#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/87/2228707.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2228707
loop_
_publ_author_name
'Assani, Abderrazzak'
'Saadi, Mohamed'
'Zriouil, Mohammed'
'El Ammari, Lahcen'
_publ_section_title
;
 Silver trimagnesium phosphate bis(hydrogenphosphate),
 AgMg₃(PO₄)(HPO₄)₂, with an alluaudite-like structure
;
_journal_coeditor_code           FJ2371
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i5
_journal_paper_doi               10.1107/S1600536810053304
_journal_volume                  67
_journal_year                    2011
_chemical_formula_iupac          'Ag Mg3 (P O4) (H P O4)2'
_chemical_formula_moiety         'Ag H2 Mg3 O12 P3'
_chemical_formula_sum            'Ag H2 Mg3 O12 P3'
_chemical_formula_weight         467.73
_chemical_name_systematic
;
Silver trimagnesium phosphate bis(hydrogenphosphate)
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 113.812(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.9126(5)
_cell_length_b                   12.1197(6)
_cell_length_c                   6.4780(3)
_cell_measurement_reflns_used    2330
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      38.01
_cell_measurement_theta_min      2.51
_cell_volume                     855.66(7)
_computing_cell_refinement       'SAINT (Bruker, 2005)'
_computing_data_collection       'APEX2 (Bruker, 2005)'
_computing_data_reduction        'SAINT (Bruker, 2005)'
_computing_molecular_graphics
'ORTEP-3 for Windows (Farrugia, 1997) and DIAMOND (Brandenburg, 2006)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker X8 APEX'
_diffrn_measurement_method       'φ and ω'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_av_sigmaI/netI    0.0298
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            10680
_diffrn_reflns_theta_full        38.01
_diffrn_reflns_theta_max         38.01
_diffrn_reflns_theta_min         2.51
_exptl_absorpt_coefficient_mu    3.214
_exptl_absorpt_correction_T_max  0.680
_exptl_absorpt_correction_T_min  0.545
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2005)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    3.631
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             904
_exptl_crystal_size_max          0.31
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.631
_refine_diff_density_min         -1.275
_refine_ls_extinction_coef       0.0013(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL97 (Sheldrick, 2008)'
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     91
_refine_ls_number_reflns         2330
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.080
_refine_ls_R_factor_all          0.0336
_refine_ls_R_factor_gt           0.0264
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0323P)²+1.8049P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0716
_refine_ls_wR_factor_ref         0.0749
_reflns_number_gt                1998
_reflns_number_total             2330
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            fj2371.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               2228707
_cod_database_fobs_code          2228707
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'
loop_
_atom_site_type_symbol
_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
Ag Ag1A 0.5000 0.0261(4) 0.7500 0.0192(3) Uani d SP 0.89(3) . .
Ag Ag1B 0.5000 0.0047(18) 0.7500 0.0192(3) Uani d SP 0.11(3) . .
Mg Mg1 0.5000 0.27737(7) 0.2500 0.00765(14) Uani d S 1 . .
Mg Mg2 0.28999(6) 0.16182(5) 0.37691(10) 0.00621(10) Uani d . 1 . .
P P1 0.0000 0.18606(5) 0.2500 0.00545(10) Uani d S 1 . .
P P2 0.22298(4) 0.38713(3) 0.11567(7) 0.00508(8) Uani d . 1 . .
O O1 0.10721(11) 0.10964(10) 0.2643(2) 0.00793(19) Uani d . 1 . .
O O2 0.03617(10) 0.25753(10) 0.46302(18) 0.00686(19) Uani d . 1 . .
O O3 0.15657(11) 0.32826(10) -0.11097(19) 0.00676(19) Uani d . 1 . .
O O4 0.21721(11) 0.31920(10) 0.30907(18) 0.00623(18) Uani d . 1 . .
O O5 0.16491(11) 0.50095(10) 0.1050(2) 0.00777(19) Uani d . 1 . .
O O6 0.36178(11) 0.40491(10) 0.1603(2) 0.00812(19) Uani d . 1 . .
H H6 0.3747 0.4749 0.1705 0.012 Uiso d R 1 . .
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'
Mg Mg 0.0486 0.0363 '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'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O5 Ag1A O5 4_545 3_546 165.2(2) ?
O5 Ag1A O5 4_545 8_556 95.01(5) ?
O5 Ag1A O5 3_546 8_556 83.06(5) ?
O5 Ag1A O5 4_545 7_556 83.06(5) ?
O5 Ag1A O5 3_546 7_556 95.01(5) ?
O5 Ag1A O5 8_556 7_556 165.0(2) ?
O5 Ag1A Mg2 4_545 . 39.70(5) ?
O5 Ag1A Mg2 3_546 . 154.68(19) ?
O5 Ag1A Mg2 8_556 . 106.22(6) ?
O5 Ag1A Mg2 7_556 . 81.75(5) ?
O5 Ag1A Mg2 4_545 2_656 154.68(19) ?
O5 Ag1A Mg2 3_546 2_656 39.70(5) ?
O5 Ag1A Mg2 8_556 2_656 81.75(5) ?
O5 Ag1A Mg2 7_556 2_656 106.22(6) ?
Mg2 Ag1A Mg2 . 2_656 117.04(15) ?
O5 Ag1A Ag1B 4_545 5_656 49.64(5) ?
O5 Ag1A Ag1B 3_546 5_656 128.18(15) ?
O5 Ag1A Ag1B 8_556 5_656 45.70(5) ?
O5 Ag1A Ag1B 7_556 5_656 131.97(16) ?
Mg2 Ag1A Ag1B . 5_656 67.4(3) ?
Mg2 Ag1A Ag1B 2_656 5_656 120.2(3) ?
O5 Ag1A Ag1B 4_545 5_657 128.18(15) ?
O5 Ag1A Ag1B 3_546 5_657 49.64(5) ?
O5 Ag1A Ag1B 8_556 5_657 131.97(16) ?
O5 Ag1A Ag1B 7_556 5_657 45.70(5) ?
Mg2 Ag1A Ag1B . 5_657 120.2(3) ?
Mg2 Ag1A Ag1B 2_656 5_657 67.4(3) ?
Ag1B Ag1A Ag1B 5_656 5_657 166.9(9) ?
O5 Ag1A Ag1A 4_545 5_656 49.46(4) ?
O5 Ag1A Ag1A 3_546 5_656 126.91(10) ?
O5 Ag1A Ag1A 8_556 5_656 45.55(3) ?
O5 Ag1A Ag1A 7_556 5_656 130.57(10) ?
Mg2 Ag1A Ag1A . 5_656 70.23(7) ?
Mg2 Ag1A Ag1A 2_656 5_656 122.57(9) ?
Ag1B Ag1A Ag1A 5_656 5_656 4.5(3) ?
Ag1B Ag1A Ag1A 5_657 5_656 162.4(6) ?
O5 Ag1A Ag1A 4_545 5_657 126.91(10) ?
O5 Ag1A Ag1A 3_546 5_657 49.46(4) ?
O5 Ag1A Ag1A 8_556 5_657 130.57(10) ?
O5 Ag1A Ag1A 7_556 5_657 45.55(3) ?
Mg2 Ag1A Ag1A . 5_657 122.57(9) ?
Mg2 Ag1A Ag1A 2_656 5_657 70.23(7) ?
Ag1B Ag1A Ag1A 5_656 5_657 162.4(6) ?
Ag1B Ag1A Ag1A 5_657 5_657 4.5(3) ?
Ag1A Ag1A Ag1A 5_656 5_657 157.9(3) ?
O5 Ag1B O5 4_545 3_546 177.8(10) ?
O5 Ag1B O5 4_545 8_556 96.05(5) ?
O5 Ag1B O5 3_546 8_556 83.89(5) ?
O5 Ag1B O5 4_545 7_556 83.89(5) ?
O5 Ag1B O5 3_546 7_556 96.05(5) ?
O5 Ag1B O5 8_556 7_556 176.9(10) ?
O5 Ag1B Ag1B 4_545 5_656 50.02(3) ?
O5 Ag1B Ag1B 3_546 5_656 129.88(8) ?
O5 Ag1B Ag1B 8_556 5_656 46.03(3) ?
O5 Ag1B Ag1B 7_556 5_656 133.82(10) ?
O5 Ag1B Ag1B 4_545 5_657 129.88(8) ?
O5 Ag1B Ag1B 3_546 5_657 50.02(3) ?
O5 Ag1B Ag1B 8_556 5_657 133.82(10) ?
O5 Ag1B Ag1B 7_556 5_657 46.03(3) ?
Ag1B Ag1B Ag1B 5_656 5_657 176.0(15) ?
O5 Ag1B Ag1A 4_545 5_656 50.19(5) ?
O5 Ag1B Ag1A 3_546 5_656 129.49(14) ?
O5 Ag1B Ag1A 8_556 5_656 46.19(4) ?
O5 Ag1B Ag1A 7_556 5_656 133.32(16) ?
Ag1B Ag1B Ag1A 5_656 5_656 4.6(3) ?
Ag1B Ag1B Ag1A 5_657 5_656 171.4(12) ?
O5 Ag1B Ag1A 4_545 5_657 129.49(14) ?
O5 Ag1B Ag1A 3_546 5_657 50.19(5) ?
O5 Ag1B Ag1A 8_556 5_657 133.32(16) ?
O5 Ag1B Ag1A 7_556 5_657 46.19(4) ?
Ag1B Ag1B Ag1A 5_656 5_657 171.4(12) ?
Ag1B Ag1B Ag1A 5_657 5_657 4.6(3) ?
Ag1A Ag1B Ag1A 5_656 5_657 166.9(9) ?
O5 Ag1B Mg2 4_545 . 37.3(2) ?
O5 Ag1B Mg2 3_546 . 144.9(8) ?
O5 Ag1B Mg2 8_556 . 102.7(3) ?
O5 Ag1B Mg2 7_556 . 79.2(2) ?
Ag1B Ag1B Mg2 5_656 . 66.0(4) ?
Ag1B Ag1B Mg2 5_657 . 116.6(6) ?
Ag1A Ag1B Mg2 5_656 . 69.01(18) ?
Ag1A Ag1B Mg2 5_657 . 119.4(3) ?
O5 Ag1B Mg2 4_545 2_656 144.9(8) ?
O5 Ag1B Mg2 3_546 2_656 37.3(2) ?
O5 Ag1B Mg2 8_556 2_656 79.2(2) ?
O5 Ag1B Mg2 7_556 2_656 102.7(3) ?
Ag1B Ag1B Mg2 5_656 2_656 116.6(6) ?
Ag1B Ag1B Mg2 5_657 2_656 66.0(4) ?
Ag1A Ag1B Mg2 5_656 2_656 119.4(3) ?
Ag1A Ag1B Mg2 5_657 2_656 69.01(18) ?
Mg2 Ag1B Mg2 . 2_656 109.3(6) ?
O5 Ag1B Mg1 4_545 5_656 88.9(5) ?
O5 Ag1B Mg1 3_546 5_656 88.9(5) ?
O5 Ag1B Mg1 8_556 5_656 88.4(5) ?
O5 Ag1B Mg1 7_556 5_656 88.4(5) ?
Ag1B Ag1B Mg1 5_656 5_656 88.0(8) ?
Ag1B Ag1B Mg1 5_657 5_656 88.0(8) ?
Ag1A Ag1B Mg1 5_656 5_656 83.4(5) ?
Ag1A Ag1B Mg1 5_657 5_656 83.4(5) ?
Mg2 Ag1B Mg1 . 5_656 125.3(3) ?
Mg2 Ag1B Mg1 2_656 5_656 125.3(3) ?
O2 Mg1 O2 8 7_556 156.91(8) ?
O2 Mg1 O3 8 7 87.86(5) ?
O2 Mg1 O3 7_556 7 78.33(5) ?
O2 Mg1 O3 8 8_556 78.33(5) ?
O2 Mg1 O3 7_556 8_556 87.86(5) ?
O3 Mg1 O3 7 8_556 106.45(7) ?
O2 Mg1 O6 8 . 108.09(5) ?
O2 Mg1 O6 7_556 . 88.61(5) ?
O3 Mg1 O6 7 . 82.80(4) ?
O3 Mg1 O6 8_556 . 169.20(5) ?
O2 Mg1 O6 8 2_655 88.61(5) ?
O2 Mg1 O6 7_556 2_655 108.09(5) ?
O3 Mg1 O6 7 2_655 169.20(5) ?
O3 Mg1 O6 8_556 2_655 82.80(4) ?
O6 Mg1 O6 . 2_655 88.61(7) ?
O2 Mg1 Mg2 8 2_655 40.53(3) ?
O2 Mg1 Mg2 7_556 2_655 125.98(4) ?
O3 Mg1 Mg2 7 2_655 105.38(4) ?
O3 Mg1 Mg2 8_556 2_655 38.62(3) ?
O6 Mg1 Mg2 . 2_655 145.25(4) ?
O6 Mg1 Mg2 2_655 2_655 78.19(3) ?
O2 Mg1 Mg2 8 . 125.98(4) ?
O2 Mg1 Mg2 7_556 . 40.53(3) ?
O3 Mg1 Mg2 7 . 38.62(3) ?
O3 Mg1 Mg2 8_556 . 105.38(4) ?
O6 Mg1 Mg2 . . 78.19(3) ?
O6 Mg1 Mg2 2_655 . 145.25(4) ?
Mg2 Mg1 Mg2 2_655 . 128.94(3) ?
O2 Mg1 Ag1B 8 5_656 78.46(4) ?
O2 Mg1 Ag1B 7_556 5_656 78.46(4) ?
O3 Mg1 Ag1B 7 5_656 53.22(4) ?
O3 Mg1 Ag1B 8_556 5_656 53.22(4) ?
O6 Mg1 Ag1B . 5_656 135.69(4) ?
O6 Mg1 Ag1B 2_655 5_656 135.70(4) ?
Mg2 Mg1 Ag1B 2_655 5_656 64.468(17) ?
Mg2 Mg1 Ag1B . 5_656 64.467(17) ?
O5 Mg2 O3 4_545 7 86.56(5) ?
O5 Mg2 O4 4_545 . 170.04(6) ?
O3 Mg2 O4 7 . 90.74(5) ?
O5 Mg2 O4 4_545 7_556 99.52(5) ?
O3 Mg2 O4 7 7_556 162.82(6) ?
O4 Mg2 O4 . 7_556 85.79(5) ?
O5 Mg2 O1 4_545 . 86.75(5) ?
O3 Mg2 O1 7 . 110.73(5) ?
O4 Mg2 O1 . . 85.23(5) ?
O4 Mg2 O1 7_556 . 85.78(5) ?
O5 Mg2 O2 4_545 7_556 103.34(5) ?
O3 Mg2 O2 7 7_556 79.28(5) ?
O4 Mg2 O2 . 7_556 85.55(5) ?
O4 Mg2 O2 7_556 7_556 83.67(5) ?
O1 Mg2 O2 . 7_556 166.46(6) ?
O5 Mg2 Mg2 4_545 7_556 141.54(5) ?
O3 Mg2 Mg2 7 7_556 131.55(5) ?
O4 Mg2 Mg2 . 7_556 43.09(3) ?
O4 Mg2 Mg2 7_556 7_556 42.70(3) ?
O1 Mg2 Mg2 . 7_556 83.86(4) ?
O2 Mg2 Mg2 7_556 7_556 82.63(4) ?
O5 Mg2 P2 4_545 . 151.29(4) ?
O3 Mg2 P2 7 . 66.25(4) ?
O4 Mg2 P2 . . 24.50(3) ?
O4 Mg2 P2 7_556 . 109.17(4) ?
O1 Mg2 P2 . . 94.16(4) ?
O2 Mg2 P2 7_556 . 81.36(4) ?
Mg2 Mg2 P2 7_556 . 66.81(2) ?
O5 Mg2 Ag1A 4_545 . 48.62(8) ?
O3 Mg2 Ag1A 7 . 104.68(4) ?
O4 Mg2 Ag1A . . 141.24(8) ?
O4 Mg2 Ag1A 7_556 . 68.99(5) ?
O1 Mg2 Ag1A . . 120.08(7) ?
O2 Mg2 Ag1A 7_556 . 63.49(8) ?
Mg2 Mg2 Ag1A 7_556 . 106.54(6) ?
P2 Mg2 Ag1A . . 144.85(7) ?
O5 Mg2 P2 4_545 7 77.41(4) ?
O3 Mg2 P2 7 7 23.55(3) ?
O4 Mg2 P2 . 7 96.44(4) ?
O4 Mg2 P2 7_556 7 173.57(4) ?
O1 Mg2 P2 . 7 88.39(4) ?
O2 Mg2 P2 7_556 7 102.49(4) ?
Mg2 Mg2 P2 7_556 7 139.20(3) ?
P2 Mg2 P2 . 7 73.940(17) ?
Ag1A Mg2 P2 . 7 111.92(4) ?
O5 Mg2 Mg1 4_545 . 102.56(4) ?
O3 Mg2 Mg1 7 . 40.22(3) ?
O4 Mg2 Mg1 . . 81.27(4) ?
O4 Mg2 Mg1 7_556 . 122.61(4) ?
O1 Mg2 Mg1 . . 147.15(4) ?
O2 Mg2 Mg1 7_556 . 39.90(3) ?
Mg2 Mg2 Mg1 7_556 . 105.43(3) ?
P2 Mg2 Mg1 . . 62.814(18) ?
Ag1A Mg2 Mg1 . . 88.00(4) ?
P2 Mg2 Mg1 7 . 63.765(15) ?
O5 Mg2 Ag1B 4_545 . 44.9(3) ?
O3 Mg2 Ag1B 7 . 104.30(5) ?
O4 Mg2 Ag1B . . 144.9(3) ?
O4 Mg2 Ag1B 7_556 . 70.47(13) ?
O1 Mg2 Ag1B . . 117.1(2) ?
O2 Mg2 Ag1B 7_556 . 67.0(3) ?
Mg2 Mg2 Ag1B 7_556 . 109.1(2) ?
P2 Mg2 Ag1B . . 148.3(3) ?
Ag1A Mg2 Ag1B . . 3.9(2) ?
P2 Mg2 Ag1B 7 . 110.03(15) ?
Mg1 Mg2 Ag1B . . 90.03(16) ?
O2 P1 O2 . 2 111.36(10) ?
O2 P1 O1 . . 110.96(6) ?
O2 P1 O1 2 . 108.44(6) ?
O2 P1 O1 . 2 108.44(6) ?
O2 P1 O1 2 2 110.95(6) ?
O1 P1 O1 . 2 106.60(10) ?
O4 P2 O5 . . 110.74(7) ?
O4 P2 O3 . . 111.02(7) ?
O5 P2 O3 . . 109.06(7) ?
O4 P2 O6 . . 108.40(7) ?
O5 P2 O6 . . 107.86(7) ?
O3 P2 O6 . . 109.70(7) ?
O4 P2 Mg2 . . 34.24(5) ?
O5 P2 Mg2 . . 144.97(5) ?
O3 P2 Mg2 . . 91.84(5) ?
O6 P2 Mg2 . . 90.03(5) ?
O4 P2 Mg2 . 7 136.27(5) ?
O5 P2 Mg2 . 7 106.49(5) ?
O3 P2 Mg2 . 7 32.58(5) ?
O6 P2 Mg2 . 7 80.34(5) ?
Mg2 P2 Mg2 . 7 106.060(17) ?
P1 O1 Mg2 . . 123.77(7) ?
P1 O2 Mg1 . 7_556 126.47(7) ?
P1 O2 Mg2 . 7_556 123.92(7) ?
Mg1 O2 Mg2 7_556 7_556 99.56(5) ?
P2 O3 Mg2 . 7 123.87(7) ?
P2 O3 Mg1 . 7 134.97(7) ?
Mg2 O3 Mg1 7 7 101.16(5) ?
P2 O4 Mg2 . . 121.26(7) ?
P2 O4 Mg2 . 7_556 140.95(7) ?
Mg2 O4 Mg2 . 7_556 94.21(5) ?
P2 O5 Mg2 . 4 139.84(8) ?
P2 O5 Ag1B . 3_454 104.2(5) ?
Mg2 O5 Ag1B 4 3_454 97.9(5) ?
P2 O5 Ag1A . 3_454 110.03(12) ?
Mg2 O5 Ag1A 4 3_454 91.67(12) ?
Ag1B O5 Ag1A 3_454 3_454 6.3(4) ?
P2 O5 Ag1B . 7_556 111.6(5) ?
Mg2 O5 Ag1B 4 7_556 103.7(5) ?
Ag1B O5 Ag1B 3_454 7_556 83.95(5) ?
Ag1A O5 Ag1B 3_454 7_556 84.17(8) ?
P2 O5 Ag1A . 7_556 105.79(12) ?
Mg2 O5 Ag1A 4 7_556 109.53(12) ?
Ag1B O5 Ag1A 3_454 7_556 84.12(8) ?
Ag1A O5 Ag1A 3_454 7_556 84.99(5) ?
Ag1B O5 Ag1A 7_556 7_556 5.9(4) ?
P2 O6 Mg1 . . 125.56(7) ?
P2 O6 H6 . . 106.9 ?
Mg1 O6 H6 . . 126.3 ?
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
Ag1A O5 4_545 2.3649(14) ?
Ag1A O5 3_546 2.3649(14) ?
Ag1A O5 8_556 2.5177(14) ?
Ag1A O5 7_556 2.5177(14) ?
Ag1A Mg2 . 3.150(3) ?
Ag1A Mg2 2_656 3.150(3) ?
Ag1A Ag1B 5_656 3.260(3) ?
Ag1A Ag1B 5_657 3.260(3) ?
Ag1A Ag1A 5_656 3.3001(19) ?
Ag1A Ag1A 5_657 3.3001(19) ?
Ag1B O5 4_545 2.3457(13) ?
Ag1B O5 3_546 2.3457(13) ?
Ag1B O5 8_556 2.4972(14) ?
Ag1B O5 7_556 2.4972(14) ?
Ag1B Ag1B 5_656 3.2410(15) ?
Ag1B Ag1B 5_657 3.2410(15) ?
Ag1B Ag1A 5_656 3.260(3) ?
Ag1B Ag1A 5_657 3.260(3) ?
Ag1B Mg2 . 3.293(12) ?
Ag1B Mg2 2_656 3.293(12) ?
Ag1B Mg1 5_656 3.42(2) ?
Mg1 O2 8 2.1136(12) ?
Mg1 O2 7_556 2.1136(12) ?
Mg1 O3 7 2.1383(13) ?
Mg1 O3 8_556 2.1383(13) ?
Mg1 O6 . 2.1600(14) ?
Mg1 O6 2_655 2.1601(14) ?
Mg1 Mg2 2_655 3.2491(7) ?
Mg1 Mg2 . 3.2492(7) ?
Mg1 Ag1B 5_656 3.42(2) ?
Mg2 O5 4_545 2.0132(13) ?
Mg2 O3 7 2.0672(13) ?
Mg2 O4 . 2.0677(13) ?
Mg2 O4 7_556 2.0831(13) ?
Mg2 O1 . 2.0954(13) ?
Mg2 O2 7_556 2.1414(13) ?
Mg2 Mg2 7_556 3.0408(12) ?
Mg2 P2 . 3.1411(7) ?
Mg2 P2 7 3.1874(7) ?
P1 O2 . 1.5363(12) ?
P1 O2 2 1.5363(12) ?
P1 O1 . 1.5497(12) ?
P1 O1 2 1.5497(12) ?
P2 O4 . 1.5237(12) ?
P2 O5 . 1.5322(13) ?
P2 O3 . 1.5337(12) ?
P2 O6 . 1.5742(13) ?
P2 Mg2 7 3.1874(7) ?
O2 Mg1 7_556 2.1136(12) ?
O2 Mg2 7_556 2.1414(13) ?
O3 Mg2 7 2.0672(13) ?
O3 Mg1 7 2.1384(13) ?
O4 Mg2 7_556 2.0831(13) ?
O5 Mg2 4 2.0133(13) ?
O5 Ag1B 3_454 2.3457(13) ?
O5 Ag1A 3_454 2.3649(14) ?
O5 Ag1B 7_556 2.4972(14) ?
O5 Ag1A 7_556 2.5177(14) ?
O6 H6 . 0.8600 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
O6 H6 O1 4_555 0.86 1.68 2.5266(17) 168 y
