#------------------------------------------------------------------------------
#$Date: 2021-05-17 10:22:23 +0300 (Mon, 17 May 2021) $
#$Revision: 265263 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/25/1562576.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_1562576
loop_
_publ_author_name
'Liu, Samuel'
'Blanchard, Peter E.R.'
'Avdeev, Maxim'
'Kennedy, Brendan J.'
'Ling, Chris D.'
_publ_section_title
;
 Designing new n=2 Sillen--Aurivillius phases by lattice-matched
 substitutions in the halide and [Bi2O2]2+ layers
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              165
_journal_page_last               170
_journal_paper_doi               10.1016/j.jssc.2013.07.004
_journal_volume                  205
_journal_year                    2013
_chemical_formula_sum            'Bi3 Br Nb2 O11 Sr2'
_chemical_formula_weight         1243.89
_space_group_IT_number           123
_space_group_name_Hall           '-P 4 2'
_space_group_name_H-M_alt        'P 4/m m m'
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            1
_cell_length_a                   3.92306(7)
_cell_length_b                   3.92306
_cell_length_c                   18.6066(6)
_cell_volume                     286.363(11)
_computing_structure_refinement  GSAS
_diffrn_radiation_probe          neutron
_diffrn_radiation_wavelength     2.4395
_exptl_absorpt_correction_T_max  0.06418
_exptl_absorpt_correction_T_min  0.00334
_exptl_absorpt_process_details
;   GSAS Absorption/surface roughness correction: function number 0
 Debye-Scherrer absorption correction
Term (= MU.r/wave) =      2.0000    
Correction is not refined.
;
_pd_calc_method                  'Rietveld Refinement'
_pd_meas_2theta_range_inc        0.05
_pd_meas_2theta_range_max        163.95
_pd_meas_2theta_range_min        2.75
_pd_meas_number_of_points        3225
_pd_proc_2theta_range_inc        0.05
_pd_proc_2theta_range_max        163.6741
_pd_proc_2theta_range_min        2.4741
_pd_proc_info_datetime           2013-06-03T12:11:39
_pd_proc_ls_background_function
;   GSAS Background function number 1 with 10 terms.
 Shifted Chebyshev function of 1st kind
      1:    450.410     2:    86.2552     3:    24.0147     4:   -8.44090    
      5:    22.9623     6:    1.40729     7:    3.88320     8:    6.64076    
      9:    8.52413    10:    4.06065    
;
_pd_proc_ls_prof_R_factor        0.0557
_pd_proc_ls_prof_wR_expected     0.0370
_pd_proc_ls_prof_wR_factor       0.0759
_pd_proc_number_of_points        3225
_refine_ls_goodness_of_fit_all   2.07
_refine_ls_matrix_type           full
_refine_ls_number_parameters     56
_refine_ls_number_restraints     0
_refine_ls_R_Fsqd_factor         0.06345
_refine_ls_shift/su_max          0.04
_refine_ls_shift/su_mean         0.01
_reflns_d_resolution_high        1.251
_reflns_d_resolution_low         12.553
_reflns_limit_h_max              4
_reflns_limit_h_min              0
_reflns_limit_k_max              4
_reflns_limit_k_min              0
_reflns_limit_l_max              20
_reflns_limit_l_min              0
_reflns_number_total             205
_cod_data_source_file            JSSC-2013-205-165.cif
_cod_data_source_block           SRBR300K
_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 (539 times).

data item '_geom_bond_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 (180 times).

Automatic conversion script
Id: cif_fix_values 8369 2020-08-20 11:38:08Z andrius 
;
_cod_original_cell_volume        286.364(16)
_cod_original_formula_sum        'Bi3.00 Br Nb2 O11 Sr2.00'
_cod_database_code               1562576
_gsas_exptl_extinct_corr_t_min   1.00000
_gsas_exptl_extinct_corr_t_max   1.00000
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +x,+y,+z
2 -y,+x,+z
3 -x,-y,+z
4 +y,-x,+z
5 -x,+y,+z
6 -y,-x,+z
7 +x,-y,+z
8 +y,+x,+z
-1 -x,-y,-z
-2 +y,-x,-z
-3 +x,+y,-z
-4 -y,+x,-z
-5 +x,-y,-z
-6 +y,+x,-z
-7 -x,+y,-z
-8 -y,-x,-z
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_thermal_displace_type
_atom_site_U_iso_or_equiv
_atom_site_symmetry_multiplicity
Bi Bi1 0.0 0.0 0.0 1.0 Uani 0.12145 1
Bi Bi2 0.0 0.0 0.25822(33) 0.5 Uani 0.11168 2
Sr Sr1 0.0 0.0 0.25822(33) 0.5 Uani 0.11168 2
Bi Bi3 0.5 0.5 0.38873(25) 0.5 Uani 0.07275 2
Sr Sr2 0.5 0.5 0.38873(25) 0.5 Uani 0.07275 2
Nb Nb1 0.5 0.5 0.11359(28) 1.0 Uani 0.06454 2
Br Br1 0.0 0.0 0.5 1.0 Uani 0.0864 1
O- O1 0.5 0.5 0.0 1.0 Uani 0.11918 1
O- O2 0.0 0.5 0.1064(4) 1.0 Uani 0.12045 4
O- O3 0.5 0.5 0.21358(31) 1.0 Uani 0.09005 2
O- O4 0.0 0.5 0.33072(22) 1.0 Uani 0.07883 4
loop_
_atom_type_symbol
_atom_type_scat_length_neutron
_atom_type_scat_source
Bi+3 0.8532 International_Tables_Vol_C
Sr+2 0.7020 International_Tables_Vol_C
Nb+5 0.7054 International_Tables_Vol_C
Br-1 0.6795 International_Tables_Vol_C
O-2 0.5803 International_Tables_Vol_C
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_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Sr2 Bi2 Sr2 64.29(10) 1_445 . 1_455 n
Sr2 Bi2 Sr2 64.29(10) 1_445 . 1_545 n
Sr2 Bi2 Sr2 97.60(19) 1_445 . 1_555 n
Sr2 Bi2 O4 35.74(7) 1_445 . 1_545 n
Sr2 Bi2 O4 93.73(20) 1_445 . 1_555 n
Sr2 Bi2 O4 35.74(7) 1_445 . 2_555 n
Sr2 Bi2 O4 93.73(20) 1_445 . 2_655 n
Sr2 Bi2 Sr2 97.60(19) 1_455 . 1_545 n
Sr2 Bi2 Sr2 64.29(10) 1_455 . 1_555 n
Sr2 Bi2 O4 93.73(20) 1_455 . 1_545 n
Sr2 Bi2 O4 35.74(7) 1_455 . 1_555 n
Sr2 Bi2 O4 35.74(7) 1_455 . 2_555 n
Sr2 Bi2 O4 93.73(20) 1_455 . 2_655 n
Sr2 Bi2 Sr2 64.29(10) 1_545 . 1_555 n
Sr2 Bi2 O4 35.74(7) 1_545 . 1_545 n
Sr2 Bi2 O4 93.73(20) 1_545 . 1_555 n
Sr2 Bi2 O4 93.73(20) 1_545 . 2_555 n
Sr2 Bi2 O4 35.74(7) 1_545 . 2_655 n
Sr2 Bi2 O4 93.73(20) 1_555 . 1_545 n
Sr2 Bi2 O4 35.74(7) 1_555 . 1_555 n
Sr2 Bi2 O4 93.73(20) 1_555 . 2_555 n
Sr2 Bi2 O4 35.74(7) 1_555 . 2_655 n
O4 Bi2 O4 110.96(32) 1_545 . 1_555 n
O4 Bi2 O4 71.27(16) 1_545 . 2_555 n
O4 Bi2 O4 71.27(16) 1_545 . 2_655 n
O4 Bi2 O4 71.27(16) 1_555 . 2_555 n
O4 Bi2 O4 71.27(16) 1_555 . 2_655 n
O4 Bi2 O4 110.96(32) 2_555 . 2_655 n
Sr1 Sr1 Sr1 90.0 1_455 . 1_545 n
Sr1 Sr1 Sr1 90.0 1_455 . 1_565 n
Sr1 Sr1 Sr1 180.0 1_455 . 1_655 n
Sr1 Sr1 Bi3 57.86(5) 1_455 . 1_445 n
Sr1 Sr1 Bi3 57.86(5) 1_455 . 1_455 n
Sr1 Sr1 Bi3 122.14(5) 1_455 . 1_545 n
Sr1 Sr1 Bi3 122.14(5) 1_455 . 1_555 n
Sr1 Sr1 Sr2 57.86(5) 1_455 . 1_445 n
Sr1 Sr1 Sr2 57.86(5) 1_455 . 1_455 n
Sr1 Sr1 Sr2 122.14(5) 1_455 . 1_545 n
Sr1 Sr1 Sr2 122.14(5) 1_455 . 1_555 n
Sr1 Sr1 O3 47.36(5) 1_455 . 1_445 n
Sr1 Sr1 O3 47.36(5) 1_455 . 1_455 n
Sr1 Sr1 O3 132.64(5) 1_455 . 1_545 n
Sr1 Sr1 O3 132.64(5) 1_455 . 1_555 n
Sr1 Sr1 O4 90.0 1_455 . 1_545 n
Sr1 Sr1 O4 90.0 1_455 . 1_555 n
Sr1 Sr1 O4 34.52(16) 1_455 . 2_555 n
Sr1 Sr1 O4 145.48(16) 1_455 . 2_655 n
Sr1 Sr1 Sr1 180.0 1_545 . 1_565 n
Sr1 Sr1 Sr1 90.0 1_545 . 1_655 n
Sr1 Sr1 Bi3 57.86(5) 1_545 . 1_445 n
Sr1 Sr1 Bi3 122.14(5) 1_545 . 1_455 n
Sr1 Sr1 Bi3 57.86(5) 1_545 . 1_545 n
Sr1 Sr1 Bi3 122.14(5) 1_545 . 1_555 n
Sr1 Sr1 Sr2 57.86(5) 1_545 . 1_445 n
Sr1 Sr1 Sr2 122.14(5) 1_545 . 1_455 n
Sr1 Sr1 Sr2 57.86(5) 1_545 . 1_545 n
Sr1 Sr1 Sr2 122.14(5) 1_545 . 1_555 n
Sr1 Sr1 O3 47.36(5) 1_545 . 1_445 n
Sr1 Sr1 O3 132.64(5) 1_545 . 1_455 n
Sr1 Sr1 O3 47.36(5) 1_545 . 1_545 n
Sr1 Sr1 O3 132.64(5) 1_545 . 1_555 n
Sr1 Sr1 O4 34.52(16) 1_545 . 1_545 n
Sr1 Sr1 O4 145.48(16) 1_545 . 1_555 n
Sr1 Sr1 O4 90.0 1_545 . 2_555 n
Sr1 Sr1 O4 90.0 1_545 . 2_655 n
Sr1 Sr1 Sr1 90.0 1_565 . 1_655 n
Sr1 Sr1 Bi3 122.14(5) 1_565 . 1_445 n
Sr1 Sr1 Bi3 57.86(5) 1_565 . 1_455 n
Sr1 Sr1 Bi3 122.14(5) 1_565 . 1_545 n
Sr1 Sr1 Bi3 57.86(5) 1_565 . 1_555 n
Sr1 Sr1 Sr2 122.14(5) 1_565 . 1_445 n
Sr1 Sr1 Sr2 57.86(5) 1_565 . 1_455 n
Sr1 Sr1 Sr2 122.14(5) 1_565 . 1_545 n
Sr1 Sr1 Sr2 57.86(5) 1_565 . 1_555 n
Sr1 Sr1 O3 132.64(5) 1_565 . 1_445 n
Sr1 Sr1 O3 47.36(5) 1_565 . 1_455 n
Sr1 Sr1 O3 132.64(5) 1_565 . 1_545 n
Sr1 Sr1 O3 47.36(5) 1_565 . 1_555 n
Sr1 Sr1 O4 145.48(16) 1_565 . 1_545 n
Sr1 Sr1 O4 34.52(16) 1_565 . 1_555 n
Sr1 Sr1 O4 90.0 1_565 . 2_555 n
Sr1 Sr1 O4 90.0 1_565 . 2_655 n
Sr1 Sr1 Bi3 122.14(5) 1_655 . 1_445 n
Sr1 Sr1 Bi3 122.14(5) 1_655 . 1_455 n
Sr1 Sr1 Bi3 57.86(5) 1_655 . 1_545 n
Sr1 Sr1 Bi3 57.86(5) 1_655 . 1_555 n
Sr1 Sr1 Sr2 122.14(5) 1_655 . 1_445 n
Sr1 Sr1 Sr2 122.14(5) 1_655 . 1_455 n
Sr1 Sr1 Sr2 57.86(5) 1_655 . 1_545 n
Sr1 Sr1 Sr2 57.86(5) 1_655 . 1_555 n
Sr1 Sr1 O3 132.64(5) 1_655 . 1_445 n
Sr1 Sr1 O3 132.64(5) 1_655 . 1_455 n
Sr1 Sr1 O3 47.36(5) 1_655 . 1_545 n
Sr1 Sr1 O3 47.36(5) 1_655 . 1_555 n
Sr1 Sr1 O4 90.0 1_655 . 1_545 n
Sr1 Sr1 O4 90.0 1_655 . 1_555 n
Sr1 Sr1 O4 145.48(16) 1_655 . 2_555 n
Sr1 Sr1 O4 34.52(16) 1_655 . 2_655 n
Bi3 Sr1 Bi3 64.29(10) 1_445 . 1_455 n
Bi3 Sr1 Bi3 64.29(10) 1_445 . 1_545 n
Bi3 Sr1 Bi3 97.60(19) 1_445 . 1_555 n
Bi3 Sr1 Sr2 0.0 1_445 . 1_445 n
Bi3 Sr1 Sr2 64.29(10) 1_445 . 1_455 n
Bi3 Sr1 Sr2 64.29(10) 1_445 . 1_545 n
Bi3 Sr1 Sr2 97.60(19) 1_445 . 1_555 n
Bi3 Sr1 O3 57.87(12) 1_445 . 1_445 n
Bi3 Sr1 O3 100.89(9) 1_445 . 1_455 n
Bi3 Sr1 O3 100.89(9) 1_445 . 1_545 n
Bi3 Sr1 O3 155.47(24) 1_445 . 1_555 n
Bi3 Sr1 O4 35.74(7) 1_445 . 1_545 n
Bi3 Sr1 O4 93.73(20) 1_445 . 1_555 n
Bi3 Sr1 O4 35.74(7) 1_445 . 2_555 n
Bi3 Sr1 O4 93.73(20) 1_445 . 2_655 n
Bi3 Sr1 Bi3 97.60(19) 1_455 . 1_545 n
Bi3 Sr1 Bi3 64.29(10) 1_455 . 1_555 n
Bi3 Sr1 Sr2 64.29(10) 1_455 . 1_445 n
Bi3 Sr1 Sr2 0.0 1_455 . 1_455 n
Bi3 Sr1 Sr2 97.60(19) 1_455 . 1_545 n
Bi3 Sr1 Sr2 64.29(10) 1_455 . 1_555 n
Bi3 Sr1 O3 100.89(9) 1_455 . 1_445 n
Bi3 Sr1 O3 57.87(12) 1_455 . 1_455 n
Bi3 Sr1 O3 155.47(24) 1_455 . 1_545 n
Bi3 Sr1 O3 100.89(9) 1_455 . 1_555 n
Bi3 Sr1 O4 93.73(20) 1_455 . 1_545 n
Bi3 Sr1 O4 35.74(7) 1_455 . 1_555 n
Bi3 Sr1 O4 35.74(7) 1_455 . 2_555 n
Bi3 Sr1 O4 93.73(20) 1_455 . 2_655 n
Bi3 Sr1 Bi3 64.29(10) 1_545 . 1_555 n
Bi3 Sr1 Sr2 64.29(10) 1_545 . 1_445 n
Bi3 Sr1 Sr2 97.60(19) 1_545 . 1_455 n
Bi3 Sr1 Sr2 0.0 1_545 . 1_545 n
Bi3 Sr1 Sr2 64.29(10) 1_545 . 1_555 n
Bi3 Sr1 O3 100.89(9) 1_545 . 1_445 n
Bi3 Sr1 O3 155.47(24) 1_545 . 1_455 n
Bi3 Sr1 O3 57.87(12) 1_545 . 1_545 n
Bi3 Sr1 O3 100.89(9) 1_545 . 1_555 n
Bi3 Sr1 O4 35.74(7) 1_545 . 1_545 n
Bi3 Sr1 O4 93.73(20) 1_545 . 1_555 n
Bi3 Sr1 O4 93.73(20) 1_545 . 2_555 n
Bi3 Sr1 O4 35.74(7) 1_545 . 2_655 n
Bi3 Sr1 Sr2 97.60(19) 1_555 . 1_445 n
Bi3 Sr1 Sr2 64.29(10) 1_555 . 1_455 n
Bi3 Sr1 Sr2 64.29(10) 1_555 . 1_545 n
Bi3 Sr1 Sr2 0.0 1_555 . 1_555 n
Bi3 Sr1 O3 155.47(24) 1_555 . 1_445 n
Bi3 Sr1 O3 100.89(9) 1_555 . 1_455 n
Bi3 Sr1 O3 100.89(9) 1_555 . 1_545 n
Bi3 Sr1 O3 57.87(12) 1_555 . 1_555 n
Bi3 Sr1 O4 93.73(20) 1_555 . 1_545 n
Bi3 Sr1 O4 35.74(7) 1_555 . 1_555 n
Bi3 Sr1 O4 93.73(20) 1_555 . 2_555 n
Bi3 Sr1 O4 35.74(7) 1_555 . 2_655 n
Sr2 Sr1 Sr2 64.29(10) 1_445 . 1_455 n
Sr2 Sr1 Sr2 64.29(10) 1_445 . 1_545 n
Sr2 Sr1 Sr2 97.60(19) 1_445 . 1_555 n
Sr2 Sr1 O3 57.87(12) 1_445 . 1_445 n
Sr2 Sr1 O3 100.89(9) 1_445 . 1_455 n
Sr2 Sr1 O3 100.89(9) 1_445 . 1_545 n
Sr2 Sr1 O3 155.47(24) 1_445 . 1_555 n
Sr2 Sr1 O4 35.74(7) 1_445 . 1_545 n
Sr2 Sr1 O4 93.73(20) 1_445 . 1_555 n
Sr2 Sr1 O4 35.74(7) 1_445 . 2_555 n
Sr2 Sr1 O4 93.73(20) 1_445 . 2_655 n
Sr2 Sr1 Sr2 97.60(19) 1_455 . 1_545 n
Sr2 Sr1 Sr2 64.29(10) 1_455 . 1_555 n
Sr2 Sr1 O3 100.89(9) 1_455 . 1_445 n
Sr2 Sr1 O3 57.87(12) 1_455 . 1_455 n
Sr2 Sr1 O3 155.47(24) 1_455 . 1_545 n
Sr2 Sr1 O3 100.89(9) 1_455 . 1_555 n
Sr2 Sr1 O4 93.73(20) 1_455 . 1_545 n
Sr2 Sr1 O4 35.74(7) 1_455 . 1_555 n
Sr2 Sr1 O4 35.74(7) 1_455 . 2_555 n
Sr2 Sr1 O4 93.73(20) 1_455 . 2_655 n
Sr2 Sr1 Sr2 64.29(10) 1_545 . 1_555 n
Sr2 Sr1 O3 100.89(9) 1_545 . 1_445 n
Sr2 Sr1 O3 155.47(24) 1_545 . 1_455 n
Sr2 Sr1 O3 57.87(12) 1_545 . 1_545 n
Sr2 Sr1 O3 100.89(9) 1_545 . 1_555 n
Sr2 Sr1 O4 35.74(7) 1_545 . 1_545 n
Sr2 Sr1 O4 93.73(20) 1_545 . 1_555 n
Sr2 Sr1 O4 93.73(20) 1_545 . 2_555 n
Sr2 Sr1 O4 35.74(7) 1_545 . 2_655 n
Sr2 Sr1 O3 155.47(24) 1_555 . 1_445 n
Sr2 Sr1 O3 100.89(9) 1_555 . 1_455 n
Sr2 Sr1 O3 100.89(9) 1_555 . 1_545 n
Sr2 Sr1 O3 57.87(12) 1_555 . 1_555 n
Sr2 Sr1 O4 93.73(20) 1_555 . 1_545 n
Sr2 Sr1 O4 35.74(7) 1_555 . 1_555 n
Sr2 Sr1 O4 93.73(20) 1_555 . 2_555 n
Sr2 Sr1 O4 35.74(7) 1_555 . 2_655 n
O3 Sr1 O3 85.28(9) 1_445 . 1_455 n
O3 Sr1 O3 85.28(9) 1_445 . 1_545 n
O3 Sr1 O3 146.67(33) 1_445 . 1_555 n
O3 Sr1 O4 66.70(10) 1_445 . 1_545 n
O3 Sr1 O4 136.11(11) 1_445 . 1_555 n
O3 Sr1 O4 66.70(10) 1_445 . 2_555 n
O3 Sr1 O4 136.11(11) 1_445 . 2_655 n
O3 Sr1 O3 146.67(33) 1_455 . 1_545 n
O3 Sr1 O3 85.28(9) 1_455 . 1_555 n
O3 Sr1 O4 136.11(11) 1_455 . 1_545 n
O3 Sr1 O4 66.70(10) 1_455 . 1_555 n
O3 Sr1 O4 66.70(10) 1_455 . 2_555 n
O3 Sr1 O4 136.11(11) 1_455 . 2_655 n
O3 Sr1 O3 85.28(9) 1_545 . 1_555 n
O3 Sr1 O4 66.70(10) 1_545 . 1_545 n
O3 Sr1 O4 136.11(11) 1_545 . 1_555 n
O3 Sr1 O4 136.11(11) 1_545 . 2_555 n
O3 Sr1 O4 66.70(10) 1_545 . 2_655 n
O3 Sr1 O4 136.11(11) 1_555 . 1_545 n
O3 Sr1 O4 66.70(10) 1_555 . 1_555 n
O3 Sr1 O4 136.11(11) 1_555 . 2_555 n
O3 Sr1 O4 66.70(10) 1_555 . 2_655 n
O4 Sr1 O4 110.96(32) 1_545 . 1_555 n
O4 Sr1 O4 71.27(16) 1_545 . 2_555 n
O4 Sr1 O4 71.27(16) 1_545 . 2_655 n
O4 Sr1 O4 71.27(16) 1_555 . 2_555 n
O4 Sr1 O4 71.27(16) 1_555 . 2_655 n
O4 Sr1 O4 110.96(32) 2_555 . 2_655 n
Sr1 Bi3 Sr1 64.29(10) 1_555 . 1_565 n
Sr1 Bi3 Sr1 64.29(10) 1_555 . 1_655 n
Sr1 Bi3 Sr1 97.60(19) 1_555 . 1_665 n
Sr1 Bi3 O4 38.40(7) 1_555 . 1_555 n
Sr1 Bi3 O4 98.55(15) 1_555 . 1_655 n
Sr1 Bi3 O4 38.40(7) 1_555 . 2_655 n
Sr1 Bi3 O4 98.55(15) 1_555 . 2_665 n
Sr1 Bi3 Sr1 97.60(19) 1_565 . 1_655 n
Sr1 Bi3 Sr1 64.29(10) 1_565 . 1_665 n
Sr1 Bi3 O4 38.40(7) 1_565 . 1_555 n
Sr1 Bi3 O4 98.55(15) 1_565 . 1_655 n
Sr1 Bi3 O4 98.55(15) 1_565 . 2_655 n
Sr1 Bi3 O4 38.40(7) 1_565 . 2_665 n
Sr1 Bi3 Sr1 64.29(10) 1_655 . 1_665 n
Sr1 Bi3 O4 98.55(15) 1_655 . 1_555 n
Sr1 Bi3 O4 38.40(7) 1_655 . 1_655 n
Sr1 Bi3 O4 38.40(7) 1_655 . 2_655 n
Sr1 Bi3 O4 98.55(15) 1_655 . 2_665 n
Sr1 Bi3 O4 98.55(15) 1_665 . 1_555 n
Sr1 Bi3 O4 38.40(7) 1_665 . 1_655 n
Sr1 Bi3 O4 98.55(15) 1_665 . 2_655 n
Sr1 Bi3 O4 38.40(7) 1_665 . 2_665 n
O4 Bi3 O4 122.36(26) 1_555 . 1_655 n
O4 Bi3 O4 76.56(11) 1_555 . 2_655 n
O4 Bi3 O4 76.56(11) 1_555 . 2_665 n
O4 Bi3 O4 76.56(11) 1_655 . 2_655 n
O4 Bi3 O4 76.56(11) 1_655 . 2_665 n
O4 Bi3 O4 122.36(26) 2_655 . 2_665 n
Bi2 Sr2 Bi2 64.29(10) 1_555 . 1_565 n
Bi2 Sr2 Bi2 64.29(10) 1_555 . 1_655 n
Bi2 Sr2 Bi2 97.60(19) 1_555 . 1_665 n
Bi2 Sr2 Sr1 0.0 1_555 . 1_555 n
Bi2 Sr2 Sr1 64.29(10) 1_555 . 1_565 n
Bi2 Sr2 Sr1 64.29(10) 1_555 . 1_655 n
Bi2 Sr2 Sr1 97.60(19) 1_555 . 1_665 n
Bi2 Sr2 Sr2 57.86(5) 1_555 . 1_455 n
Bi2 Sr2 Sr2 57.86(5) 1_555 . 1_545 n
Bi2 Sr2 Sr2 122.14(5) 1_555 . 1_565 n
Bi2 Sr2 Sr2 122.14(5) 1_555 . 1_655 n
Bi2 Sr2 Sr2 131.20(9) 1_555 . -1_666 n
Bi2 Sr2 Br1 77.93(7) 1_555 . 1_555 n
Bi2 Sr2 Br1 113.20(4) 1_555 . 1_565 n
Bi2 Sr2 Br1 113.20(4) 1_555 . 1_655 n
Bi2 Sr2 Br1 175.54(14) 1_555 . 1_665 n
Bi2 Sr2 O4 38.40(7) 1_555 . 1_555 n
Bi2 Sr2 O4 98.55(15) 1_555 . 1_655 n
Bi2 Sr2 O4 38.40(7) 1_555 . 2_655 n
Bi2 Sr2 O4 98.55(15) 1_555 . 2_665 n
Bi2 Sr2 Bi2 97.60(19) 1_565 . 1_655 n
Bi2 Sr2 Bi2 64.29(10) 1_565 . 1_665 n
Bi2 Sr2 Sr1 64.29(10) 1_565 . 1_555 n
Bi2 Sr2 Sr1 0.0 1_565 . 1_565 n
Bi2 Sr2 Sr1 97.60(19) 1_565 . 1_655 n
Bi2 Sr2 Sr1 64.29(10) 1_565 . 1_665 n
Bi2 Sr2 Sr2 57.86(5) 1_565 . 1_455 n
Bi2 Sr2 Sr2 122.14(5) 1_565 . 1_545 n
Bi2 Sr2 Sr2 57.86(5) 1_565 . 1_565 n
Bi2 Sr2 Sr2 122.14(5) 1_565 . 1_655 n
Bi2 Sr2 Sr2 131.20(9) 1_565 . -1_666 n
Bi2 Sr2 Br1 113.20(4) 1_565 . 1_555 n
Bi2 Sr2 Br1 77.93(7) 1_565 . 1_565 n
Bi2 Sr2 Br1 175.54(14) 1_565 . 1_655 n
Bi2 Sr2 Br1 113.20(4) 1_565 . 1_665 n
Bi2 Sr2 O4 38.40(7) 1_565 . 1_555 n
Bi2 Sr2 O4 98.55(15) 1_565 . 1_655 n
Bi2 Sr2 O4 98.55(15) 1_565 . 2_655 n
Bi2 Sr2 O4 38.40(7) 1_565 . 2_665 n
Bi2 Sr2 Bi2 64.29(10) 1_655 . 1_665 n
Bi2 Sr2 Sr1 64.29(10) 1_655 . 1_555 n
Bi2 Sr2 Sr1 97.60(19) 1_655 . 1_565 n
Bi2 Sr2 Sr1 0.0 1_655 . 1_655 n
Bi2 Sr2 Sr1 64.29(10) 1_655 . 1_665 n
Bi2 Sr2 Sr2 122.14(5) 1_655 . 1_455 n
Bi2 Sr2 Sr2 57.86(5) 1_655 . 1_545 n
Bi2 Sr2 Sr2 122.14(5) 1_655 . 1_565 n
Bi2 Sr2 Sr2 57.86(5) 1_655 . 1_655 n
Bi2 Sr2 Sr2 131.20(9) 1_655 . -1_666 n
Bi2 Sr2 Br1 113.20(4) 1_655 . 1_555 n
Bi2 Sr2 Br1 175.54(14) 1_655 . 1_565 n
Bi2 Sr2 Br1 77.93(7) 1_655 . 1_655 n
Bi2 Sr2 Br1 113.20(4) 1_655 . 1_665 n
Bi2 Sr2 O4 98.55(15) 1_655 . 1_555 n
Bi2 Sr2 O4 38.40(7) 1_655 . 1_655 n
Bi2 Sr2 O4 38.40(7) 1_655 . 2_655 n
Bi2 Sr2 O4 98.55(15) 1_655 . 2_665 n
Bi2 Sr2 Sr1 97.60(19) 1_665 . 1_555 n
Bi2 Sr2 Sr1 64.29(10) 1_665 . 1_565 n
Bi2 Sr2 Sr1 64.29(10) 1_665 . 1_655 n
Bi2 Sr2 Sr1 0.0 1_665 . 1_665 n
Bi2 Sr2 Sr2 122.14(5) 1_665 . 1_455 n
Bi2 Sr2 Sr2 122.14(5) 1_665 . 1_545 n
Bi2 Sr2 Sr2 57.86(5) 1_665 . 1_565 n
Bi2 Sr2 Sr2 57.86(5) 1_665 . 1_655 n
Bi2 Sr2 Sr2 131.20(9) 1_665 . -1_666 n
Bi2 Sr2 Br1 175.54(14) 1_665 . 1_555 n
Bi2 Sr2 Br1 113.20(4) 1_665 . 1_565 n
Bi2 Sr2 Br1 113.20(4) 1_665 . 1_655 n
Bi2 Sr2 Br1 77.93(7) 1_665 . 1_665 n
Bi2 Sr2 O4 98.55(15) 1_665 . 1_555 n
Bi2 Sr2 O4 38.40(7) 1_665 . 1_655 n
Bi2 Sr2 O4 98.55(15) 1_665 . 2_655 n
Bi2 Sr2 O4 38.40(7) 1_665 . 2_665 n
Sr1 Sr2 Sr1 64.29(10) 1_555 . 1_565 n
Sr1 Sr2 Sr1 64.29(10) 1_555 . 1_655 n
Sr1 Sr2 Sr1 97.60(19) 1_555 . 1_665 n
Sr1 Sr2 Sr2 57.86(5) 1_555 . 1_455 n
Sr1 Sr2 Sr2 57.86(5) 1_555 . 1_545 n
Sr1 Sr2 Sr2 122.14(5) 1_555 . 1_565 n
Sr1 Sr2 Sr2 122.14(5) 1_555 . 1_655 n
Sr1 Sr2 Sr2 131.20(9) 1_555 . -1_666 n
Sr1 Sr2 Br1 77.93(7) 1_555 . 1_555 n
Sr1 Sr2 Br1 113.20(4) 1_555 . 1_565 n
Sr1 Sr2 Br1 113.20(4) 1_555 . 1_655 n
Sr1 Sr2 Br1 175.54(14) 1_555 . 1_665 n
Sr1 Sr2 O4 38.40(7) 1_555 . 1_555 n
Sr1 Sr2 O4 98.55(15) 1_555 . 1_655 n
Sr1 Sr2 O4 38.40(7) 1_555 . 2_655 n
Sr1 Sr2 O4 98.55(15) 1_555 . 2_665 n
Sr1 Sr2 Sr1 97.60(19) 1_565 . 1_655 n
Sr1 Sr2 Sr1 64.29(10) 1_565 . 1_665 n
Sr1 Sr2 Sr2 57.86(5) 1_565 . 1_455 n
Sr1 Sr2 Sr2 122.14(5) 1_565 . 1_545 n
Sr1 Sr2 Sr2 57.86(5) 1_565 . 1_565 n
Sr1 Sr2 Sr2 122.14(5) 1_565 . 1_655 n
Sr1 Sr2 Sr2 131.20(9) 1_565 . -1_666 n
Sr1 Sr2 Br1 113.20(4) 1_565 . 1_555 n
Sr1 Sr2 Br1 77.93(7) 1_565 . 1_565 n
Sr1 Sr2 Br1 175.54(14) 1_565 . 1_655 n
Sr1 Sr2 Br1 113.20(4) 1_565 . 1_665 n
Sr1 Sr2 O4 38.40(7) 1_565 . 1_555 n
Sr1 Sr2 O4 98.55(15) 1_565 . 1_655 n
Sr1 Sr2 O4 98.55(15) 1_565 . 2_655 n
Sr1 Sr2 O4 38.40(7) 1_565 . 2_665 n
Sr1 Sr2 Sr1 64.29(10) 1_655 . 1_665 n
Sr1 Sr2 Sr2 122.14(5) 1_655 . 1_455 n
Sr1 Sr2 Sr2 57.86(5) 1_655 . 1_545 n
Sr1 Sr2 Sr2 122.14(5) 1_655 . 1_565 n
Sr1 Sr2 Sr2 57.86(5) 1_655 . 1_655 n
Sr1 Sr2 Sr2 131.20(9) 1_655 . -1_666 n
Sr1 Sr2 Br1 113.20(4) 1_655 . 1_555 n
Sr1 Sr2 Br1 175.54(14) 1_655 . 1_565 n
Sr1 Sr2 Br1 77.93(7) 1_655 . 1_655 n
Sr1 Sr2 Br1 113.20(4) 1_655 . 1_665 n
Sr1 Sr2 O4 98.55(15) 1_655 . 1_555 n
Sr1 Sr2 O4 38.40(7) 1_655 . 1_655 n
Sr1 Sr2 O4 38.40(7) 1_655 . 2_655 n
Sr1 Sr2 O4 98.55(15) 1_655 . 2_665 n
Sr1 Sr2 Sr2 122.14(5) 1_665 . 1_455 n
Sr1 Sr2 Sr2 122.14(5) 1_665 . 1_545 n
Sr1 Sr2 Sr2 57.86(5) 1_665 . 1_565 n
Sr1 Sr2 Sr2 57.86(5) 1_665 . 1_655 n
Sr1 Sr2 Sr2 131.20(9) 1_665 . -1_666 n
Sr1 Sr2 Br1 175.54(14) 1_665 . 1_555 n
Sr1 Sr2 Br1 113.20(4) 1_665 . 1_565 n
Sr1 Sr2 Br1 113.20(4) 1_665 . 1_655 n
Sr1 Sr2 Br1 77.93(7) 1_665 . 1_665 n
Sr1 Sr2 O4 98.55(15) 1_665 . 1_555 n
Sr1 Sr2 O4 38.40(7) 1_665 . 1_655 n
Sr1 Sr2 O4 98.55(15) 1_665 . 2_655 n
Sr1 Sr2 O4 38.40(7) 1_665 . 2_665 n
Sr2 Sr2 Sr2 90.0 1_455 . 1_545 n
Sr2 Sr2 Sr2 90.0 1_455 . 1_565 n
Sr2 Sr2 Sr2 180.0 1_455 . 1_655 n
Sr2 Sr2 Sr2 90.0 1_455 . -1_666 n
Sr2 Sr2 Br1 55.481(32) 1_455 . 1_555 n
Sr2 Sr2 Br1 55.481(32) 1_455 . 1_565 n
Sr2 Sr2 Br1 124.519(32) 1_455 . 1_655 n
Sr2 Sr2 Br1 124.519(32) 1_455 . 1_665 n
Sr2 Sr2 O4 28.82(13) 1_455 . 1_555 n
Sr2 Sr2 O4 151.18(13) 1_455 . 1_655 n
Sr2 Sr2 O4 90.0 1_455 . 2_655 n
Sr2 Sr2 O4 90.0 1_455 . 2_665 n
Sr2 Sr2 Sr2 180.0 1_545 . 1_565 n
Sr2 Sr2 Sr2 90.0 1_545 . 1_655 n
Sr2 Sr2 Sr2 90.0 1_545 . -1_666 n
Sr2 Sr2 Br1 55.481(32) 1_545 . 1_555 n
Sr2 Sr2 Br1 124.519(32) 1_545 . 1_565 n
Sr2 Sr2 Br1 55.481(32) 1_545 . 1_655 n
Sr2 Sr2 Br1 124.519(32) 1_545 . 1_665 n
Sr2 Sr2 O4 90.0 1_545 . 1_555 n
Sr2 Sr2 O4 90.0 1_545 . 1_655 n
Sr2 Sr2 O4 28.82(13) 1_545 . 2_655 n
Sr2 Sr2 O4 151.18(13) 1_545 . 2_665 n
Sr2 Sr2 Sr2 90.0 1_565 . 1_655 n
Sr2 Sr2 Sr2 90.0 1_565 . -1_666 n
Sr2 Sr2 Br1 124.519(32) 1_565 . 1_555 n
Sr2 Sr2 Br1 55.481(32) 1_565 . 1_565 n
Sr2 Sr2 Br1 124.519(32) 1_565 . 1_655 n
Sr2 Sr2 Br1 55.481(32) 1_565 . 1_665 n
Sr2 Sr2 O4 90.0 1_565 . 1_555 n
Sr2 Sr2 O4 90.0 1_565 . 1_655 n
Sr2 Sr2 O4 151.18(13) 1_565 . 2_655 n
Sr2 Sr2 O4 28.82(13) 1_565 . 2_665 n
Sr2 Sr2 Sr2 90.0 1_655 . -1_666 n
Sr2 Sr2 Br1 124.519(32) 1_655 . 1_555 n
Sr2 Sr2 Br1 124.519(32) 1_655 . 1_565 n
Sr2 Sr2 Br1 55.481(32) 1_655 . 1_655 n
Sr2 Sr2 Br1 55.481(32) 1_655 . 1_665 n
Sr2 Sr2 O4 151.18(13) 1_655 . 1_555 n
Sr2 Sr2 O4 28.82(13) 1_655 . 1_655 n
Sr2 Sr2 O4 90.0 1_655 . 2_655 n
Sr2 Sr2 O4 90.0 1_655 . 2_665 n
Sr2 Sr2 Br1 53.26(6) -1_666 . 1_555 n
Sr2 Sr2 Br1 53.26(6) -1_666 . 1_565 n
Sr2 Sr2 Br1 53.26(6) -1_666 . 1_655 n
Sr2 Sr2 Br1 53.26(6) -1_666 . 1_665 n
Sr2 Sr2 O4 118.82(13) -1_666 . 1_555 n
Sr2 Sr2 O4 118.82(13) -1_666 . 1_655 n
Sr2 Sr2 O4 118.82(13) -1_666 . 2_655 n
Sr2 Sr2 O4 118.82(13) -1_666 . 2_665 n
Br1 Sr2 Br1 69.04(6) 1_555 . 1_565 n
Br1 Sr2 Br1 69.04(6) 1_555 . 1_655 n
Br1 Sr2 Br1 106.53(12) 1_555 . 1_665 n
Br1 Sr2 O4 77.99(8) 1_555 . 1_555 n
Br1 Sr2 O4 141.70(5) 1_555 . 1_655 n
Br1 Sr2 O4 77.99(8) 1_555 . 2_655 n
Br1 Sr2 O4 141.70(5) 1_555 . 2_665 n
Br1 Sr2 Br1 106.53(12) 1_565 . 1_655 n
Br1 Sr2 Br1 69.04(6) 1_565 . 1_665 n
Br1 Sr2 O4 77.99(8) 1_565 . 1_555 n
Br1 Sr2 O4 141.70(5) 1_565 . 1_655 n
Br1 Sr2 O4 141.70(5) 1_565 . 2_655 n
Br1 Sr2 O4 77.99(8) 1_565 . 2_665 n
Br1 Sr2 Br1 69.04(6) 1_655 . 1_665 n
Br1 Sr2 O4 141.70(5) 1_655 . 1_555 n
Br1 Sr2 O4 77.99(8) 1_655 . 1_655 n
Br1 Sr2 O4 77.99(8) 1_655 . 2_655 n
Br1 Sr2 O4 141.70(5) 1_655 . 2_665 n
Br1 Sr2 O4 141.70(5) 1_665 . 1_555 n
Br1 Sr2 O4 77.99(8) 1_665 . 1_655 n
Br1 Sr2 O4 141.70(5) 1_665 . 2_655 n
Br1 Sr2 O4 77.99(8) 1_665 . 2_665 n
O4 Sr2 O4 122.36(26) 1_555 . 1_655 n
O4 Sr2 O4 76.56(11) 1_555 . 2_655 n
O4 Sr2 O4 76.56(11) 1_555 . 2_665 n
O4 Sr2 O4 76.56(11) 1_655 . 2_655 n
O4 Sr2 O4 76.56(11) 1_655 . 2_665 n
O4 Sr2 O4 122.36(26) 2_655 . 2_665 n
O1 Nb1 O2 86.10(23) 1_555 . 1_555 n
O1 Nb1 O2 86.10(23) 1_555 . 1_655 n
O1 Nb1 O2 86.10(23) 1_555 . 2_655 n
O1 Nb1 O2 86.10(23) 1_555 . 2_665 n
O1 Nb1 O3 180.0 1_555 . 1_555 n
O2 Nb1 O2 172.2(5) 1_555 . 1_655 n
O2 Nb1 O2 89.735(31) 1_555 . 2_655 n
O2 Nb1 O2 89.735(31) 1_555 . 2_665 n
O2 Nb1 O3 93.90(23) 1_555 . 1_555 n
O2 Nb1 O2 89.735(31) 1_655 . 2_655 n
O2 Nb1 O2 89.735(31) 1_655 . 2_665 n
O2 Nb1 O3 93.90(23) 1_655 . 1_555 n
O2 Nb1 O2 172.2(5) 2_655 . 2_665 n
O2 Nb1 O3 93.90(23) 2_655 . 1_555 n
O2 Nb1 O3 93.90(23) 2_665 . 1_555 n
Sr2 Br1 Sr2 69.04(6) 1_445 . 1_455 n
Sr2 Br1 Sr2 69.04(6) 1_445 . 1_545 n
Sr2 Br1 Sr2 106.53(12) 1_445 . 1_555 n
Sr2 Br1 Sr2 73.47(12) 1_445 . -1_556 n
Sr2 Br1 Sr2 110.96(6) 1_445 . -1_566 n
Sr2 Br1 Sr2 110.96(6) 1_445 . -1_656 n
Sr2 Br1 Sr2 180.0 1_445 . -1_666 n
Sr2 Br1 Sr2 106.53(12) 1_455 . 1_545 n
Sr2 Br1 Sr2 69.04(6) 1_455 . 1_555 n
Sr2 Br1 Sr2 110.96(6) 1_455 . -1_556 n
Sr2 Br1 Sr2 73.47(12) 1_455 . -1_566 n
Sr2 Br1 Sr2 180.0 1_455 . -1_656 n
Sr2 Br1 Sr2 110.96(6) 1_455 . -1_666 n
Sr2 Br1 Sr2 69.04(6) 1_545 . 1_555 n
Sr2 Br1 Sr2 110.96(6) 1_545 . -1_556 n
Sr2 Br1 Sr2 180.0 1_545 . -1_566 n
Sr2 Br1 Sr2 73.47(12) 1_545 . -1_656 n
Sr2 Br1 Sr2 110.96(6) 1_545 . -1_666 n
Sr2 Br1 Sr2 180.0 1_555 . -1_556 n
Sr2 Br1 Sr2 110.96(6) 1_555 . -1_566 n
Sr2 Br1 Sr2 110.96(6) 1_555 . -1_656 n
Sr2 Br1 Sr2 73.47(12) 1_555 . -1_666 n
Sr2 Br1 Sr2 69.04(6) -1_556 . -1_566 n
Sr2 Br1 Sr2 69.04(6) -1_556 . -1_656 n
Sr2 Br1 Sr2 106.53(12) -1_556 . -1_666 n
Sr2 Br1 Sr2 106.53(12) -1_566 . -1_656 n
Sr2 Br1 Sr2 69.04(6) -1_566 . -1_666 n
Sr2 Br1 Sr2 69.04(6) -1_656 . -1_666 n
Nb1 O1 Nb1 180.0 1_555 . -1_665 n
Nb1 O2 Nb1 172.2(5) 1_455 . 1_555 n
Sr1 O3 Sr1 85.28(9) 1_555 . 1_565 n
Sr1 O3 Sr1 85.28(9) 1_555 . 1_655 n
Sr1 O3 Sr1 146.67(33) 1_555 . 1_665 n
Sr1 O3 Nb1 106.67(17) 1_555 . 1_555 n
Sr1 O3 Sr1 146.67(33) 1_565 . 1_655 n
Sr1 O3 Sr1 85.28(9) 1_565 . 1_665 n
Sr1 O3 Nb1 106.67(17) 1_565 . 1_555 n
Sr1 O3 Sr1 85.28(9) 1_655 . 1_665 n
Sr1 O3 Nb1 106.67(17) 1_655 . 1_555 n
Sr1 O3 Nb1 106.67(17) 1_665 . 1_555 n
Bi2 O4 Bi2 110.96(32) 1_555 . 1_565 n
Bi2 O4 Sr1 0.0 1_555 . 1_555 n
Bi2 O4 Sr1 110.96(32) 1_555 . 1_565 n
Bi2 O4 Bi3 105.85(7) 1_555 . 1_455 n
Bi2 O4 Bi3 105.85(7) 1_555 . 1_555 n
Bi2 O4 Sr2 105.85(7) 1_555 . 1_455 n
Bi2 O4 Sr2 105.85(7) 1_555 . 1_555 n
Bi2 O4 Sr1 110.96(32) 1_565 . 1_555 n
Bi2 O4 Sr1 0.0 1_565 . 1_565 n
Bi2 O4 Bi3 105.85(7) 1_565 . 1_455 n
Bi2 O4 Bi3 105.85(7) 1_565 . 1_555 n
Bi2 O4 Sr2 105.85(7) 1_565 . 1_455 n
Bi2 O4 Sr2 105.85(7) 1_565 . 1_555 n
Sr1 O4 Sr1 110.96(32) 1_555 . 1_565 n
Sr1 O4 Bi3 105.85(7) 1_555 . 1_455 n
Sr1 O4 Bi3 105.85(7) 1_555 . 1_555 n
Sr1 O4 Sr2 105.85(7) 1_555 . 1_455 n
Sr1 O4 Sr2 105.85(7) 1_555 . 1_555 n
Sr1 O4 Bi3 105.85(7) 1_565 . 1_455 n
Sr1 O4 Bi3 105.85(7) 1_565 . 1_555 n
Sr1 O4 Sr2 105.85(7) 1_565 . 1_455 n
Sr1 O4 Sr2 105.85(7) 1_565 . 1_555 n
Bi3 O4 Bi3 122.36(26) 1_455 . 1_555 n
Bi3 O4 Sr2 0.0 1_455 . 1_455 n
Bi3 O4 Sr2 122.36(26) 1_455 . 1_555 n
Bi3 O4 Sr2 122.36(26) 1_555 . 1_455 n
Bi3 O4 Sr2 0.0 1_555 . 1_555 n
Sr2 O4 Sr2 122.36(26) 1_455 . 1_555 n
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Bi1 Nb1 3.4874(32) . 1_445 n
Bi1 Nb1 3.4874(32) . 1_455 n
Bi1 Nb1 3.4874(32) . 1_545 n
Bi1 Nb1 3.4874(32) . 1_555 n
Bi1 Nb1 3.4874(32) . -1_555 n
Bi1 Nb1 3.4874(32) . -1_565 n
Bi1 Nb1 3.4874(32) . -1_655 n
Bi1 Nb1 3.4874(32) . -1_665 n
Bi1 O1 2.77403(5) . 1_445 n
Bi1 O1 2.77403(5) . 1_455 n
Bi1 O1 2.77403(5) . 1_545 n
Bi1 O1 2.77403(5) . 1_555 n
Bi1 O2 2.787(5) . 1_545 n
Bi1 O2 2.787(5) . 1_555 n
Bi1 O2 2.787(5) . 2_555 n
Bi1 O2 2.787(5) . 2_655 n
Bi1 O2 2.787(5) . -1_555 n
Bi1 O2 2.787(5) . -1_565 n
Bi1 O2 2.787(5) . -2_455 n
Bi1 O2 2.787(5) . -2_555 n
Bi2 Sr1 3.92306(7) . 1_455 n
Bi2 Sr1 3.92306(7) . 1_545 n
Bi2 Sr1 3.92306(7) . 1_565 n
Bi2 Sr1 3.92306(7) . 1_655 n
Bi2 Bi3 3.687(5) . 1_445 n
Bi2 Bi3 3.687(5) . 1_455 n
Bi2 Bi3 3.687(5) . 1_545 n
Bi2 Bi3 3.687(5) . 1_555 n
Bi2 Sr2 3.687(5) . 1_445 n
Bi2 Sr2 3.687(5) . 1_455 n
Bi2 Sr2 3.687(5) . 1_545 n
Bi2 Sr2 3.687(5) . 1_555 n
Bi2 O3 2.8957(25) . 1_445 n
Bi2 O3 2.8957(25) . 1_455 n
Bi2 O3 2.8957(25) . 1_545 n
Bi2 O3 2.8957(25) . 1_555 n
Bi2 O4 2.381(5) . 1_545 n
Bi2 O4 2.381(5) . 1_555 n
Bi2 O4 2.381(5) . 2_555 n
Bi2 O4 2.381(5) . 2_655 n
Sr1 Bi2 3.92306(7) . 1_455 n
Sr1 Bi2 3.92306(7) . 1_545 n
Sr1 Bi2 3.92306(7) . 1_565 n
Sr1 Bi2 3.92306(7) . 1_655 n
Sr1 Sr1 3.92306(7) . 1_455 n
Sr1 Sr1 3.92306(7) . 1_545 n
Sr1 Sr1 3.92306(7) . 1_565 n
Sr1 Sr1 3.92306(7) . 1_655 n
Sr1 Bi3 3.687(5) . 1_445 n
Sr1 Bi3 3.687(5) . 1_455 n
Sr1 Bi3 3.687(5) . 1_545 n
Sr1 Bi3 3.687(5) . 1_555 n
Sr1 Sr2 3.687(5) . 1_445 n
Sr1 Sr2 3.687(5) . 1_455 n
Sr1 Sr2 3.687(5) . 1_545 n
Sr1 Sr2 3.687(5) . 1_555 n
Sr1 Nb1 3.865(5) . 1_445 n
Sr1 Nb1 3.865(5) . 1_455 n
Sr1 Nb1 3.865(5) . 1_545 n
Sr1 Nb1 3.865(5) . 1_555 n
Sr1 O2 3.439(7) . 1_545 n
Sr1 O2 3.439(7) . 1_555 n
Sr1 O2 3.439(7) . 2_555 n
Sr1 O2 3.439(7) . 2_655 n
Sr1 O3 2.8957(25) . 1_445 n
Sr1 O3 2.8957(25) . 1_455 n
Sr1 O3 2.8957(25) . 1_545 n
Sr1 O3 2.8957(25) . 1_555 n
Sr1 O4 2.381(5) . 1_545 n
Sr1 O4 2.381(5) . 1_555 n
Sr1 O4 2.381(5) . 2_555 n
Sr1 O4 2.381(5) . 2_655 n
Bi3 Bi2 3.687(5) . 1_555 n
Bi3 Bi2 3.687(5) . 1_565 n
Bi3 Bi2 3.687(5) . 1_655 n
Bi3 Bi2 3.687(5) . 1_665 n
Bi3 Sr1 3.687(5) . 1_555 n
Bi3 Sr1 3.687(5) . 1_565 n
Bi3 Sr1 3.687(5) . 1_655 n
Bi3 Sr1 3.687(5) . 1_665 n
Bi3 Sr2 3.92306(7) . 1_455 n
Bi3 Sr2 3.92306(7) . 1_545 n
Bi3 Sr2 3.92306(7) . 1_565 n
Bi3 Sr2 3.92306(7) . 1_655 n
Bi3 Sr2 4.141(9) . -1_666 n
Bi3 Br1 3.4614(28) . 1_555 n
Bi3 Br1 3.4614(28) . 1_565 n
Bi3 Br1 3.4614(28) . 1_655 n
Bi3 Br1 3.4614(28) . 1_665 n
Bi3 O4 2.2389(28) . 1_555 n
Bi3 O4 2.2389(28) . 1_655 n
Bi3 O4 2.2389(28) . 2_655 n
Bi3 O4 2.2389(28) . 2_665 n
Sr2 Bi2 3.687(5) . 1_555 n
Sr2 Bi2 3.687(5) . 1_565 n
Sr2 Bi2 3.687(5) . 1_655 n
Sr2 Bi2 3.687(5) . 1_665 n
Sr2 Sr1 3.687(5) . 1_555 n
Sr2 Sr1 3.687(5) . 1_565 n
Sr2 Sr1 3.687(5) . 1_655 n
Sr2 Sr1 3.687(5) . 1_665 n
Sr2 Bi3 3.92306(7) . 1_455 n
Sr2 Bi3 3.92306(7) . 1_545 n
Sr2 Bi3 3.92306(7) . 1_565 n
Sr2 Bi3 3.92306(7) . 1_655 n
Sr2 Bi3 4.141(9) . -1_666 n
Sr2 Sr2 3.92306(7) . 1_455 n
Sr2 Sr2 3.92306(7) . 1_545 n
Sr2 Sr2 3.92306(7) . 1_565 n
Sr2 Sr2 3.92306(7) . 1_655 n
Sr2 Sr2 4.141(9) . -1_666 n
Sr2 Br1 3.4614(28) . 1_555 n
Sr2 Br1 3.4614(28) . 1_565 n
Sr2 Br1 3.4614(28) . 1_655 n
Sr2 Br1 3.4614(28) . 1_665 n
Sr2 O3 3.259(7) . 1_555 n
Sr2 O4 2.2389(28) . 1_555 n
Sr2 O4 2.2389(28) . 1_655 n
Sr2 O4 2.2389(28) . 2_655 n
Sr2 O4 2.2389(28) . 2_665 n
Nb1 Bi1 3.4874(32) . 1_555 n
Nb1 Bi1 3.4874(32) . 1_565 n
Nb1 Bi1 3.4874(32) . 1_655 n
Nb1 Bi1 3.4874(32) . 1_665 n
Nb1 Sr1 3.865(5) . 1_555 n
Nb1 Sr1 3.865(5) . 1_565 n
Nb1 Sr1 3.865(5) . 1_655 n
Nb1 Sr1 3.865(5) . 1_665 n
Nb1 O1 2.114(5) . 1_555 n
Nb1 O2 1.9661(5) . 1_555 n
Nb1 O2 1.9661(5) . 1_655 n
Nb1 O2 1.9661(5) . 2_655 n
Nb1 O2 1.9661(5) . 2_665 n
Nb1 O3 1.861(8) . 1_555 n
Br1 Bi3 3.4614(28) . 1_445 n
Br1 Bi3 3.4614(28) . 1_455 n
Br1 Bi3 3.4614(28) . 1_545 n
Br1 Bi3 3.4614(28) . 1_555 n
Br1 Bi3 3.4614(28) . -1_556 n
Br1 Bi3 3.4614(28) . -1_566 n
Br1 Bi3 3.4614(28) . -1_656 n
Br1 Bi3 3.4614(28) . -1_666 n
Br1 Sr2 3.4614(28) . 1_445 n
Br1 Sr2 3.4614(28) . 1_455 n
Br1 Sr2 3.4614(28) . 1_545 n
Br1 Sr2 3.4614(28) . 1_555 n
Br1 Sr2 3.4614(28) . -1_556 n
Br1 Sr2 3.4614(28) . -1_566 n
Br1 Sr2 3.4614(28) . -1_656 n
Br1 Sr2 3.4614(28) . -1_666 n
O1 Bi1 2.77403(5) . 1_555 n
O1 Bi1 2.77403(5) . 1_565 n
O1 Bi1 2.77403(5) . 1_655 n
O1 Bi1 2.77403(5) . 1_665 n
O1 Nb1 2.114(5) . 1_555 n
O1 Nb1 2.114(5) . -1_665 n
O2 Bi1 2.787(5) . 1_555 n
O2 Bi1 2.787(5) . 1_565 n
O2 Sr1 3.439(7) . 1_555 n
O2 Sr1 3.439(7) . 1_565 n
O2 Nb1 1.9661(5) . 1_455 n
O2 Nb1 1.9661(5) . 1_555 n
O3 Bi2 2.8957(25) . 1_555 n
O3 Bi2 2.8957(25) . 1_565 n
O3 Bi2 2.8957(25) . 1_655 n
O3 Bi2 2.8957(25) . 1_665 n
O3 Sr1 2.8957(25) . 1_555 n
O3 Sr1 2.8957(25) . 1_565 n
O3 Sr1 2.8957(25) . 1_655 n
O3 Sr1 2.8957(25) . 1_665 n
O3 Sr2 3.259(7) . 1_555 n
O3 Nb1 1.861(8) . 1_555 n
O4 Bi2 2.381(5) . 1_555 n
O4 Bi2 2.381(5) . 1_565 n
O4 Sr1 2.381(5) . 1_555 n
O4 Sr1 2.381(5) . 1_565 n
O4 Bi3 2.2389(28) . 1_455 n
O4 Bi3 2.2389(28) . 1_555 n
O4 Sr2 2.2389(28) . 1_455 n
O4 Sr2 2.2389(28) . 1_555 n
loop_
_pd_meas_counts_total
_pd_proc_ls_weight
_pd_proc_intensity_bkg_calc
_pd_calc_intensity_total
29.0 0.0 461.80746 .
20.0 0.0 461.61520 .
20.0 0.0 461.42029 .
16.0 0.0 461.22275 .
14.0 0.0 461.02258 .
18.0 0.0 460.81982 .
21.0 0.0 460.61456 .
22.0 0.0 460.40680 .
16.0 0.0 460.19656 .
25.0 0.0 459.98389 .
24.0 0.0 459.76883 .
26.0 0.0 459.55142 .
27.0 0.0 459.33167 .
21.0 0.0 459.10965 .
17.0 0.0 458.88538 .
16.0 0.0 458.65884 .
21.0 0.0 458.43018 .
22.0 0.0 458.19931 .
22.0 0.0 457.96637 .
21.0 0.0 457.73129 .
17.0 0.0 457.49420 .
16.0 0.0 457.25507 .
27.0 0.0 457.01392 .
15.0 0.0 456.77084 .
11.0 0.0 456.52582 .
24.0 0.0 456.27890 .
25.0 0.0 456.03012 .
26.0 0.0 455.77948 .
26.0 0.0 455.52707 .
34.0 0.0 455.27289 .
39.0 0.0 455.01694 .
50.0 0.0 454.75928 .
66.0 0.0 454.49994 .
83.0 0.0 454.23895 .
118.0 0.0 453.97632 .
129.0 0.0 453.71210 .
122.0 0.0 453.44632 .
142.0 0.0 453.17899 .
209.0 0.0 452.91016 .
277.0 0.0 452.63983 .
330.0 0.0 452.36804 .
413.0 0.0 452.09485 .
427.0 0.0 451.82025 .
504.0 0.0 451.54425 .
520.0 0.0 451.26694 .
575.0 0.0 450.98828 .
615.0 0.0 450.70834 .
642.0 0.0 450.42712 .
656.0 0.0 450.14468 .
714.0 0.0 449.86102 .
830.0 0.0 449.57617 .
863.0 0.0 449.29013 .
869.0 0.0 449.00296 .
862.0 0.0 448.71469 .
878.0 0.0 448.42535 .
890.0 0.0 448.13492 .
873.0 0.0 447.84344 .
933.0 0.0 447.55096 .
907.0 0.0 447.25748 .
957.0 0.0 446.96304 .
981.0 0.0 446.66763 .
994.0 0.0 446.37134 .
960.0 0.0 446.07413 .
970.0 0.0 445.77603 .
963.0 0.0 445.47708 .
1011.0 0.0 445.17731 .
1037.0 0.0 444.87674 .
953.0 0.0 444.57538 .
1082.0 0.0 444.27328 .
1002.0 0.0 443.97040 .
1038.0 0.0 443.66681 .
1036.0 0.0 443.36252 .
1077.0 0.0 443.05756 .
1072.0 0.0 442.75192 .
1064.0 0.0 442.44568 .
1078.0 0.0 442.13882 .
1073.0 0.0 441.83136 .
1145.0 0.0 441.52332 .
1101.0 0.0 441.21472 .
1110.0 0.0 440.90561 .
1120.0 0.0 440.59595 .
1131.0 0.0 440.28583 .
1169.0 0.0 439.97522 .
1205.0 0.0 439.66415 .
1235.0 0.0 439.35266 .
1252.0 0.0 439.04071 .
1258.0 0.0 438.72842 .
1217.0 0.0 438.41571 .
1316.0 0.0 438.10263 .
1330.0 0.0 437.78925 .
1356.0 0.0 437.47552 .
1433.0 0.0 437.16147 .
1468.0 0.0 436.84714 .
1605.0 0.0 436.53256 .
1626.0 0.0 436.21768 .
1662.0 0.0 435.90262 .
1689.0 0.0 435.58728 .
1634.0 0.0 435.27176 .
1592.0 0.0 434.95605 .
1549.0 0.0 434.64017 .
1470.0 0.0 434.32416 .
1376.0 0.0 434.00797 .
1247.0 0.0 433.69168 .
1089.0 0.0 433.37527 .
968.0 0.0 433.05881 .
882.0 0.0 432.74222 .
771.0 0.0 432.42560 .
660.0 0.0 432.10892 .
593.0 0.0 431.79224 .
595.0 0.0 431.47552 .
569.0 0.0 431.15881 .
534.0 0.0 430.84210 .
544.0 0.0 430.52545 .
531.0 0.0 430.20883 .
542.0 0.0 429.89227 .
527.0 0.0 429.57578 .
515.0 0.0 429.25937 .
498.0 0.0 428.94305 .
505.0 0.0 428.62689 .
513.0 0.0 428.31082 .
520.0 0.0 427.99490 .
518.0 0.0 427.67914 .
493.0 0.0 427.36356 .
461.0 0.0 427.04813 .
458.0 0.0 426.73291 .
467.0 0.0 426.41791 .
474.0 0.0 426.10309 .
495.0 0.0 425.78854 .
475.0 0.0 425.47421 .
454.0 0.0 425.16016 .
469.0 0.0 424.84634 .
466.0 0.0 424.53284 .
462.0 0.0 424.21960 .
455.0 0.0 423.90668 .
464.0 0.0 423.59409 .
463.0 0.0 423.28180 .
448.0 0.0 422.96985 .
481.0 0.0 422.65823 .
478.0 0.0 422.34702 .
472.0 0.0 422.03613 .
452.0 0.0 421.72565 .
483.0 0.0 421.41556 .
421.0 0.0 421.10587 .
448.0 0.0 420.79660 .
445.0 0.0 420.48773 .
442.0 0.0 420.17932 .
443.0 0.002257 419.87134 425.67950
460.0 0.002174 419.56381 425.19623
434.0 0.002304 419.25674 424.72568
436.0 0.002294 418.95013 424.26709
444.0 0.002252 418.64404 423.82004
484.0 0.002066 418.33841 423.38397
404.0 0.002475 418.03329 422.95859
423.0 0.002364 417.72870 422.54346
451.0 0.002217 417.42459 422.13846
457.0 0.002188 417.12103 421.74362
428.0 0.002336 416.81802 421.35886
403.0 0.002481 416.51553 420.98453
448.0 0.002232 416.21362 420.62100
457.0 0.002188 415.91226 420.26883
422.0 0.002370 415.61145 419.92868
426.0 0.002347 415.31125 419.60129
415.0 0.002410 415.01163 419.28723
391.0 0.002558 414.71259 418.98669
412.0 0.002427 414.41418 418.69897
423.0 0.002364 414.11636 418.42233
409.0 0.002445 413.81915 418.15329
419.0 0.002387 413.52258 417.88666
417.0 0.002398 413.22668 417.61542
445.0 0.002247 412.93140 417.33066
403.0 0.002481 412.63675 417.02255
443.0 0.002257 412.34277 416.68124
408.0 0.002451 412.04944 416.29855
390.0 0.002564 411.75681 415.87134
410.0 0.002439 411.46484 415.40369
436.0 0.002294 411.17355 414.90723
381.0 0.002625 410.88297 414.39761
423.0 0.002364 410.59308 413.89011
406.0 0.002463 410.30389 413.39624
398.0 0.002513 410.01541 412.92355
438.0 0.002283 409.72766 412.47574
408.0 0.002451 409.44064 412.05359
423.0 0.002364 409.15433 411.65573
378.0 0.002646 408.86877 411.27942
403.0 0.002481 408.58395 410.92130
411.0 0.002433 408.29987 410.57791
395.0 0.002532 408.01654 410.24615
420.0 0.002381 407.73401 409.92352
414.0 0.002415 407.45221 409.60806
427.0 0.002342 407.17120 409.29837
381.0 0.002625 406.89096 408.99347
367.0 0.002725 406.61148 408.69284
414.0 0.002415 406.33282 408.39603
402.0 0.002488 406.05493 408.10294
402.0 0.002488 405.77786 407.81345
379.0 0.002639 405.50159 407.52756
383.0 0.002611 405.22610 407.24536
365.0 0.002740 404.95145 406.96698
384.0 0.002604 404.67761 406.69260
386.0 0.002591 404.40460 406.42245
404.0 0.002475 404.13242 406.15698
388.0 0.002577 403.86105 405.89673
420.0 0.002381 403.59055 405.64258
396.0 0.002525 403.32086 405.39542
397.0 0.002519 403.05203 405.15683
363.0 0.002755 402.78406 404.92868
377.0 0.002653 402.51691 404.71332
403.0 0.002481 402.25064 404.51367
371.0 0.002695 401.98523 404.33337
417.0 0.002398 401.72070 404.17609
398.0 0.002513 401.45703 404.04626
394.0 0.002538 401.19421 403.94827
350.0 0.002857 400.93228 403.88608
396.0 0.002525 400.67126 403.86316
416.0 0.002404 400.41110 403.88153
390.0 0.002564 400.15182 403.94214
424.0 0.002358 399.89343 404.04581
391.0 0.002558 399.63596 404.19412
392.0 0.002551 399.37936 404.38922
423.0 0.002364 399.12369 404.63049
390.0 0.002564 398.86890 404.91440
382.0 0.002618 398.61502 405.23782
388.0 0.002577 398.36206 405.60242
411.0 0.002433 398.11002 406.01389
414.0 0.002415 397.85886 406.47528
391.0 0.002558 397.60864 406.98447
415.0 0.002410 397.35934 407.54001
401.0 0.002494 397.11096 408.14902
415.0 0.002410 396.86353 408.82318
401.0 0.002494 396.61700 409.56931
423.0 0.002364 396.37143 410.38818
424.0 0.002358 396.12677 411.28589
433.0 0.002309 395.88306 412.28006
416.0 0.002404 395.64029 413.39081
437.0 0.002288 395.39847 414.63187
413.0 0.002421 395.15756 416.01889
473.0 0.002114 394.91763 417.58167
449.0 0.002227 394.67862 419.35831
454.0 0.002203 394.44058 421.38196
457.0 0.002188 394.20349 423.68204
468.0 0.002137 393.96735 426.28992
489.0 0.002045 393.73215 429.22501
530.0 0.001887 393.49792 432.47406
459.0 0.002179 393.26465 435.98361
483.0 0.002070 393.03232 439.65182
516.0 0.001938 392.80096 443.31277
486.0 0.002058 392.57059 446.73080
543.0 0.001842 392.34116 449.60858
524.0 0.001908 392.11270 451.60022
517.0 0.001934 391.88519 452.34174
555.0 0.001802 391.65869 451.51242
528.0 0.001894 391.43314 448.93182
525.0 0.001905 391.20856 444.66782
511.0 0.001957 390.98492 439.07544
436.0 0.002294 390.76230 432.70389
442.0 0.002262 390.54062 426.12628
418.0 0.002392 390.31995 419.80872
382.0 0.002618 390.10022 414.06543
425.0 0.002353 389.88150 409.06979
409.0 0.002445 389.66373 404.88260
387.0 0.002584 389.44696 401.48166
393.0 0.002545 389.23114 398.23459
405.0 0.002469 389.01633 396.14877
344.0 0.002907 388.80249 394.73956
351.0 0.002849 388.58963 393.50809
349.0 0.002865 388.37775 392.54901
389.0 0.002571 388.16687 391.78439
345.0 0.002899 387.95694 391.15570
372.0 0.002688 387.74802 390.62115
359.0 0.002786 387.54007 390.15775
382.0 0.002618 387.33310 389.73544
381.0 0.002625 387.12714 389.34744
379.0 0.002639 386.92212 388.98566
389.0 0.002571 386.71811 388.64481
362.0 0.002762 386.51508 388.32120
401.0 0.002494 386.31305 388.01212
361.0 0.002770 386.11200 387.71570
366.0 0.002732 385.91193 387.43018
375.0 0.002667 385.71283 387.15439
362.0 0.002762 385.51471 386.88715
386.0 0.002591 385.31760 386.62769
358.0 0.002793 385.12146 386.37512
349.0 0.002865 384.92630 386.12885
366.0 0.002732 384.73215 385.88828
361.0 0.002770 384.53894 385.65292
361.0 0.002770 384.34674 385.42236
397.0 0.002519 384.15552 385.19620
408.0 0.002451 383.96527 384.97415
372.0 0.002688 383.77603 384.75589
356.0 0.002809 383.58774 384.54123
335.0 0.002985 383.40045 384.32983
369.0 0.002710 383.21414 384.12161
361.0 0.002770 383.02881 383.91635
392.0 0.002551 382.84445 383.71396
398.0 0.002513 382.66107 383.51419
397.0 0.002519 382.47867 383.31705
365.0 0.002740 382.29724 383.12234
395.0 0.002532 382.11679 382.92999
375.0 0.002667 381.93732 382.73990
359.0 0.002786 381.75882 382.55197
381.0 0.002625 381.58130 382.36621
364.0 0.002747 381.40475 382.18250
346.0 0.002890 381.22916 382.00082
367.0 0.002725 381.05457 381.82111
372.0 0.002688 380.88092 381.64328
357.0 0.002801 380.70825 381.46741
367.0 0.002725 380.53653 381.29333
388.0 0.002577 380.36578 381.12109
367.0 0.002725 380.19604 380.95068
406.0 0.002463 380.02722 380.78052
365.0 0.002740 379.85938 380.61362
374.0 0.002674 379.69250 380.44849
365.0 0.002740 379.52658 380.28510
394.0 0.002538 379.36160 380.12344
375.0 0.002667 379.19760 379.96347
375.0 0.002667 379.03458 379.80527
360.0 0.002778 378.87247 379.64880
368.0 0.002717 378.71133 379.49399
387.0 0.002584 378.55115 379.34094
349.0 0.002865 378.39191 379.18964
361.0 0.002770 378.23364 379.04004
367.0 0.002725 378.07629 378.89221
384.0 0.002604 377.91992 378.74615
358.0 0.002793 377.76447 378.60190
374.0 0.002674 377.60999 378.45947
374.0 0.002674 377.45642 378.31888
353.0 0.002833 377.30380 378.18015
389.0 0.002571 377.15213 378.04327
375.0 0.002667 377.00140 377.90842
376.0 0.002660 376.85159 377.77545
371.0 0.002695 376.70273 377.64456
359.0 0.002786 376.55478 377.51569
374.0 0.002674 376.40778 377.38895
381.0 0.002625 376.26169 377.26437
357.0 0.002801 376.11655 377.14203
382.0 0.002618 375.97232 377.02194
421.0 0.002375 375.82901 376.90430
393.0 0.002545 375.68665 376.78903
356.0 0.002809 375.54517 376.67639
384.0 0.002604 375.40463 376.56635
401.0 0.002494 375.26501 376.45908
363.0 0.002755 375.12628 376.35464
385.0 0.002597 374.98849 376.25320
392.0 0.002551 374.85159 376.15497
359.0 0.002786 374.71561 376.05997
361.0 0.002770 374.58054 375.96921
356.0 0.002809 374.44635 375.88141
369.0 0.002710 374.31308 375.79742
391.0 0.002558 374.18073 375.71756
348.0 0.002874 374.04926 375.64200
364.0 0.002747 373.91867 375.57114
358.0 0.002793 373.78897 375.50519
342.0 0.002924 373.66019 375.44461
349.0 0.002865 373.53229 375.38971
355.0 0.002817 373.40527 375.34100
394.0 0.002538 373.27914 375.29898
369.0 0.002710 373.15390 375.26410
368.0 0.002717 373.02951 375.23715
366.0 0.002732 372.90604 375.21881
351.0 0.002849 372.78342 375.20990
380.0 0.002632 372.66168 375.21143
388.0 0.002577 372.54080 375.22452
362.0 0.002762 372.42081 375.25049
363.0 0.002755 372.30167 375.29099
396.0 0.002525 372.18341 375.34805
341.0 0.002933 372.06598 375.42426
357.0 0.002801 371.94946 375.52301
366.0 0.002732 371.83377 375.64877
384.0 0.002604 371.71893 375.80765
380.0 0.002632 371.60495 376.00769
396.0 0.002525 371.49182 376.26010
381.0 0.002625 371.37955 376.57950
363.0 0.002755 371.26810 376.98483
375.0 0.002667 371.15750 377.50000
375.0 0.002667 371.04776 378.15405
391.0 0.002558 370.93884 378.98132
391.0 0.002558 370.83078 380.02112
412.0 0.002427 370.72351 381.31717
375.0 0.002667 370.61710 382.91608
415.0 0.002410 370.51151 384.86447
426.0 0.002347 370.40677 387.20395
431.0 0.002320 370.30283 389.96762
405.0 0.002469 370.19971 393.18301
445.0 0.002247 370.09741 396.88528
461.0 0.002169 369.99594 401.13025
432.0 0.002315 369.89526 405.98737
442.0 0.002262 369.79541 411.51376
510.0 0.001961 369.69638 417.74329
470.0 0.002128 369.59814 424.66208
507.0 0.001972 369.50070 432.49564
504.0 0.001984 369.40405 441.35614
494.0 0.002024 369.30823 451.39886
518.0 0.001931 369.21317 462.69653
590.0 0.001695 369.11893 475.26205
593.0 0.001686 369.02545 489.09116
611.0 0.001637 368.93280 504.08856
634.0 0.001577 368.84091 519.91638
606.0 0.001650 368.74979 535.94684
677.0 0.001477 368.65948 551.33594
667.0 0.001499 368.56992 565.04712
714.0 0.001401 368.48114 575.81604
646.0 0.001548 368.39316 582.22864
699.0 0.001431 368.30591 582.94403
637.0 0.001570 368.21945 577.02362
680.0 0.001471 368.13373 564.37115
613.0 0.001631 368.04880 546.03979
576.0 0.001736 367.96463 524.02191
552.0 0.001812 367.88120 500.59567
461.0 0.002169 367.79852 477.71277
471.0 0.002123 367.71658 456.73468
419.0 0.002387 367.63541 438.44479
412.0 0.002427 367.55499 423.15921
425.0 0.002353 367.47528 410.84796
448.0 0.002232 367.39633 401.24670
377.0 0.002653 367.31812 393.95715
397.0 0.002519 367.24063 388.53186
436.0 0.002294 367.16388 384.53833
401.0 0.002494 367.08786 381.59943
403.0 0.002481 367.01257 379.56284
400.0 0.002500 366.93802 377.89960
429.0 0.002331 366.86417 376.59555
387.0 0.002584 366.79102 375.53955
411.0 0.002433 366.71860 374.65805
408.0 0.002451 366.64691 373.90344
399.0 0.002506 366.57590 373.24490
387.0 0.002584 366.50562 372.66193
361.0 0.002770 366.43604 372.14047
379.0 0.002639 366.36716 371.67044
352.0 0.002841 366.29898 371.24423
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