#------------------------------------------------------------------------------
#$Date: 2009-11-11 20:41:08 +0200 (Wed, 11 Nov 2009) $
#$Revision: 840 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2104471.hkl $
#------------------------------------------------------------------------------
#
# 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_2104471_Fobs
loop_
_publ_author_name
'Wahl, B.'
'Ruck, M.'
_publ_section_title
;
 Superspace description of the modulated structure of the
 metal-salt-hybrid Bi~7{-~\d}Ni~2~Br~5{-~2\d} (\d = 1/9)
;
_journal_coeditor_code           SN5087
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              593
_journal_page_last               599
_journal_volume                  65
_journal_year                    2009
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_[local]_cod_data_source_file    sn5087Bi7Ni2Br5simplifiedsup4.hkl
_[local]_cod_data_source_block   Bi7Ni2Br5simplified
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_intensity_meas
_refln_intensity_calc
_refln_intensity_sigma
_refln_observed_status
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1 1 0 407.6 256.5 72.6 o
3 1 0 850.9 716.7 47.5 o
0 2 0 17462.7 24082.5 1260.5 o
2 2 0 23802.4 21244.6 139.4 o
4 2 0 14394.6 13252.5 107.8 o
1 3 0 22177.5 19200.9 158.5 o
3 3 0 16412.8 14989.0 106.4 o
0 4 0 424.5 91.9 476.7 <
2 4 0 229.9 81.0 64.0 o
4 4 0 105.9 50.2 75.2 <
1 5 0 496238.0 388625.5 2576.0 o
3 5 0 128235.9 117408.9 658.4 o
0 6 0 23207.0 35757.2 377.7 o
2 6 0 22681.9 20767.1 146.1 o
4 6 0 7555.6 7523.2 93.3 o
1 7 0 2264.2 2069.3 116.8 o
3 7 0 208.7 97.2 62.3 o
0 8 0 2734.5 4668.2 208.4 o
2 8 0 7847.1 8002.6 102.8 o
4 8 0 8605.8 8581.3 103.9 o
1 9 0 96328.8 99637.6 564.6 o
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3 11 0 25607.5 24531.2 173.0 o
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2 12 0 2376.4 2059.9 99.3 o
4 12 0 241.9 125.9 128.5 <
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3 13 0 7064.1 7171.4 101.7 o
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2 22 0 364.8 208.9 101.6 o
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3 1 1 127.8 68.3 34.6 o
0 2 1 292.6 67.7 100.8 <
2 2 1 97.5 30.7 34.2 <
4 2 1 17.0 2.4 46.9 <
1 3 1 4599.8 3788.0 70.5 o
3 3 1 1285.8 1173.3 38.9 o
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2 4 1 610.0 482.4 40.7 o
4 4 1 177.8 109.9 61.7 <
1 5 1 780.6 726.6 77.1 o
3 5 1 85.3 23.5 43.4 <
0 6 1 144.9 66.6 218.0 <
2 6 1 354.8 292.7 44.8 o
4 6 1 635.8 476.6 72.4 o
1 7 1 252.5 115.3 99.2 <
3 7 1 38.0 10.3 49.0 <
0 8 1 52049.0 44429.6 429.4 o
2 8 1 22796.6 21557.7 152.0 o
4 8 1 4332.7 4352.9 72.1 o
1 9 1 7832.5 5701.7 133.7 o
3 9 1 2639.9 2000.9 57.4 o
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2 10 1 1697.0 95.5 63.0 o
4 10 1 472.7 98.9 60.3 o
1 11 1 6739.7 7005.6 101.5 o
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2 12 1 1540.4 1088.8 77.5 o
4 12 1 172.7 40.4 80.1 <
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4 14 1 3041.4 2986.2 80.5 o
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2 16 1 1396.4 1257.3 86.7 o
1 17 1 146.0 193.4 58.7 <
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1 19 1 11222.0 11177.9 81.1 o
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0 26 1 3.3 53.7 37.9 <
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3 1 2 132.1 61.3 46.5 <
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3 19 2 8256.0 8483.7 86.6 o
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2 20 2 227.0 88.9 93.2 <
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1 1 3 3253.1 2814.7 245.3 o
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2 2 3 1506.2 1366.3 160.1 o
4 2 3 97.7 65.0 117.7 <
1 3 3 29265.5 28539.4 175.6 o
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2 4 3 1528.3 1353.3 69.4 o
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3 17 3 5620.4 5855.6 70.2 o
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2 18 3 13820.6 14311.9 124.4 o
1 19 3 26174.8 26080.5 160.1 o
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1 21 3 4061.0 4078.6 59.3 o
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2 22 3 14593.4 16913.2 161.4 o
1 23 3 5815.8 6459.0 54.0 o
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1 25 3 629.6 540.7 36.3 o
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2 0 4 208.3 79.6 60.9 o
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