li5 36.71(12) 2_655 1_654 n
O3 Li4 Li5 72.39(15) . 1_654 n
O6 Li4 Li5 148.8(2) 1_655 1_654 n
O1 Li4 Li5 92.38(17) 1_655 1_654 n
Li4 Li4 Li5 58.23(16) 2_755 1_654 n
P2 Li4 Li5 178.02(18) 1_655 1_654 n
Li5 Li4 Li5 123.70(16) 2_656 1_654 n
P1 Li4 Li5 84.69(14) . 1_654 n
P1 Li4 Li5 86.80(14) 1_655 1_654 n
P1 Li4 Li5 63.31(11) 2_655 1_654 n
O1 Li4 Li5 101.88(18) 2_655 2_556 n
O3 Li4 Li5 89.67(16) . 2_556 n
O6 Li4 Li5 54.01(13) 1_655 2_556 n
O1 Li4 Li5 146.15(19) 1_655 2_556 n
Li4 Li4 Li5 139.1(2) 2_755 2_556 n
P2 Li4 Li5 61.19(12) 1_655 2_556 n
Li5 Li4 Li5 104.84(17) 2_656 2_556 n
P1 Li4 Li5 60.84(11) . 2_556 n
P1 Li4 Li5 153.92(17) 1_655 2_556 n
P1 Li4 Li5 80.41(13) 2_655 2_556 n
Li5 Li4 Li5 116.87(15) 1_654 2_556 n
O8 Li5 O1 152.9(3) . 2_556 n
O8 Li5 O5 111.1(2) . 2_556 n
O1 Li5 O5 95.92(19) 2_556 2_556 n
O8 Li5 O6 98.8(2) . 2_556 n
O1 Li5 O6 90.19(19) 2_556 2_556 n
O5 Li5 O6 66.94(15) 2_556 2_556 n
O8 Li5 P2 105.84(19) . 2_556 n
O1 Li5 P2 95.74(18) 2_556 2_556 n
O5 Li5 P2 33.67(8) 2_556 2_556 n
O6 Li5 P2 33.39(8) 2_556 2_556 n
O8 Li5 Li4 134.0(2) . 2_656 n
O1 Li5 Li4 46.19(14) 2_556 2_656 n
O5 Li5 Li4 82.07(17) 2_556 2_656 n
O6 Li5 Li4 44.34(13) 2_556 2_656 n
P2 Li5 Li4 60.84(13) 2_556 2_656 n
O8 Li5 Cr3 42.64(11) . 1_455 n
O1 Li5 Cr3 118.3(2) 2_556 1_455 n
O5 Li5 Cr3 131.7(2) 2_556 1_455 n
O6 Li5 Cr3 138.56(18) 2_556 1_455 n
P2 Li5 Cr3 145.93(15) 2_556 1_455 n
Li4 Li5 Cr3 146.2(2) 2_656 1_455 n
O8 Li5 Li3 42.64(11) . 1_455 n
O1 Li5 Li3 118.3(2) 2_556 1_455 n
O5 Li5 Li3 131.7(2) 2_556 1_455 n
O6 Li5 Li3 138.56(18) 2_556 1_455 n
P2 Li5 Li3 145.93(15) 2_556 1_455 n
Li4 Li5 Li3 146.2(2) 2_656 1_455 n
Cr3 Li5 Li3 0.00(3) 1_455 1_455 n
O8 Li5 Li4 115.7(2) . 1_456 n
O1 Li5 Li4 37.76(13) 2_556 1_456 n
O5 Li5 Li4 131.37(19) 2_556 1_456 n
O6 Li5 Li4 93.34(18) 2_556 1_456 n
P2 Li5 Li4 117.12(17) 2_556 1_456 n
Li4 Li5 Li4 56.30(16) 2_656 1_456 n
Cr3 Li5 Li4 93.03(16) 1_455 1_456 n
Li3 Li5 Li4 93.03(16) 1_455 1_456 n
O8 Li5 P2 21.67(8) . . n
O1 Li5 P2 169.2(2) 2_556 . n
O5 Li5 P2 90.59(15) 2_556 . n
O6 Li5 P2 84.48(13) 2_556 . n
P2 Li5 P2 84.94(12) 2_556 . n
Li4 Li5 P2 126.93(18) 2_656 . n
Cr3 Li5 P2 61.96(8) 1_455 . n
Li3 Li5 P2 61.96(8) 1_455 . n
Li4 Li5 P2 133.09(18) 1_456 . n
O8 Li5 Li4 109.3(2) . 2_556 n
O1 Li5 Li4 58.83(14) 2_556 2_556 n
O5 Li5 Li4 112.39(18) 2_556 2_556 n
O6 Li5 Li4 149.01(18) 2_556 2_556 n
P2 Li5 Li4 139.60(17) 2_556 2_556 n
Li4 Li5 Li4 104.84(17) 2_656 2_556 n
Cr3 Li5 Li4 66.81(12) 1_455 2_556 n
Li3 Li5 Li4 66.81(12) 1_455 2_556 n
Li4 Li5 Li4 63.13(15) 1_456 2_556 n
P2 Li5 Li4 126.11(17) . 2_556 n
O1 P1 O3 108.78(8) . . n
O1 P1 O2 111.24(8) . . n
O3 P1 O2 112.71(8) . . n
O1 P1 O7 109.39(8) . . n
O3 P1 O7 108.45(8) . . n
O2 P1 O7 106.17(8) . . n
O1 P1 Li4 71.87(10) . . n
O3 P1 Li4 38.89(10) . . n
O2 P1 Li4 116.61(10) . . n
O7 P1 Li4 133.55(10) . . n
O1 P1 Li4 42.82(10) . 1_455 n
O3 P1 Li4 148.88(10) . 1_455 n
O2 P1 Li4 93.30(10) . 1_455 n
O7 P1 Li4 78.43(10) . 1_455 n
Li4 P1 Li4 114.63(13) . 1_455 n
O1 P1 Li4 37.06(10) . 2_655 n
O3 P1 Li4 92.32(10) . 2_655 n
O2 P1 Li4 146.89(10) . 2_655 n
O7 P1 Li4 84.50(10) . 2_655 n
Li4 P1 Li4 69.77(13) . 2_655 n
Li4 P1 Li4 57.51(14) 1_455 2_655 n
O1 P1 Li3 107.95(6) . 1_554 n
O3 P1 Li3 73.71(6) . 1_554 n
O2 P1 Li3 134.74(6) . 1_554 n
O7 P1 Li3 37.76(5) . 1_554 n
Li4 P1 Li3 96.30(8) . 1_554 n
Li4 P1 Li3 100.48(8) 1_455 1_554 n
Li4 P1 Li3 71.49(8) 2_655 1_554 n
O4 P2 O8 112.49(8) . . n
O4 P2 O6 106.55(9) . . n
O8 P2 O6 111.92(9) . . n
O4 P2 O5 111.49(8) . . n
O8 P2 O5 109.23(8) . . n
O6 P2 O5 104.91(8) . . n
O4 P2 Li5 126.49(10) . 2_556 n
O8 P2 Li5 121.02(10) . 2_556 n
O6 P2 Li5 53.69(12) . 2_556 n
O5 P2 Li5 51.45(12) . 2_556 n
O4 P2 Li4 72.64(10) . 1_455 n
O8 P2 Li4 150.34(11) . 1_455 n
O6 P2 Li4 42.43(10) . 1_455 n
O5 P2 Li4 94.53(10) . 1_455 n
Li5 P2 Li4 61.23(12) 2_556 1_455 n
O4 P2 Li5 137.73(11) . . n
O8 P2 Li5 27.03(11) . . n
O6 P2 Li5 91.10(11) . . n
O5 P2 Li5 99.96(11) . . n
Li5 P2 Li5 95.06(12) 2_556 . n
Li4 P2 Li5 133.52(12) 1_455 . n
P1 O1 Li5 134.58(17) . 2_556 n
P1 O1 Li4 115.21(15) . 2_655 n
Li5 O1 Li4 105.5(2) 2_556 2_655 n
P1 O1 Li4 107.56(13) . 1_455 n
Li5 O1 Li4 92.2(2) 2_556 1_455 n
Li4 O1 Li4 88.45(17) 2_655 1_455 n
P1 O2 Cr1 128.54(9) . . n
P1 O2 Li3 122.20(8) . 2_666 n
Cr1 O2 Li3 98.27(6) . 2_666 n
P1 O2 Cr3 122.20(8) . 2_666 n
Cr1 O2 Cr3 98.27(6) . 2_666 n
Li3 O2 Cr3 0.00(3) 2_666 2_666 n
P1 O3 Li4 112.07(15) . . n
P1 O3 Cr2 126.02(8) . . n
Li4 O3 Cr2 120.09(14) . . n
P2 O4 Cr1 141.12(9) . 1_455 n
P2 O5 Cr1 134.84(8) . . n
P2 O5 Li5 94.88(15) . 2_556 n
Cr1 O5 Li5 111.92(13) . 2_556 n
P2 O5 Cr3 115.93(8) . . n
Cr1 O5 Cr3 94.42(6) . . n
Li5 O5 Cr3 101.22(13) 2_556 . n
P2 O6 Li3 133.14(10) . 2_556 n
P2 O6 Cr3 133.14(10) . 2_556 n
Li3 O6 Cr3 0.000(16) 2_556 2_556 n
P2 O6 Li4 106.78(14) . 1_455 n
Li3 O6 Li4 118.70(13) 2_556 1_455 n
Cr3 O6 Li4 118.70(13) 2_556 1_455 n
P2 O6 Li5 92.93(15) . 2_556 n
Li3 O6 Li5 101.47(13) 2_556 2_556 n
Cr3 O6 Li5 101.47(13) 2_556 2_556 n
Li4 O6 Li5 84.70(16) 1_455 2_556 n
P1 O7 Cr2 120.78(8) . 1_455 n
P1 O7 Li3 114.44(8) . 1_554 n
Cr2 O7 Li3 122.74(7) 1_455 1_554 n
P1 O7 Cr3 114.44(8) . 1_554 n
Cr2 O7 Cr3 122.74(7) 1_455 1_554 n
Li3 O7 Cr3 0.00(3) 1_554 1_554 n
P2 O8 Li5 131.30(18) . . n
P2 O8 Li3 121.67(9) . 1_455 n
Li5 O8 Li3 99.40(17) . 1_455 n
P2 O8 Cr3 121.67(9) . 1_455 n
Li5 O8 Cr3 99.40(17) . 1_455 n
Li3 O8 Cr3 0.000(13) 1_455 1_455 n
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
Cr1 O4 1.9328(14) 1_655 y
Cr1 O4 1.9328(14) 2_566 y
Cr1 O2 2.0032(14) . y
Cr1 O2 2.0032(14) 2_666 y
Cr1 O5 2.0140(14) 2_666 y
Cr1 O5 2.0140(14) . y
Cr1 Li3 3.1327(8) 2_666 y
Cr2 O7 2.0089(14) 2_665 y
Cr2 O7 2.0089(14) 1_655 y
Cr2 O3 2.0161(15) 2_765 y
Cr2 O3 2.0161(15) . y
Cr3 O6 2.0294(16) 2_556 y
Cr3 O7 2.0343(15) 1_556 y
Cr3 O8 2.0670(16) 1_655 y
Cr3 O2 2.1376(16) 2_666 y
Cr3 O5 2.2493(15) . y
Cr3 Li5 3.010(5) 1_655 y
Li4 O1 1.972(4) 2_655 y
Li4 O3 1.985(4) . y
Li4 O6 2.035(4) 1_655 y
Li4 O1 2.094(4) 1_655 y
Li4 Li4 2.837(8) 2_755 y
Li4 P2 2.888(4) 1_655 y
Li4 Li5 2.899(6) 2_656 y
Li4 P1 2.930(4) . y
Li4 P1 2.937(4) 1_655 y
Li4 P1 2.960(4) 2_655 y
Li4 Li5 3.102(6) 1_654 y
Li4 Li5 3.323(6) 2_556 y
Li5 O8 1.877(4) . y
Li5 O1 1.925(4) 2_556 y
Li5 O5 2.200(5) 2_556 y
Li5 O6 2.261(5) 2_556 y
Li5 P2 2.803(5) 2_556 y
Li5 Li4 2.899(6) 2_656 y
Li5 Cr3 3.010(5) 1_455 y
Li5 Li3 3.010(5) 1_455 y
Li5 Li4 3.102(6) 1_456 y
Li5 P2 3.103(4) . y
Li5 Li4 3.323(6) 2_556 y
P1 O1 1.5226(15) . y
P1 O3 1.5346(14) . y
P1 O2 1.5480(15) . y
P1 O7 1.5494(14) . y
P1 Li4 2.937(4) 1_455 y
P1 Li4 2.960(4) 2_655 y
P1 Li3 3.0245(10) 1_554 y
P2 O4 1.5164(15) . y
P2 O8 1.5249(15) . y
P2 O6 1.5444(15) . y
P2 O5 1.5596(14) . y
P2 Li5 2.803(5) 2_556 y
P2 Li4 2.888(4) 1_455 y
O1 Li5 1.925(4) 2_556 y
O1 Li4 1.972(4) 2_655 y
O1 Li4 2.094(4) 1_455 y
O2 Li3 2.1376(16) 2_666 y
O2 Cr3 2.1376(16) 2_666 y
O4 Cr1 1.9328(14) 1_455 y
O5 Li5 2.200(5) 2_556 y
O6 Li3 2.0294(16) 2_556 y
O6 Cr3 2.0294(16) 2_556 y
O6 Li4 2.035(4) 1_455 y
O6 Li5 2.261(5) 2_556 y
O7 Cr2 2.0089(14) 1_455 y
O7 Li3 2.0343(15) 1_554 y
O7 Cr3 2.0343(15) 1_554 y
O8 Li3 2.0670(16) 1_455 y
O8 Cr3 2.0670(16) 1_455 y
