data_4031306 _cell_angle_alpha 90 _cell_angle_beta 111.9157(20) _cell_angle_gamma 90 _cell_length_a 7.83392(20) _cell_length_b 15.49703(41) _cell_length_c 8.75018(24) _cod_data_source_file AgDETBA.fcf _cod_data_source_block a _shelx_f_squared_multiplier 1 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_phase_calc 0 2 0 10.26 10.39 180.00000 1 0 0 9.63 9.98 0.00000 0 1 1 18.06 18.85 0.00000 1 1 0 53.19 55.00 0.00000 1 -1 -1 1.05 1.01 180.00000 0 2 1 15.01 15.65 180.00000 1 2 0 0.29 0.28 0.00000 1 -2 -1 0.28 0.27 180.00000 1 1 1 6.46 6.09 0.00000 0 3 1 41.64 44.34 180.00000 1 0 -2 14.96 15.85 180.00000 1 3 0 3.87 4.04 180.00000 1 -1 -2 39.65 38.73 0.00000 1 -3 -1 20.32 20.13 0.00000 0 0 2 3.21 3.26 180.00000 1 2 1 7.20 6.34 0.00000 0 1 2 28.86 27.81 180.00000 0 4 0 0.35 0.35 180.00000 2 -1 -1 2.20 2.36 180.00000 1 -2 -2 7.80 8.06 180.00000 2 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