#------------------------------------------------------------------------------ #$Date: 2016-04-02 21:48:25 +0300 (Sat, 02 Apr 2016) $ #$Revision: 180804 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/35/2013599.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_2013599_Fobs loop_ _publ_author_name 'Atria, Ana Mar\'ia' 'Mu\~noz, Juan Carlos' 'Soto, Andr\'es' 'Garland, Mar\'ia Teresa' 'Baggio, Ricardo' _publ_section_title ; Three yttrium crotonate complexes with diimines ; _journal_issue 10 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first m416 _journal_page_last m420 _journal_volume 59 _journal_year 2003 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 78.966 _cell_angle_beta 71.685 _cell_angle_gamma 77.256 _cell_length_a 10.5565 _cell_length_b 10.9994 _cell_length_c 11.4194 _exptl_crystal_F_000 556.00 _reflns_d_resolution_high 0.7556 _cod_data_source_file ga1033Isup2.hkl _cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' (1) in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 190.43 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' 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 1 0 0 23606.62 22104.05 245.04 o 2 0 0 946.42 1184.65 51.31 o 3 0 0 42.84 51.49 44.13 o 4 0 0 714.72 690.34 74.57 o 5 0 0 1829.82 1897.61 278.23 o 6 0 0 1755.50 1693.12 86.25 o 7 0 0 972.15 829.09 105.92 o 8 0 0 744.06 681.15 112.54 o 9 0 0 277.07 359.88 172.95 o 10 0 0 616.10 515.55 184.72 o 11 0 0 62.37 70.16 161.09 o 12 0 0 25.15 -1.20 165.78 o -12 1 0 3.85 63.08 179.57 o -11 1 0 76.83 85.60 163.57 o -10 1 0 11.59 -69.60 130.20 o -9 1 0 151.43 127.81 140.96 o -8 1 0 265.01 230.42 157.51 o -7 1 0 388.90 410.82 151.90 o -6 1 0 894.24 659.72 155.67 o -5 1 0 94.99 108.31 29.79 o -4 1 0 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