#------------------------------------------------------------------------------ #$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $ #$Revision: 26025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2100702.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_2100702_Fobs loop_ _publ_author_name 'van Mechelen, Jan B.' 'Peschar, Rene' 'Schenk, Henk' _publ_section_title ; Structures of mono-unsaturated triacylglycerols. II. The \b~2~ polymorph ; _journal_issue 6 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 1131 _journal_page_last 1138 _journal_volume 62 _journal_year 2006 _space_group_IT_number 9 _symmetry_space_group_name_Hall 'C -2yc' _symmetry_space_group_name_H-M 'C 1 c 1' _[local]_cod_data_source_file dr5012POS-B2_ENAN_publsup9.hkl _[local]_cod_data_source_block POS-B2-ENAN_publ loop_ _refln_index_h _refln_index_k _refln_index_l _refln_observed_status _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 0 2 0 o 7634.523 8325.438 180.00 63.26451 100.00 0 4 0 o 17227.990 15488.877 180.00 31.63225 56.42 0 6 0 o 451.899 217.121 180.00 21.08817 0.66 0 8 0 o 2534.942 3082.808 180.00 15.81613 2.08 0 10 0 o 7819.978 9316.547 180.00 12.65290 4.10 0 12 0 o 2979.995 4180.117 180.00 10.54409 1.08 0 14 0 o 755.372 134.282 180.00 9.03779 0.20 0 2 1 o 3638.162 3649.702 -122.20 8.05182 1.54 0 4 1 o 4887.252 4968.454 54.66 7.86303 1.98 0 6 1 o 1029.113 1078.021 -140.49 7.57590 0.39 0 16 0 o 3267.473 3405.775 180.00 7.90806 0.67 0 8 1 o 1851.465 2051.631 -124.87 7.22209 0.63 0 10 1 o 5257.901 4811.749 64.37 6.83252 1.61 0 18 0 o 8281.974 10105.186 180.00 7.02939 1.34 0 12 1 o 1545.349 1297.916 -127.05 6.43232 0.42 0 14 1 o 2507.232 2732.445 -153.32 6.03931 0.60 0 20 0 o 113.335 73.296 0.00 6.32645 0.01 0 16 1 o 2894.520 2320.203 86.26 5.66455 0.61 0 22 0 o 27.495 12.050 180.00 5.75132 0.00 0 18 1 o 603.051 651.973 -124.42 5.31400 0.11 1 5 0 o 1029.221 1144.545 -117.63 5.30208 0.19 1 3 0 o 28776.104 30324.396 69.46 5.37817 5.46 1 1 0 o 7470.958 7837.041 -90.05 5.41746 1.44 1 7 0 o 15140.166 14998.290 -77.12 5.19377 2.68 1 9 0 o 13515.867 13475.211 66.43 5.05917 2.27 0 20 1 o 2448.520 2745.295 -139.60 4.99005 0.40 0 24 0 o 12437.777 14370.305 180.00 5.27204 1.13 1 11 0 o 974.695 522.873 115.88 4.90477 0.15 1 13 0 o 13644.566 12024.731 -86.57 4.73692 2.01 0 22 1 o 3219.957 3302.129 142.81 4.69289 0.47 1 15 0 o 3288.267 3155.474 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