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###                                                                        ###
###           Full Paper (Acta Crystallographica Section C)                ###
###                                                                        ###
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#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section C. It conforms to the editorial and technical    #
# requirements of Notes for Authors for Section C, and has been peer         #
# reviewed under the auspices of the IUCr Commission on Journals.            #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
# cif/home.html                                                              #
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#            Copyright International Union of Crystallography                #
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data_global
_audit_creation_method     'form.cif (version 2.0)'
_journal_data_validation_number     ?
_journal_date_recd_electronic     2005-06-17
_journal_date_accepted     2005-11-14
_journal_name_full     'Acta Crystallographica, Section C'
_journal_year     2006
_journal_volume     62
_journal_issue      1
_journal_page_first     i1
_journal_page_last     i2
_journal_paper_category     FI
_journal_coeditor_code     TA1500
_publ_contact_author_name     "Frederic Hatert"
_publ_contact_author_address
;
University of Liege
Laboratory of Mineralogy B.18
B-4000 Liege
Belgium
;
_publ_contact_author_email     fhatert@ulg.ac.be
_publ_contact_author_fax     0032-4-366.22.02
_publ_contact_author_phone     0032-4-366.21.43
_publ_section_title
;
Na~1.50~Mn~2.48~Al~0.85~(PO₄)₃, a new synthetic alluaudite-type compound
;
loop_
    _publ_author_name
    _publ_author_address
    "Hatert, Frédéric"
;
University of Liège
Laboratory of Mineralogy B.18
B-4000 Liège
Belgium
;
_publ_section_synopsis
;
The title compound, an Na--Mn--Al-bearing phosphate, has been synthesized by
the hydrothermal technique. Its crystal structure is similar to that of the
natural mineral alluaudite.
;
data_I
_chemical_name_systematic     'Disodium dimanganese aluminium tris(phosphate)'
_chemical_name_common     ?
_chemical_formula_moiety     'Na1.50 Mn2.48 Al0.85 (P O4)3'
_chemical_formula_sum     'Al0.85 Mn2.48 Na1.50 O12 P3'
_chemical_formula_structural     'Na1.50 Mn2.48 Al0.85 (P O4)3'
_chemical_formula_analytical     'Na1.453 Mn2.518 Al0.772 P3.039 O12'
_chemical_formula_iupac     'Na1.50 Mn2.48 Al0.85 (P O4)3'
_chemical_formula_weight     468.76
_chemical_melting_point     ?
_symmetry_cell_setting     monoclinic
_symmetry_space_group_name_H-M     'C 2/c'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, y, -z+1/2'
    'x+1/2, y+1/2, z'
    '-x+1/2, y+1/2, -z+1/2'
    '-x, -y, -z'
    'x, -y, z-1/2'
    '-x+1/2, -y+1/2, -z'
    'x+1/2, -y+1/2, z-1/2'
_cell_length_a     11.9816(10)
_cell_length_b     12.5387(13)
_cell_length_c     6.4407(10)
_cell_angle_alpha     90.00
_cell_angle_beta     114.621(8)
_cell_angle_gamma     90.00
_cell_volume     879.64(18)
_cell_formula_units_Z     4
_cell_measurement_reflns_used     34
_cell_measurement_theta_min     5.83
_cell_measurement_theta_max     12.49
_cell_measurement_temperature     293(2)
_exptl_crystal_description     'Acicular, elongated along the c axis'
_exptl_crystal_colour     Colourless
_exptl_crystal_size_max     0.230
_exptl_crystal_size_mid     0.070
_exptl_crystal_size_min     0.050
_exptl_crystal_density_diffrn     3.614
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     922
_exptl_absorpt_coefficient_mu     4.310
_exptl_absorpt_correction_type     psi-scan
_exptl_absorpt_process_details     'XSCANS in SHELXTL-Plus (Sheldrick, 1991)'
_exptl_absorpt_correction_T_min     0.761
_exptl_absorpt_correction_T_max     0.806
_exptl_special_details
; ?
;
_diffrn_ambient_temperature     293(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Bruker P4'
_diffrn_measurement_method     'Profile data from ω'
_diffrn_detector_area_resol_mean     ?
_diffrn_reflns_number     1271
_diffrn_reflns_av_R_equivalents     0.0240
_diffrn_reflns_av_sigmaI/netI     0.0317
_diffrn_reflns_theta_min     2.48
_diffrn_reflns_theta_max     27.50
_diffrn_reflns_theta_full     27.50
_diffrn_measured_fraction_theta_max     1.000
_diffrn_measured_fraction_theta_full     1.000
_diffrn_reflns_limit_h_min     -15
_diffrn_reflns_limit_h_max     1
_diffrn_reflns_limit_k_min     -16
_diffrn_reflns_limit_k_max     1
_diffrn_reflns_limit_l_min     -7
_diffrn_reflns_limit_l_max     8
_diffrn_reflns_reduction_process     ?
_diffrn_standards_number     3
_diffrn_standards_interval_count     97
_diffrn_standards_interval_time     ?
_diffrn_standards_decay_%     2.3
loop_
    _diffrn_standard_refln_index_h
    _diffrn_standard_refln_index_k
    _diffrn_standard_refln_index_l
    ? ? ?
_refine_special_details
;
  Refinement of F² against ALL reflections.  The weighted R-factor wR and
  goodness of fit S are based on F², conventional R-factors R are based
  on F, with F set to zero for negative F². The threshold expression of
  F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
  not relevant to the choice of reflections for refinement.  R-factors based
  on F² are statistically about twice as large as those based on F, and R-
  factors based on ALL data will be even larger.
;
_reflns_number_total     1019
_reflns_number_gt     894
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0403
_refine_ls_R_factor_gt     0.0317
_refine_ls_wR_factor_gt     0.0717
_refine_ls_wR_factor_ref     0.0754
_refine_ls_goodness_of_fit_all     ?
_refine_ls_goodness_of_fit_ref     1.069
_refine_ls_restrained_S_all     1.068
_refine_ls_restrained_S_obs     ?
_refine_ls_number_reflns     1019
_refine_ls_number_parameters     100
_refine_ls_number_restraints     2
_refine_ls_number_constraints     ?
_refine_ls_hydrogen_treatment     .
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
       'calc w = 1/[σ²(Fo²)+(0.0344P)²+2.4705P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.000
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.520
_refine_diff_density_min     -0.647
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
_refine_ls_abs_structure_details     ?
_refine_ls_abs_structure_Flack     ?
_refine_ls_abs_structure_Rogers     ?
loop_
    _atom_type_symbol
    _atom_type_description
    _atom_type_scat_dispersion_real
    _atom_type_scat_dispersion_imag
    _atom_type_scat_source
    O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    Al Al 0.0645 0.0514 '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'
    Mn Mn 0.3368 0.7283 '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'
_computing_data_collection     'XSCANS in SHELXTL-Plus (Sheldrick, 1991)'
_computing_cell_refinement     'XSCANS'
_computing_data_reduction     'SHELXTL-Plus'
_computing_structure_solution     'SHELXS97 (Sheldrick, 1990)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'ATOMS (Dowty, 1993)'
_computing_publication_material     'SHELXTL-Plus'
loop_
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    _atom_site_type_symbol
    Na1 0.5000 0.0000 0.0000 0.0268(5) Uani d SP 0.619(8) . . Na
    Mn1 0.5000 0.0000 0.0000 0.0268(5) Uani d SP 0.381(7) . . Mn
    Na2 0.0000 -0.0207(2) 0.2500 0.0329(9) Uani d SP 0.891(10) . . Na
    Mn3 0.0000 0.26627(6) 0.2500 0.0144(3) Uani d SP 0.908(4) . . Mn
    Mn4 0.27572(5) 0.65456(5) 0.35763(10) 0.0137(2) Uani d P 0.573(6) . . Mn
    Al4 0.27572(5) 0.65456(5) 0.35763(10) 0.0137(2) Uani d P 0.427(6) . . Al
    P1 0.0000 -0.28457(9) 0.2500 0.0158(3) Uani d S 1 . . P
    P2 0.23711(7) -0.10611(7) 0.13087(13) 0.0154(2) Uani d . 1 . . P
    O1 0.4524(2) 0.71353(19) 0.5356(4) 0.0183(5) Uani d . 1 . . O
    O2 0.0959(3) 0.6397(2) 0.2321(5) 0.0422(9) Uani d . 1 . . O
    O3 0.3317(3) 0.6633(2) 0.0992(4) 0.0290(7) Uani d . 1 . . O
    O4 0.1268(2) 0.4078(2) 0.3175(5) 0.0266(6) Uani d . 1 . . O
    O5 0.2279(2) 0.8255(2) 0.3217(4) 0.0282(6) Uani d . 1 . . O
    O6 0.3272(3) 0.5010(2) 0.3849(5) 0.0291(6) Uani d . 1 . . O
_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_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Na1 O2 7 2.278(3) ?
    Na1 O2 3_545 2.278(3) ?
    Na1 O4 7 2.288(2) ?
    Na1 O4 3_545 2.288(2) ?
    Na1 O4 8 2.552(3) ?
    Na1 O4 4_545 2.552(3) ?
    Na1 O2 8 3.003(4) ?
    Na1 O2 4_545 3.003(4) ?
    Na1 P1 7_545 3.1447(10) ?
    Na1 P1 3 3.1447(10) ?
    Na1 Mn1 2_654 3.2204(5) ?
    Na1 Mn1 2_655 3.2204(5) ?
    Na2 O6 7_556 2.413(3) ?
    Na2 O6 8_455 2.413(3) ?
    Na2 O6 4_545 2.572(3) ?
    Na2 O6 3_445 2.572(3) ?
    Na2 O1 8_455 2.725(3) ?
    Na2 O1 7_556 2.725(3) ?
    Na2 O3 4_545 2.949(4) ?
    Na2 O3 3_445 2.949(4) ?
    Na2 Na2 5_556 3.2618(10) ?
    Na2 Na2 5 3.2618(10) ?
    Na2 Mn4 8_455 3.2814(16) ?
    Na2 Al4 8_455 3.2814(16) ?
    Mn3 O1 3_445 2.241(2) ?
    Mn3 O1 4_545 2.241(2) ?
    Mn3 O3 3_445 2.246(3) ?
    Mn3 O3 4_545 2.246(3) ?
    Mn3 O4 . 2.257(3) ?
    Mn3 O4 2 2.257(3) ?
    Mn3 Na1 4 3.3439(7) ?
    Mn3 Na1 3_455 3.3439(7) ?
    Mn4 O2 . 1.970(3) ?
    Mn4 O6 . 2.007(3) ?
    Mn4 O3 . 2.041(3) ?
    Mn4 O1 . 2.078(2) ?
    Mn4 O5 7_566 2.098(3) ?
    Mn4 O5 . 2.206(3) ?
    Mn4 Mn4 7_566 3.2268(12) ?
    Mn4 Na2 7_556 3.2814(16) ?
    Mn4 Na1 3_455 3.6925(7) ?
    P1 O2 2_545 1.531(3) ?
    P1 O2 1_545 1.531(3) ?
    P1 O1 7_556 1.539(2) ?
    P1 O1 8_455 1.539(2) ?
    P1 Na1 3_445 3.1447(10) ?
    P1 Na1 4_545 3.1447(10) ?
    P2 O6 4_545 1.531(3) ?
    P2 O4 4_545 1.533(3) ?
    P2 O5 1_545 1.540(3) ?
    P2 O3 7 1.540(2) ?
    P2 Na2 5 3.2877(16) ?
    P2 Na1 2_655 3.3323(9) ?
    O1 P1 7_556 1.539(2) ?
    O1 Mn3 3 2.241(2) ?
    O1 Na2 7_556 2.725(3) ?
    O2 P1 1_565 1.531(3) ?
    O2 Na1 3_455 2.278(3) ?
    O2 Mn1 3_455 2.278(3) ?
    O2 Na1 4 3.003(4) ?
    O3 P2 7 1.540(2) ?
    O3 Mn3 3 2.246(3) ?
    O3 Na2 3 2.949(4) ?
    O4 P2 4 1.533(3) ?
    O4 Na1 3_455 2.288(2) ?
    O4 Mn1 3_455 2.288(2) ?
    O4 Na1 4 2.552(3) ?
    O5 P2 1_565 1.540(3) ?
    O5 Al4 7_566 2.098(3) ?
    O5 Mn4 7_566 2.098(3) ?
    O6 P2 4 1.531(3) ?
    O6 Na2 7_556 2.413(3) ?
    O6 Na2 3 2.572(3) ?
loop_
    _geom_contact_atom_site_label_1
    _geom_contact_atom_site_label_2
    _geom_contact_distance
    _geom_contact_site_symmetry_1
    _geom_contact_site_symmetry_2
    _geom_contact_publ_flag
    ? ? ? ? ? ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    O2 Na1 O2 7 3_545 180.00(15) ?
    O2 Na1 O4 7 7 80.59(10) ?
    O2 Na1 O4 3_545 7 99.41(10) ?
    O2 Na1 O4 7 3_545 99.41(10) ?
    O2 Na1 O4 3_545 3_545 80.59(10) ?
    O4 Na1 O4 7 3_545 180.00(11) ?
    O2 Na1 O4 7 8 106.26(11) ?
    O2 Na1 O4 3_545 8 73.74(11) ?
    O4 Na1 O4 7 8 70.15(10) ?
    O4 Na1 O4 3_545 8 109.85(10) ?
    O2 Na1 O4 7 4_545 73.74(11) ?
    O2 Na1 O4 3_545 4_545 106.26(11) ?
    O4 Na1 O4 7 4_545 109.85(10) ?
    O4 Na1 O4 3_545 4_545 70.15(10) ?
    O4 Na1 O4 8 4_545 180.00(12) ?
    O2 Na1 O2 7 8 51.94(13) ?
    O2 Na1 O2 3_545 8 128.06(13) ?
    O4 Na1 O2 7 8 92.95(9) ?
    O4 Na1 O2 3_545 8 87.05(9) ?
    O4 Na1 O2 8 8 63.63(8) ?
    O4 Na1 O2 4_545 8 116.37(8) ?
    O2 Na1 O2 7 4_545 128.06(13) ?
    O2 Na1 O2 3_545 4_545 51.94(13) ?
    O4 Na1 O2 7 4_545 87.05(9) ?
    O4 Na1 O2 3_545 4_545 92.95(9) ?
    O4 Na1 O2 8 4_545 116.37(8) ?
    O4 Na1 O2 4_545 4_545 63.63(8) ?
    O2 Na1 O2 8 4_545 180.00(17) ?
    O2 Na1 P1 7 7_545 27.28(8) ?
    O2 Na1 P1 3_545 7_545 152.72(8) ?
    O4 Na1 P1 7 7_545 96.77(7) ?
    O4 Na1 P1 3_545 7_545 83.23(7) ?
    O4 Na1 P1 8 7_545 91.50(6) ?
    O4 Na1 P1 4_545 7_545 88.50(6) ?
    O2 Na1 P1 8 7_545 28.73(6) ?
    O2 Na1 P1 4_545 7_545 151.27(6) ?
    O2 Na1 P1 7 3 152.72(8) ?
    O2 Na1 P1 3_545 3 27.28(8) ?
    O4 Na1 P1 7 3 83.23(7) ?
    O4 Na1 P1 3_545 3 96.77(7) ?
    O4 Na1 P1 8 3 88.50(6) ?
    O4 Na1 P1 4_545 3 91.50(6) ?
    O2 Na1 P1 8 3 151.27(6) ?
    O2 Na1 P1 4_545 3 28.73(6) ?
    P1 Na1 P1 7_545 3 180.0 ?
    O2 Na1 Mn1 7 2_654 63.51(9) ?
    O2 Na1 Mn1 3_545 2_654 116.49(9) ?
    O4 Na1 Mn1 7 2_654 51.89(7) ?
    O4 Na1 Mn1 3_545 2_654 128.11(7) ?
    O4 Na1 Mn1 8 2_654 44.88(6) ?
    O4 Na1 Mn1 4_545 2_654 135.12(6) ?
    O2 Na1 Mn1 8 2_654 42.77(5) ?
    O2 Na1 Mn1 4_545 2_654 137.23(5) ?
    P1 Na1 Mn1 7_545 2_654 59.201(12) ?
    P1 Na1 Mn1 3 2_654 120.799(12) ?
    O2 Na1 Mn1 7 2_655 116.49(9) ?
    O2 Na1 Mn1 3_545 2_655 63.51(9) ?
    O4 Na1 Mn1 7 2_655 128.11(7) ?
    O4 Na1 Mn1 3_545 2_655 51.89(7) ?
    O4 Na1 Mn1 8 2_655 135.12(6) ?
    O4 Na1 Mn1 4_545 2_655 44.88(6) ?
    O2 Na1 Mn1 8 2_655 137.23(5) ?
    O2 Na1 Mn1 4_545 2_655 42.77(5) ?
    P1 Na1 Mn1 7_545 2_655 120.799(12) ?
    P1 Na1 Mn1 3 2_655 59.201(12) ?
    Mn1 Na1 Mn1 2_654 2_655 180.0 ?
    O6 Na2 O6 7_556 8_455 168.26(19) ?
    O6 Na2 O6 7_556 4_545 80.43(8) ?
    O6 Na2 O6 8_455 4_545 98.32(9) ?
    O6 Na2 O6 7_556 3_445 98.32(9) ?
    O6 Na2 O6 8_455 3_445 80.43(8) ?
    O6 Na2 O6 4_545 3_445 167.88(17) ?
    O6 Na2 O1 7_556 8_455 119.89(12) ?
    O6 Na2 O1 8_455 8_455 71.53(9) ?
    O6 Na2 O1 4_545 8_455 87.18(9) ?
    O6 Na2 O1 3_445 8_455 103.69(10) ?
    O6 Na2 O1 7_556 7_556 71.53(9) ?
    O6 Na2 O1 8_455 7_556 119.89(12) ?
    O6 Na2 O1 4_545 7_556 103.69(10) ?
    O6 Na2 O1 3_445 7_556 87.18(9) ?
    O1 Na2 O1 8_455 7_556 54.87(11) ?
    O6 Na2 O3 7_556 4_545 53.67(8) ?
    O6 Na2 O3 8_455 4_545 115.62(12) ?
    O6 Na2 O3 4_545 4_545 59.50(9) ?
    O6 Na2 O3 3_445 4_545 110.02(11) ?
    O1 Na2 O3 8_455 4_545 146.22(8) ?
    O1 Na2 O3 7_556 4_545 123.85(7) ?
    O6 Na2 O3 7_556 3_445 115.62(12) ?
    O6 Na2 O3 8_455 3_445 53.67(8) ?
    O6 Na2 O3 4_545 3_445 110.02(11) ?
    O6 Na2 O3 3_445 3_445 59.50(9) ?
    O1 Na2 O3 8_455 3_445 123.85(7) ?
    O1 Na2 O3 7_556 3_445 146.22(8) ?
    O3 Na2 O3 4_545 3_445 77.10(12) ?
    O6 Na2 Na2 7_556 5_556 51.27(7) ?
    O6 Na2 Na2 8_455 5_556 126.38(8) ?
    O6 Na2 Na2 4_545 5_556 130.38(7) ?
    O6 Na2 Na2 3_445 5_556 47.05(6) ?
    O1 Na2 Na2 8_455 5_556 123.72(13) ?
    O1 Na2 Na2 7_556 5_556 74.15(8) ?
    O3 Na2 Na2 4_545 5_556 80.31(9) ?
    O3 Na2 Na2 3_445 5_556 85.39(10) ?
    O6 Na2 Na2 7_556 5 126.38(8) ?
    O6 Na2 Na2 8_455 5 51.27(7) ?
    O6 Na2 Na2 4_545 5 47.05(6) ?
    O6 Na2 Na2 3_445 5 130.38(7) ?
    O1 Na2 Na2 8_455 5 74.15(8) ?
    O1 Na2 Na2 7_556 5 123.72(13) ?
    O3 Na2 Na2 4_545 5 85.39(10) ?
    O3 Na2 Na2 3_445 5 80.31(9) ?
    Na2 Na2 Na2 5_556 5 161.71(19) ?
    O6 Na2 Mn4 7_556 8_455 153.88(12) ?
    O6 Na2 Mn4 8_455 8_455 37.51(7) ?
    O6 Na2 Mn4 4_545 8_455 108.07(7) ?
    O6 Na2 Mn4 3_445 8_455 78.34(7) ?
    O1 Na2 Mn4 8_455 8_455 39.12(5) ?
    O1 Na2 Mn4 7_556 8_455 82.39(8) ?
    O3 Na2 Mn4 4_545 8_455 151.88(7) ?
    O3 Na2 Mn4 3_445 8_455 85.31(5) ?
    Na2 Na2 Mn4 5_556 8_455 120.32(6) ?
    Na2 Na2 Mn4 5 8_455 69.99(4) ?
    O6 Na2 Al4 7_556 8_455 153.88(12) ?
    O6 Na2 Al4 8_455 8_455 37.51(7) ?
    O6 Na2 Al4 4_545 8_455 108.07(7) ?
    O6 Na2 Al4 3_445 8_455 78.34(7) ?
    O1 Na2 Al4 8_455 8_455 39.12(5) ?
    O1 Na2 Al4 7_556 8_455 82.39(8) ?
    O3 Na2 Al4 4_545 8_455 151.88(7) ?
    O3 Na2 Al4 3_445 8_455 85.31(5) ?
    Na2 Na2 Al4 5_556 8_455 120.32(6) ?
    Na2 Na2 Al4 5 8_455 69.99(4) ?
    Mn4 Na2 Al4 8_455 8_455 0.00(3) ?
    O1 Mn3 O1 3_445 4_545 145.67(12) ?
    O1 Mn3 O3 3_445 3_445 72.27(9) ?
    O1 Mn3 O3 4_545 3_445 88.00(9) ?
    O1 Mn3 O3 3_445 4_545 88.00(9) ?
    O1 Mn3 O3 4_545 4_545 72.27(9) ?
    O3 Mn3 O3 3_445 4_545 109.79(14) ?
    O1 Mn3 O4 3_445 . 117.07(9) ?
    O1 Mn3 O4 4_545 . 90.52(9) ?
    O3 Mn3 O4 3_445 . 161.10(9) ?
    O3 Mn3 O4 4_545 . 87.61(9) ?
    O1 Mn3 O4 3_445 2 90.52(9) ?
    O1 Mn3 O4 4_545 2 117.07(9) ?
    O3 Mn3 O4 3_445 2 87.61(9) ?
    O3 Mn3 O4 4_545 2 161.10(9) ?
    O4 Mn3 O4 . 2 76.32(13) ?
    O1 Mn3 Na1 3_445 4 79.18(6) ?
    O1 Mn3 Na1 4_545 4 134.83(6) ?
    O3 Mn3 Na1 3_445 4 122.15(7) ?
    O3 Mn3 Na1 4_545 4 118.42(7) ?
    O4 Mn3 Na1 . 4 49.69(7) ?
    O4 Mn3 Na1 2 4 43.00(6) ?
    O1 Mn3 Na1 3_445 3_455 134.83(6) ?
    O1 Mn3 Na1 4_545 3_455 79.18(6) ?
    O3 Mn3 Na1 3_445 3_455 118.42(7) ?
    O3 Mn3 Na1 4_545 3_455 122.15(7) ?
    O4 Mn3 Na1 . 3_455 43.00(6) ?
    O4 Mn3 Na1 2 3_455 49.69(7) ?
    Na1 Mn3 Na1 4 3_455 57.571(15) ?
    O1 Mn3 Na2 3_445 . 72.84(6) ?
    O1 Mn3 Na2 4_545 . 72.84(6) ?
    O3 Mn3 Na2 3_445 . 54.89(7) ?
    O3 Mn3 Na2 4_545 . 54.89(7) ?
    O4 Mn3 Na2 . . 141.84(6) ?
    O4 Mn3 Na2 2 . 141.84(6) ?
    Na1 Mn3 Na2 4 . 151.214(8) ?
    Na1 Mn3 Na2 3_455 . 151.214(8) ?
    O2 Mn4 O6 . . 100.89(12) ?
    O2 Mn4 O3 . . 110.21(12) ?
    O6 Mn4 O3 . . 85.92(11) ?
    O2 Mn4 O1 . . 161.56(10) ?
    O6 Mn4 O1 . . 95.04(10) ?
    O3 Mn4 O1 . . 79.95(10) ?
    O2 Mn4 O5 . 7_566 87.01(12) ?
    O6 Mn4 O5 . 7_566 99.19(11) ?
    O3 Mn4 O5 . 7_566 160.92(11) ?
    O1 Mn4 O5 . 7_566 81.29(10) ?
    O2 Mn4 O5 . . 81.77(11) ?
    O6 Mn4 O5 . . 176.65(11) ?
    O3 Mn4 O5 . . 91.26(10) ?
    O1 Mn4 O5 . . 82.68(10) ?
    O5 Mn4 O5 7_566 . 82.92(11) ?
    O2 Mn4 Mn4 . 7_566 82.43(8) ?
    O6 Mn4 Mn4 . 7_566 141.85(9) ?
    O3 Mn4 Mn4 . 7_566 129.02(8) ?
    O1 Mn4 Mn4 . 7_566 79.30(7) ?
    O5 Mn4 Mn4 7_566 7_566 42.73(8) ?
    O5 Mn4 Mn4 . 7_566 40.19(7) ?
    O2 Mn4 Na2 . 7_556 132.26(10) ?
    O6 Mn4 Na2 . 7_556 47.05(8) ?
    O3 Mn4 Na2 . 7_556 102.32(8) ?
    O1 Mn4 Na2 . 7_556 55.81(8) ?
    O5 Mn4 Na2 7_566 7_556 69.44(8) ?
    O5 Mn4 Na2 . 7_556 132.19(8) ?
    Mn4 Mn4 Na2 7_566 7_556 103.34(4) ?
    O2 Mn4 Na1 . 3_455 32.10(8) ?
    O6 Mn4 Na1 . 3_455 73.35(8) ?
    O3 Mn4 Na1 . 3_455 91.83(7) ?
    O1 Mn4 Na1 . 3_455 166.34(7) ?
    O5 Mn4 Na1 7_566 3_455 107.25(8) ?
    O5 Mn4 Na1 . 3_455 108.58(7) ?
    Mn4 Mn4 Na1 7_566 3_455 114.25(3) ?
    Na2 Mn4 Na1 7_556 3_455 116.40(4) ?
    O2 P1 O2 2_545 1_545 103.3(3) ?
    O2 P1 O1 2_545 7_556 107.51(15) ?
    O2 P1 O1 1_545 7_556 114.65(13) ?
    O2 P1 O1 2_545 8_455 114.65(13) ?
    O2 P1 O1 1_545 8_455 107.51(15) ?
    O1 P1 O1 7_556 8_455 109.28(19) ?
    O2 P1 Na1 2_545 3_445 70.48(14) ?
    O2 P1 Na1 1_545 3_445 43.00(12) ?
    O1 P1 Na1 7_556 3_445 151.32(9) ?
    O1 P1 Na1 8_455 3_445 96.71(9) ?
    O2 P1 Na1 2_545 4_545 43.00(12) ?
    O2 P1 Na1 1_545 4_545 70.48(14) ?
    O1 P1 Na1 7_556 4_545 96.71(9) ?
    O1 P1 Na1 8_455 4_545 151.32(9) ?
    Na1 P1 Na1 3_445 4_545 61.60(2) ?
    O2 P1 Na2 2_545 . 128.33(14) ?
    O2 P1 Na2 1_545 . 128.33(14) ?
    O1 P1 Na2 7_556 . 54.64(9) ?
    O1 P1 Na2 8_455 . 54.64(9) ?
    Na1 P1 Na2 3_445 . 149.201(12) ?
    Na1 P1 Na2 4_545 . 149.201(12) ?
    O6 P2 O4 4_545 4_545 112.03(16) ?
    O6 P2 O5 4_545 1_545 109.85(16) ?
    O4 P2 O5 4_545 1_545 108.32(15) ?
    O6 P2 O3 4_545 7 106.95(15) ?
    O4 P2 O3 4_545 7 110.91(16) ?
    O5 P2 O3 1_545 7 108.74(15) ?
    O6 P2 Na2 4_545 5 43.25(11) ?
    O4 P2 Na2 4_545 5 128.12(12) ?
    O5 P2 Na2 1_545 5 122.51(11) ?
    O3 P2 Na2 7 5 63.70(11) ?
    O6 P2 Na1 4_545 2_655 89.83(11) ?
    O4 P2 Na1 4_545 2_655 36.44(10) ?
    O5 P2 Na1 1_545 2_655 90.79(10) ?
    O3 P2 Na1 7 2_655 147.20(12) ?
    Na2 P2 Na1 5 2_655 127.26(5) ?
    O6 P2 Na2 4_545 . 45.20(13) ?
    O4 P2 Na2 4_545 . 145.73(11) ?
    O5 P2 Na2 1_545 . 69.60(11) ?
    O3 P2 Na2 7 . 101.55(12) ?
    Na2 P2 Na2 5 . 58.26(2) ?
    Na1 P2 Na2 2_655 . 110.03(3) ?
    P1 O1 Mn4 7_556 . 127.78(14) ?
    P1 O1 Mn3 7_556 3 116.07(14) ?
    Mn4 O1 Mn3 . 3 101.62(9) ?
    P1 O1 Na2 7_556 7_556 97.93(11) ?
    Mn4 O1 Na2 . 7_556 85.07(9) ?
    Mn3 O1 Na2 3 7_556 127.35(10) ?
    P1 O2 Mn4 1_565 . 129.57(18) ?
    P1 O2 Na1 1_565 3_455 109.71(17) ?
    Mn4 O2 Na1 . 3_455 120.55(13) ?
    P1 O2 Mn1 1_565 3_455 109.71(17) ?
    Mn4 O2 Mn1 . 3_455 120.55(13) ?
    Na1 O2 Mn1 3_455 3_455 0.0 ?
    P1 O2 Na1 1_565 4 80.79(15) ?
    Mn4 O2 Na1 . 4 115.74(13) ?
    Na1 O2 Na1 3_455 4 73.72(10) ?
    Mn1 O2 Na1 3_455 4 73.72(10) ?
    P2 O3 Mn4 7 . 122.26(16) ?
    P2 O3 Mn3 7 3 135.09(17) ?
    Mn4 O3 Mn3 . 3 102.65(10) ?
    P2 O3 Na2 7 3 88.38(12) ?
    Mn4 O3 Na2 . 3 95.83(9) ?
    Mn3 O3 Na2 3 3 86.56(10) ?
    P2 O4 Mn3 4 . 121.45(14) ?
    P2 O4 Na1 4 3_455 120.11(15) ?
    Mn3 O4 Na1 . 3_455 94.72(9) ?
    P2 O4 Mn1 4 3_455 120.11(15) ?
    Mn3 O4 Mn1 . 3_455 94.72(9) ?
    Na1 O4 Mn1 3_455 3_455 0.0 ?
    P2 O4 Na1 4 4 137.34(16) ?
    Mn3 O4 Na1 . 4 87.88(9) ?
    Na1 O4 Na1 3_455 4 83.23(8) ?
    Mn1 O4 Na1 3_455 4 83.23(8) ?
    P2 O5 Al4 1_565 7_566 139.22(18) ?
    P2 O5 Mn4 1_565 7_566 139.22(18) ?
    Al4 O5 Mn4 7_566 7_566 0.00(3) ?
    P2 O5 Mn4 1_565 . 121.51(16) ?
    Al4 O5 Mn4 7_566 . 97.08(11) ?
    Mn4 O5 Mn4 7_566 . 97.08(11) ?
    P2 O6 Mn4 4 . 135.07(18) ?
    P2 O6 Na2 4 7_556 110.99(15) ?
    Mn4 O6 Na2 . 7_556 95.44(12) ?
    P2 O6 Na2 4 3 109.82(17) ?
    Mn4 O6 Na2 . 3 109.46(12) ?
    Na2 O6 Na2 7_556 3 81.68(9) ?
