#------------------------------------------------------------------------------
#$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/36/4343621.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_4343621
loop_
_publ_author_name
'Sanjeewa, Liurukara D.'
'McGuire, Michael A.'
'Garlea, Vasile O.'
'Hu, Longyu'
'Chumanov, George'
'McMillen, Colin D.'
'Kolis, Joseph W.'
_publ_section_title
;
 Hydrothermal Synthesis and Characterization of Novel Brackebuschite-Type
 Transition Metal Vanadates: Ba2M(VO4)2(OH), M = V(3+), Mn(3+), and
 Fe(3+), with Interesting Jahn-Teller and Spin-Liquid Behavior.
;
_journal_issue                   14
_journal_name_full               'Inorganic chemistry'
_journal_page_first              7014
_journal_page_last               7020
_journal_paper_doi               10.1021/acs.inorgchem.5b01037
_journal_volume                  54
_journal_year                    2015
_chemical_formula_sum            'H O9 Sr2 V3'
_chemical_formula_weight         473.07
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_atom_sites_solution_hydrogens   difmap
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 112.15(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   7.6249(15)
_cell_length_b                   6.0903(12)
_cell_length_c                   8.8153(18)
_cell_measurement_reflns_used    3196
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.04
_cell_measurement_theta_min      2.49
_cell_volume                     379.15(15)
_computing_cell_refinement       'CrystalClear (Rigaku/MSC, 2006)'
_computing_data_collection       'CrystalClear (Rigaku/MSC, 2006)'
_computing_data_reduction        'CrystalClear (Rigaku/MSC, 2006)'
_computing_molecular_graphics    'DIAMOND (Bradenburg, 1999)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 14.6199
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Rigaku AFC8S'
_diffrn_measurement_method       'ω scans'
_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  0.0320
_diffrn_reflns_av_sigmaI/netI    0.0205
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            3196
_diffrn_reflns_theta_full        25.04
_diffrn_reflns_theta_max         25.04
_diffrn_reflns_theta_min         2.49
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    17.561
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.4959
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB,RIGAKU/MSC,The Woodlands,TX,USA,1999.'
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    4.144
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             436
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.853
_refine_diff_density_min         -1.061
_refine_diff_density_rms         0.282
_refine_ls_extinction_coef       0.025(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.070
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     82
_refine_ls_number_reflns         736
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.070
_refine_ls_R_factor_all          0.0281
_refine_ls_R_factor_gt           0.0271
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0434P)²+1.8833P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0704
_refine_ls_wR_factor_ref         0.0752
_reflns_number_gt                707
_reflns_number_total             736
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic5b01037_si_001.cif
_cod_data_source_block           HO9Ba2V3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3271 2015-04-21 07:52:19Z andrius 

 Adding full bibliography for 4343620--4343623.cif.
;
_cod_original_cell_volume        379.16(13)
_cod_original_sg_symbol_H-M      P2(1)/m
_cod_database_code               4343621
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, 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
Sr1 Sr 0.67795(8) 0.2500 0.59463(7) 0.0146(2) Uani 1 2 d S
Sr2 Sr 0.26245(8) 0.2500 0.75366(7) 0.0151(2) Uani 1 2 d S
V V 1.0000 0.0000 1.0000 0.0090(3) Uani 1 2 d S
V1 V 0.96133(13) -0.2500 0.66062(12) 0.0092(3) Uani 1 2 d S
V2 V 0.44363(14) 0.2500 0.17890(12) 0.0094(3) Uani 1 2 d S
O1 O 1.0117(4) -0.0084(5) 0.7792(4) 0.0149(7) Uani 1 1 d .
O2 O 0.5102(4) 0.0258(5) 0.3006(4) 0.0167(7) Uani 1 1 d .
O3 O 0.1940(6) 0.2500 0.0577(5) 0.0126(9) Uani 1 2 d S
O4 O 0.7318(6) -0.2500 0.5450(6) 0.0210(10) Uani 1 2 d S
O5 O 0.8175(6) 0.2500 0.9197(5) 0.0097(9) Uani 1 2 d SD
H5 H 0.732(8) 0.2500 0.965(9) 0.020 Uiso 1 2 d SD
O6 O 1.0759(6) -0.2500 0.5333(6) 0.0192(10) Uani 1 2 d S
O7 O 0.5473(6) 0.2500 0.0426(6) 0.0257(12) Uani 1 2 d S
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'
V V 0.3005 0.5294 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sr Sr -1.5307 3.2498 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O6 Sr1 O2 139.63(7) 3_756 3_656
O6 Sr1 O2 139.63(7) 3_756 2_656
O2 Sr1 O2 80.70(14) 3_656 2_656
O6 Sr1 O5 114.76(14) 3_756 .
O2 Sr1 O5 70.49(10) 3_656 .
O2 Sr1 O5 70.49(10) 2_656 .
O6 Sr1 O2 75.05(11) 3_756 .
O2 Sr1 O2 83.80(10) 3_656 .
O2 Sr1 O2 121.89(6) 2_656 .
O5 Sr1 O2 149.70(7) . .
O6 Sr1 O2 75.05(11) 3_756 4_565
O2 Sr1 O2 121.89(6) 3_656 4_565
O2 Sr1 O2 83.80(10) 2_656 4_565
O5 Sr1 O2 149.70(7) . 4_565
O2 Sr1 O2 58.87(13) . 4_565
O6 Sr1 O4 132.40(14) 3_756 3_656
O2 Sr1 O4 59.89(10) 3_656 3_656
O2 Sr1 O4 59.89(10) 2_656 3_656
O5 Sr1 O4 112.84(13) . 3_656
O2 Sr1 O4 63.87(11) . 3_656
O2 Sr1 O4 63.87(11) 4_565 3_656
O6 Sr1 O1 67.03(11) 3_756 4_565
O2 Sr1 O1 129.43(9) 3_656 4_565
O2 Sr1 O1 86.29(10) 2_656 4_565
O5 Sr1 O1 59.11(9) . 4_565
O2 Sr1 O1 141.71(9) . 4_565
O2 Sr1 O1 104.70(9) 4_565 4_565
O4 Sr1 O1 144.45(7) 3_656 4_565
O6 Sr1 O1 67.03(11) 3_756 .
O2 Sr1 O1 86.29(10) 3_656 .
O2 Sr1 O1 129.43(9) 2_656 .
O5 Sr1 O1 59.11(9) . .
O2 Sr1 O1 104.70(9) . .
O2 Sr1 O1 141.71(9) 4_565 .
O4 Sr1 O1 144.45(7) 3_656 .
O1 Sr1 O1 65.43(13) 4_565 .
O6 Sr1 O4 77.22(8) 3_756 1_565
O2 Sr1 O4 143.14(11) 3_656 1_565
O2 Sr1 O4 62.51(11) 2_656 1_565
O5 Sr1 O4 97.51(9) . 1_565
O2 Sr1 O4 112.76(11) . 1_565
O2 Sr1 O4 55.20(11) 4_565 1_565
O4 Sr1 O4 96.79(8) 3_656 1_565
O1 Sr1 O4 54.43(10) 4_565 1_565
O1 Sr1 O4 118.13(10) . 1_565
O6 Sr1 O4 77.22(8) 3_756 .
O2 Sr1 O4 62.51(11) 3_656 .
O2 Sr1 O4 143.14(11) 2_656 .
O5 Sr1 O4 97.51(9) . .
O2 Sr1 O4 55.20(11) . .
O2 Sr1 O4 112.76(11) 4_565 .
O4 Sr1 O4 96.79(8) 3_656 .
O1 Sr1 O4 118.13(10) 4_565 .
O1 Sr1 O4 54.43(10) . .
O4 Sr1 O4 153.97(17) 1_565 .
O6 Sr1 V2 72.40(11) 3_756 .
O2 Sr1 V2 104.23(8) 3_656 .
O2 Sr1 V2 104.23(8) 2_656 .
O5 Sr1 V2 172.84(10) . .
O2 Sr1 V2 29.44(7) . .
O2 Sr1 V2 29.44(7) 4_565 .
O4 Sr1 V2 59.99(10) 3_656 .
O1 Sr1 V2 126.33(7) 4_565 .
O1 Sr1 V2 126.33(7) . .
O4 Sr1 V2 83.87(9) 1_565 .
O4 Sr1 V2 83.87(9) . .
O1 Sr2 O1 76.18(14) 1_455 4_465
O1 Sr2 O2 174.00(9) 1_455 2_656
O1 Sr2 O2 101.11(11) 4_465 2_656
O1 Sr2 O2 101.11(11) 1_455 3_656
O1 Sr2 O2 174.00(9) 4_465 3_656
O2 Sr2 O2 81.07(14) 2_656 3_656
O1 Sr2 O4 112.41(10) 1_455 3_656
O1 Sr2 O4 112.41(10) 4_465 3_656
O2 Sr2 O4 63.43(10) 2_656 3_656
O2 Sr2 O4 63.43(10) 3_656 3_656
O1 Sr2 O7 106.56(11) 1_455 1_556
O1 Sr2 O7 106.56(11) 4_465 1_556
O2 Sr2 O7 79.29(10) 2_656 1_556
O2 Sr2 O7 79.29(10) 3_656 1_556
O4 Sr2 O7 129.79(14) 3_656 1_556
O1 Sr2 O6 67.72(10) 1_455 3_656
O1 Sr2 O6 67.72(10) 4_465 3_656
O2 Sr2 O6 106.34(10) 2_656 3_656
O2 Sr2 O6 106.34(10) 3_656 3_656
O4 Sr2 O6 57.78(13) 3_656 3_656
O7 Sr2 O6 172.43(13) 1_556 3_656
O1 Sr2 O3 61.27(9) 1_455 1_556
O1 Sr2 O3 61.27(9) 4_465 1_556
O2 Sr2 O3 122.33(9) 2_656 1_556
O2 Sr2 O3 122.33(9) 3_656 1_556
O4 Sr2 O3 171.33(12) 3_656 1_556
O7 Sr2 O3 58.87(13) 1_556 1_556
O6 Sr2 O3 113.55(13) 3_656 1_556
O1 Sr2 V1 90.31(7) 1_455 3_656
O1 Sr2 V1 90.31(7) 4_465 3_656
O2 Sr2 V1 84.33(7) 2_656 3_656
O2 Sr2 V1 84.33(7) 3_656 3_656
O4 Sr2 V1 28.58(9) 3_656 3_656
O7 Sr2 V1 158.38(10) 1_556 3_656
O6 Sr2 V1 29.20(9) 3_656 3_656
O3 Sr2 V1 142.75(9) 1_556 3_656
O1 Sr2 V2 84.90(7) 1_455 1_556
O1 Sr2 V2 84.90(7) 4_465 1_556
O2 Sr2 V2 100.27(8) 2_656 1_556
O2 Sr2 V2 100.27(8) 3_656 1_556
O4 Sr2 V2 157.51(10) 3_656 1_556
O7 Sr2 V2 27.71(10) 1_556 1_556
O6 Sr2 V2 144.72(9) 3_656 1_556
O3 Sr2 V2 31.16(9) 1_556 1_556
V1 Sr2 V2 173.91(3) 3_656 1_556
O1 Sr2 V2 157.49(7) 1_455 3_666
O1 Sr2 V2 84.65(7) 4_465 3_666
O2 Sr2 V2 23.86(7) 2_656 3_666
O2 Sr2 V2 99.04(7) 3_656 3_666
O4 Sr2 V2 85.62(6) 3_656 3_666
O7 Sr2 V2 67.54(5) 1_556 3_666
O6 Sr2 V2 115.71(4) 3_656 3_666
O3 Sr2 V2 99.20(5) 1_556 3_666
V1 Sr2 V2 101.61(3) 3_656 3_666
V2 Sr2 V2 81.72(3) 1_556 3_666
O1 Sr2 V2 84.65(7) 1_455 3_656
O1 Sr2 V2 157.49(7) 4_465 3_656
O2 Sr2 V2 99.04(7) 2_656 3_656
O2 Sr2 V2 23.86(7) 3_656 3_656
O4 Sr2 V2 85.62(6) 3_656 3_656
O7 Sr2 V2 67.54(5) 1_556 3_656
O6 Sr2 V2 115.71(4) 3_656 3_656
O3 Sr2 V2 99.20(5) 1_556 3_656
V1 Sr2 V2 101.61(3) 3_656 3_656
V2 Sr2 V2 81.72(3) 1_556 3_656
V2 Sr2 V2 111.05(3) 3_666 3_656
O1 V O1 180.000(1) 3_757 .
O1 V O5 87.43(15) 3_757 3_757
O1 V O5 92.57(15) . 3_757
O1 V O5 92.57(15) 3_757 .
O1 V O5 87.43(15) . .
O5 V O5 180.000(1) 3_757 .
O1 V O3 88.12(15) 3_757 3_656
O1 V O3 91.88(15) . 3_656
O5 V O3 82.15(13) 3_757 3_656
O5 V O3 97.85(13) . 3_656
O1 V O3 91.88(15) 3_757 1_656
O1 V O3 88.12(15) . 1_656
O5 V O3 97.85(13) 3_757 1_656
O5 V O3 82.15(13) . 1_656
O3 V O3 180.0 3_656 1_656
O1 V V 88.52(9) 3_757 2_757
O1 V V 91.48(9) . 2_757
O5 V V 139.46(9) 3_757 2_757
O5 V V 40.54(9) . 2_757
O3 V V 138.00(9) 3_656 2_757
O3 V V 42.00(9) 1_656 2_757
O1 V V 91.48(9) 3_757 2_747
O1 V V 88.52(9) . 2_747
O5 V V 40.54(9) 3_757 2_747
O5 V V 139.46(9) . 2_747
O3 V V 42.00(9) 3_656 2_747
O3 V V 138.00(9) 1_656 2_747
V V V 180.0 2_757 2_747
O1 V Sr2 141.48(9) 3_757 1_655
O1 V Sr2 38.52(9) . 1_655
O5 V Sr2 93.51(11) 3_757 1_655
O5 V Sr2 86.49(11) . 1_655
O3 V Sr2 130.19(12) 3_656 1_655
O3 V Sr2 49.81(12) 1_656 1_655
V V Sr2 66.270(7) 2_757 1_655
V V Sr2 113.730(7) 2_747 1_655
O1 V Sr2 38.52(9) 3_757 3_657
O1 V Sr2 141.48(9) . 3_657
O5 V Sr2 86.49(11) 3_757 3_657
O5 V Sr2 93.51(11) . 3_657
O3 V Sr2 49.81(12) 3_656 3_657
O3 V Sr2 130.19(12) 1_656 3_657
V V Sr2 113.730(7) 2_757 3_657
V V Sr2 66.270(7) 2_747 3_657
Sr2 V Sr2 180.0 1_655 3_657
O1 V Sr1 48.75(9) 3_757 3_757
O1 V Sr1 131.25(9) . 3_757
O5 V Sr1 41.26(12) 3_757 3_757
O5 V Sr1 138.74(12) . 3_757
O3 V Sr1 94.91(11) 3_656 3_757
O3 V Sr1 85.09(11) 1_656 3_757
V V Sr1 113.567(10) 2_757 3_757
V V Sr1 66.433(10) 2_747 3_757
Sr2 V Sr1 113.95(2) 1_655 3_757
Sr2 V Sr1 66.05(2) 3_657 3_757
O1 V Sr1 131.25(9) 3_757 .
O1 V Sr1 48.75(9) . .
O5 V Sr1 138.74(12) 3_757 .
O5 V Sr1 41.26(12) . .
O3 V Sr1 85.09(11) 3_656 .
O3 V Sr1 94.91(11) 1_656 .
V V Sr1 66.433(10) 2_757 .
V V Sr1 113.567(10) 2_747 .
Sr2 V Sr1 66.05(2) 1_655 .
Sr2 V Sr1 113.95(2) 3_657 .
Sr1 V Sr1 180.0 3_757 .
O4 V1 O6 106.6(2) . .
O4 V1 O1 107.92(13) . .
O6 V1 O1 110.38(13) . .
O4 V1 O1 107.92(14) . 4
O6 V1 O1 110.38(13) . 4
O1 V1 O1 113.3(2) . 4
O4 V1 Sr2 49.79(17) . 3_656
O6 V1 Sr2 56.84(16) . 3_656
O1 V1 Sr2 123.12(11) . 3_656
O1 V1 Sr2 123.12(11) 4 3_656
O4 V1 Sr1 58.58(4) . 1_545
O6 V1 Sr1 108.81(8) . 1_545
O1 V1 Sr1 140.79(11) . 1_545
O1 V1 Sr1 51.78(11) 4 1_545
Sr2 V1 Sr1 78.55(3) 3_656 1_545
O4 V1 Sr1 58.58(4) . .
O6 V1 Sr1 108.81(8) . .
O1 V1 Sr1 51.78(11) . .
O1 V1 Sr1 140.79(11) 4 .
Sr2 V1 Sr1 78.55(3) 3_656 .
Sr1 V1 Sr1 113.02(3) 1_545 .
O4 V1 Sr2 123.80(3) . 1_655
O6 V1 Sr2 73.18(9) . 1_655
O1 V1 Sr2 37.42(10) . 1_655
O1 V1 Sr2 125.14(11) 4 1_655
Sr2 V1 Sr2 104.80(3) 3_656 1_655
Sr1 V1 Sr2 176.63(3) 1_545 1_655
Sr1 V1 Sr2 68.34(2) . 1_655
O4 V1 Sr2 123.80(3) . 1_645
O6 V1 Sr2 73.18(9) . 1_645
O1 V1 Sr2 125.14(11) . 1_645
O1 V1 Sr2 37.42(10) 4 1_645
Sr2 V1 Sr2 104.80(3) 3_656 1_645
Sr1 V1 Sr2 68.34(2) 1_545 1_645
Sr1 V1 Sr2 176.63(3) . 1_645
Sr2 V1 Sr2 110.13(3) 1_655 1_645
O7 V2 O2 110.27(14) . 4_565
O7 V2 O2 110.27(14) . .
O2 V2 O2 107.6(2) 4_565 .
O7 V2 O3 104.7(2) . .
O2 V2 O3 111.99(13) 4_565 .
O2 V2 O3 111.99(13) . .
O7 V2 Sr1 125.03(17) . .
O2 V2 Sr1 53.81(11) 4_565 .
O2 V2 Sr1 53.81(11) . .
O3 V2 Sr1 130.22(15) . .
O7 V2 Sr2 47.64(16) . 1_554
O2 V2 Sr2 125.93(11) 4_565 1_554
O2 V2 Sr2 125.93(11) . 1_554
O3 V2 Sr2 57.11(14) . 1_554
Sr1 V2 Sr2 172.67(4) . 1_554
O7 V2 Sr2 72.10(8) . 3_666
O2 V2 Sr2 38.18(11) 4_565 3_666
O2 V2 Sr2 122.98(12) . 3_666
O3 V2 Sr2 122.54(3) . 3_666
Sr1 V2 Sr2 77.72(3) . 3_666
Sr2 V2 Sr2 98.28(3) 1_554 3_666
O7 V2 Sr2 72.10(8) . 3_656
O2 V2 Sr2 122.98(12) 4_565 3_656
O2 V2 Sr2 38.18(11) . 3_656
O3 V2 Sr2 122.54(3) . 3_656
Sr1 V2 Sr2 77.72(3) . 3_656
Sr2 V2 Sr2 98.28(3) 1_554 3_656
Sr2 V2 Sr2 111.05(3) 3_666 3_656
O7 V2 Sr1 129.11(2) . 3_666
O2 V2 Sr1 29.11(10) 4_565 3_666
O2 V2 Sr1 111.97(12) . 3_666
O3 V2 Sr1 84.41(9) . 3_666
Sr1 V2 Sr1 65.44(2) . 3_666
Sr2 V2 Sr1 118.25(2) 1_554 3_666
Sr2 V2 Sr1 61.674(18) 3_666 3_666
Sr2 V2 Sr1 143.15(3) 3_656 3_666
O7 V2 Sr1 129.11(2) . 3_656
O2 V2 Sr1 111.97(12) 4_565 3_656
O2 V2 Sr1 29.11(10) . 3_656
O3 V2 Sr1 84.41(9) . 3_656
Sr1 V2 Sr1 65.44(2) . 3_656
Sr2 V2 Sr1 118.25(2) 1_554 3_656
Sr2 V2 Sr1 143.15(3) 3_666 3_656
Sr2 V2 Sr1 61.674(18) 3_656 3_656
Sr1 V2 Sr1 101.27(3) 3_666 3_656
V1 O1 V 121.58(17) . .
V1 O1 Sr2 117.78(14) . 1_655
V O1 Sr2 112.54(13) . 1_655
V1 O1 Sr1 99.84(13) . .
V O1 Sr1 100.45(12) . .
Sr2 O1 Sr1 98.26(10) 1_655 .
V2 O2 Sr2 117.96(15) . 3_656
V2 O2 Sr1 132.40(16) . 3_656
Sr2 O2 Sr1 98.30(11) 3_656 3_656
V2 O2 Sr1 96.76(14) . .
Sr2 O2 Sr1 112.77(11) 3_656 .
Sr1 O2 Sr1 96.20(10) 3_656 .
V2 O3 V 130.63(10) . 1_454
V2 O3 V 130.63(10) . 2_656
V O3 V 95.99(18) 1_454 2_656
V2 O3 Sr2 91.73(17) . 1_554
V O3 Sr2 97.73(14) 1_454 1_554
V O3 Sr2 97.73(14) 2_656 1_554
V1 O4 Sr2 101.6(2) . 3_656
V1 O4 Sr1 168.6(3) . 3_656
Sr2 O4 Sr1 89.81(14) 3_656 3_656
V1 O4 Sr1 94.47(9) . .
Sr2 O4 Sr1 101.03(9) 3_656 .
Sr1 O4 Sr1 83.21(8) 3_656 .
V1 O4 Sr1 94.47(9) . 1_545
Sr2 O4 Sr1 101.03(9) 3_656 1_545
Sr1 O4 Sr1 83.21(8) 3_656 1_545
Sr1 O4 Sr1 153.97(17) . 1_545
V O5 V 98.92(19) 2_757 .
V O5 Sr1 108.89(14) 2_757 .
V O5 Sr1 108.89(14) . .
V O5 H5 112(3) 2_757 .
V O5 H5 112(3) . .
Sr1 O5 H5 115(5) . .
V1 O6 Sr1 165.7(3) . 3_756
V1 O6 Sr2 93.97(19) . 3_656
Sr1 O6 Sr2 100.36(15) 3_756 3_656
V2 O7 Sr2 104.6(2) . 1_554
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sr1 O6 2.528(4) 3_756
Sr1 O2 2.595(3) 3_656
Sr1 O2 2.595(3) 2_656
Sr1 O5 2.654(5) .
Sr1 O2 2.778(3) .
Sr1 O2 2.778(3) 4_565
Sr1 O4 2.895(4) 3_656
Sr1 O1 2.912(3) 4_565
Sr1 O1 2.912(3) .
Sr1 O4 3.1254(12) 1_565
Sr1 O4 3.1254(12) .
Sr1 V2 3.4185(16) .
Sr2 O1 2.551(3) 1_455
Sr2 O1 2.551(3) 4_465
Sr2 O2 2.585(3) 2_656
Sr2 O2 2.585(3) 3_656
Sr2 O4 2.650(5) 3_656
Sr2 O7 2.652(5) 1_556
Sr2 O6 2.852(5) 3_656
Sr2 O3 2.917(4) 1_556
Sr2 V1 3.3986(16) 3_656
Sr2 V2 3.4722(16) 1_556
Sr2 V2 3.6938(9) 3_666
Sr2 V2 3.6938(9) 3_656
V O1 1.983(3) 3_757
V O1 1.983(3) .
V O5 2.003(3) 3_757
V O5 2.003(3) .
V O3 2.049(3) 3_656
V O3 2.049(3) 1_656
V V 3.0452(6) 2_757
V V 3.0452(6) 2_747
V Sr2 3.7835(9) 1_655
V Sr2 3.7835(9) 3_657
V Sr1 3.8081(14) 3_757
V1 O4 1.660(4) .
V1 O6 1.662(4) .
V1 O1 1.761(3) .
V1 O1 1.761(3) 4
V1 Sr2 3.3986(16) 3_656
V1 Sr1 3.6514(8) 1_545
V1 Sr2 3.7145(9) 1_655
V1 Sr2 3.7145(9) 1_645
V2 O7 1.669(5) .
V2 O2 1.692(3) 4_565
V2 O2 1.692(3) .
V2 O3 1.797(4) .
V2 Sr2 3.4722(15) 1_554
V2 Sr2 3.6938(8) 3_666
V2 Sr2 3.6938(9) 3_656
V2 Sr1 3.9387(10) 3_666
V2 Sr1 3.9387(10) 3_656
O1 Sr2 2.551(3) 1_655
O2 Sr2 2.585(3) 3_656
O2 Sr1 2.595(3) 3_656
O3 V 2.049(3) 1_454
O3 V 2.049(3) 2_656
O3 Sr2 2.917(4) 1_554
O4 Sr2 2.650(5) 3_656
O4 Sr1 2.895(4) 3_656
O4 Sr1 3.1254(12) 1_545
O5 V 2.003(3) 2_757
O5 H5 0.89(2) .
O6 Sr1 2.528(4) 3_756
O6 Sr2 2.852(5) 3_656
O7 Sr2 2.652(5) 1_554
