#------------------------------------------------------------------------------ #$Date: 2016-12-06 01:40:23 +0200 (Tue, 06 Dec 2016) $ #$Revision: 188929 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/30/06/2300627.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_2300627 _audit_creation_date 16-03-15 _audit_creation_method CRYSTALS _cell_angle_alpha 90 _cell_angle_beta 113.360(3) _cell_angle_gamma 90 _cell_length_a 14.2061(4) _cell_length_b 12.6581(3) _cell_length_c 17.5097(4) _cod_data_source_file kc5042TR_SAC1sup5.hkl _cod_data_source_block TR_SAC1 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,-z -x,y+1/2,-z+1/2 x,-y+1/2,z+1/2 loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_F_squared_sigma _refln_observed_status _refln_refinement_weight 2 0 0 3599.35 3411.74 86.01 o 0.2071E-04 3 0 0 4172.74 4476.40 106.90 o 0.1408E-04 4 0 0 2653.33 2869.37 88.24 o 0.2575E-04 5 0 0 645.72 612.98 44.93 o 0.2466E-03 6 0 0 3324.46 3088.76 120.32 o 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