#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/56/2215686.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_2215686_Fobs
loop_
_publ_author_name
'Zatovsky, Igor V.'
'Strutynska, Nataliya Yu.'
'Baumer, Vyacheslav N.'
'Shishkin, Oleg V.'
'Slobodyanik, Nikolay S.'
_publ_section_title
;
 The whitlockite-related phosphate Ca~9~Cr(PO~4~)~7~
;
_journal_coeditor_code           WM2144
_journal_issue                   10
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i180
_journal_page_last               i181
_journal_volume                  63
_journal_year                    2007
_space_group_IT_number           161
_symmetry_space_group_name_Hall  'R 3 -2"c'
_symmetry_space_group_name_H-M   'R 3 c :H'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   10.3272
_cell_length_b                   10.3272
_cell_length_c                   37.1321
_exptl_crystal_F_000             3198.00
_reflns_d_resolution_high        0.7109
_[local]_cod_data_source_file    wm2144Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' r3c in R3c'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            1034.95
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-y, -x, z+1/2'
'-x+y, y, z+1/2'
'x, x-y, z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'-y+2/3, -x+1/3, z+5/6'
'-x+y+2/3, y+1/3, z+5/6'
'x+2/3, x-y+1/3, z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-y+1/3, -x+2/3, z+7/6'
'-x+y+1/3, y+2/3, z+7/6'
'x+1/3, x-y+2/3, z+7/6'
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_calc
_refln_F_squared_meas
_refln_F_squared_sigma
_refln_observed_status
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-5 7 -45 391.77 946.17 1158.02 o
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-6 6 -42 2294.78 1396.81 991.05 o
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0 6 -42 2915.84 3274.77 1165.20 o
-5 7 -42 11296.80 12002.12 1439.90 o
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-6 8 -41 1153.45 1560.19 1337.56 o
-3 8 -41 2305.39 1403.99 1378.85 o
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0 7 -40 11276.36 10009.25 1188.54 o
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-2 7 -39 517.69 1046.99 777.79 o
-7 8 -39 1274.69 112.42 726.33 o
-4 8 -39 605.37 649.93 1048.50 o
-1 8 -39 19231.34 19637.91 1032.59 o
-6 9 -39 1049.23 1479.39 1210.09 o
-3 9 -39 19947.49 19950.27 1630.21 o
-4 4 -38 1714.79 1885.15 974.89 o
-1 4 -38 3192.16 2854.66 870.76 o
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0 5 -38 79587.66 79082.94 1833.08 o
-5 6 -38 48179.52 47537.91 1082.20 o
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0 8 -38 36214.38 37047.69 1554.80 o
-8 9 -38 16815.56 15389.29 781.16 o
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-3 7 -37 580.89 1052.09 924.62 o
-5 8 -37 1143.91 633.77 1009.00 o
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0 6 -36 3517.42 2885.18 1111.34 o
-5 7 -36 15824.76 14958.07 664.97 o
-2 7 -36 92751.36 91855.33 2388.76 o
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0 9 -36 68700.21 71844.01 1491.71 o
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-2 4 -33 491.91 463.21 928.21 o
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-1 5 -33 43.90 117.45 653.15 o
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-1 8 -33 1771.34 2079.12 576.61 o
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-8 10 -33 4283.77 4508.64 717.46 o
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-2 10 -33 2656.13 2200.68 601.13 o
-7 11 -33 92.88 224.42 1569.16 o
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-2 3 -32 2569.03 2368.11 833.06 o
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0 5 -32 8800.88 8326.98 1048.50 o
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-3 10 -31 5706.42 4608.78 672.94 o
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-1 3 -28 13886.51 13034.39 680.71 o
-3 4 -28 17782.38 16938.08 539.16 o
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