#------------------------------------------------------------------------------ #$Date: 2016-04-06 15:35:39 +0300 (Wed, 06 Apr 2016) $ #$Revision: 181862 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/1/52/94/1529480.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1529480 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 12.25619(10) _cell_length_b 12.25619(10) _cell_length_c 12.25619(10) _cod_data_source_file Ca3Ga2Ge3O12_Cr_Bi.fcf _cod_data_source_block a #BEGIN Tags that were not found in dictionaries: _shelx_f_squared_multiplier 1 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' '-x, -y+1/2, z' '-x, y, z+1/2' '-x, y+1/2, -z+1/2' '-x+1/4, -z+1/4, -y+1/4' '-x+1/4, -z-1/4, y-1/4' '-x+1/4, z+1/4, -y-1/4' '-x+1/4, z-1/4, y+1/4' '-x+1/2, -y, z+1/2' '-x+1/2, -y+1/2, -z+1/2' '-x+1/2, y, -z' '-x+1/2, y+1/2, z' '-x-1/4, -z+1/4, y+1/4' '-x-1/4, -z-1/4, -y-1/4' '-x-1/4, z+1/4, y-1/4' '-x-1/4, z-1/4, -y+1/4' '-y, -z, -x' '-y, -z+1/2, x' '-y, z, x+1/2' '-y, z+1/2, -x+1/2' '-y+1/4, -x+1/4, -z+1/4' '-y+1/4, -x-1/4, z-1/4' '-y+1/4, x+1/4, -z-1/4' '-y+1/4, x-1/4, z+1/4' '-y+1/2, -z, x+1/2' '-y+1/2, -z+1/2, -x+1/2' '-y+1/2, z, -x' '-y+1/2, z+1/2, x' '-y-1/4, -x+1/4, z+1/4' '-y-1/4, -x-1/4, -z-1/4' '-y-1/4, x+1/4, z-1/4' '-y-1/4, x-1/4, -z+1/4' '-z, -x, -y' '-z, -x+1/2, y' '-z, x, y+1/2' '-z, x+1/2, -y+1/2' '-z+1/4, -y+1/4, -x+1/4' '-z+1/4, -y-1/4, x-1/4' '-z+1/4, y+1/4, -x-1/4' '-z+1/4, y-1/4, x+1/4' '-z+1/2, -x, y+1/2' '-z+1/2, -x+1/2, -y+1/2' '-z+1/2, x, -y' '-z+1/2, x+1/2, y' '-z-1/4, -y+1/4, x+1/4' '-z-1/4, -y-1/4, -x-1/4' '-z-1/4, y+1/4, x-1/4' '-z-1/4, y-1/4, -x+1/4' 'z, -x, -y+1/2' 'z, -x+1/2, y+1/2' 'z, x, y' 'z, x+1/2, -y' 'z+1/4, -y+1/4, x-1/4' 'z+1/4, -y-1/4, -x+1/4' 'z+1/4, y+1/4, x+1/4' 'z+1/4, y-1/4, -x-1/4' 'z+1/2, -x, y' 'z+1/2, -x+1/2, -y' 'z+1/2, x, -y+1/2' 'z+1/2, x+1/2, y+1/2' 'z-1/4, -y+1/4, -x-1/4' 'z-1/4, -y-1/4, x+1/4' 'z-1/4, y+1/4, -x+1/4' 'z-1/4, y-1/4, x-1/4' 'y, -z, -x+1/2' 'y, -z+1/2, x+1/2' 'y, z, x' 'y, z+1/2, -x' 'y+1/4, -x+1/4, z-1/4' 'y+1/4, -x-1/4, -z+1/4' 'y+1/4, x+1/4, z+1/4' 'y+1/4, x-1/4, -z-1/4' 'y+1/2, -z, x' 'y+1/2, -z+1/2, -x' 'y+1/2, z, -x+1/2' 'y+1/2, z+1/2, x+1/2' 'y-1/4, -x+1/4, -z-1/4' 'y-1/4, -x-1/4, z+1/4' 'y-1/4, x+1/4, -z+1/4' 'y-1/4, x-1/4, z-1/4' 'x, -y, -z+1/2' 'x, -y+1/2, z+1/2' 'x, y+1/2, -z' 'x+1/4, -z+1/4, y-1/4' 'x+1/4, -z-1/4, -y+1/4' 'x+1/4, z+1/4, y+1/4' 'x+1/4, z-1/4, -y-1/4' 'x+1/2, -y, z' 'x+1/2, -y+1/2, -z' 'x+1/2, y, -z+1/2' 'x+1/2, y+1/2, z+1/2' 'x-1/4, -z+1/4, -y-1/4' 'x-1/4, -z-1/4, y+1/4' 'x-1/4, z+1/4, -y+1/4' 'x-1/4, z-1/4, y-1/4' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc 2 1 1 19.96 18.89 0.00000 0 2 2 10.83 10.30 0.00000 3 2 1 37.95 37.82 180.00000 0 0 4 225.76 224.35 0.00000 0 4 2 584.34 583.31 180.00000 3 3 2 98.78 91.79 180.00000 4 2 2 434.28 438.10 0.00000 4 3 1 45.25 42.76 0.00000 5 2 1 1.37 1.40 180.00000 0 4 4 0.82 0.87 180.00000 5 3 2 0.39 0.38 0.00000 6 1 1 10.87 10.65 0.00000 0 6 2 40.02 39.81 0.00000 5 4 1 1.14 1.20 0.00000 6 3 1 47.64 44.83 180.00000 4 4 4 153.00 150.50 180.00000 5 4 3 4.07 3.86 180.00000 0 6 4 544.78 539.93 0.00000 5 5 2 0.25 0.24 0.00000 6 3 3 8.92 8.50 0.00000 7 2 1 22.19 21.14 180.00000 6 4 2 1156.33 1146.96 0.00000 7 3 2 50.32 48.19 180.00000 6 5 1 10.16 9.73 180.00000 0 0 8 348.57 347.77 0.00000 7 4 1 12.31 12.44 0.00000 0 8 2 3.86 4.07 0.00000 6 5 3 52.75 52.82 0.00000 8 2 2 15.35 16.95 0.00000 0 6 6 0.99 1.09 0.00000 7 4 3 6.27 6.41 180.00000 8 3 1 0.21 0.21 180.00000 7 5 2 43.84 45.38 0.00000 0 8 4 420.86 421.07 0.00000 8 4 2 553.63 541.16 180.00000 6 5 5 1.82 1.88 180.00000 7 6 1 61.20 63.03 0.00000 9 2 1 14.15 14.59 0.00000 6 6 4 351.75 350.15 0.00000 7 5 4 16.70 17.09 0.00000 8 5 1 14.68 15.03 0.00000 7 6 3 13.22 13.22 0.00000 9 3 2 4.89 4.89 180.00000 8 4 4 13.44 13.48 0.00000 8 5 3 31.31 32.24 180.00000 9 4 1 26.68 27.48 0.00000 0 8 6 0.03 0.03 180.00000 7 7 2 0.86 0.85 180.00000 10 1 1 22.57 22.37 0.00000 8 6 2 0.57 0.57 0.00000 0 10 2 8.41 8.50 180.00000 9 4 3 7.02 7.06 180.00000 7 6 5 0.24 0.24 0.00000 9 5 2 15.79 15.51 0.00000 10 3 1 13.83 13.58 0.00000 8 7 1 1.45 1.42 180.00000 8 6 4 412.37 405.56 0.00000 0 10 4 260.12 255.91 0.00000 9 6 1 4.08 4.15 180.00000 10 3 3 2.89 2.94 180.00000 10 4 2 597.58 591.01 0.00000 8 7 3 5.48 5.60 0.00000 9 5 4 0.01 0.01 180.00000 9 6 3 3.97 3.91 180.00000 10 5 1 1.68 1.65 0.00000 11 2 1 4.75 4.68 180.00000 0 8 8 449.53 441.09 0.00000 7 7 6 18.66 19.33 0.00000 9 7 2 16.35 16.94 180.00000 10 5 3 3.84 3.98 180.00000 11 3 2 10.47 10.85 180.00000 8 6 6 0.56 0.60 0.00000 0 10 6 0.45 0.48 180.00000 8 7 5 1.57 1.65 0.00000 11 4 1 5.79 6.08 180.00000 10 6 2 4.83 4.89 180.00000 9 6 5 5.13 5.16 180.00000 8 8 4 205.89 199.35 0.00000 0 0 12 31.89 30.90 0.00000 9 7 4 0.77 0.77 180.00000 9 8 1 9.75 9.75 0.00000 11 4 3 0.34 0.34 180.00000 0 12 2 180.43 177.83 180.00000 10 5 5 4.27 4.07 0.00000 11 5 2 16.52 15.76 0.00000 10 7 1 2.37 2.26 0.00000 10 6 4 397.35 381.82 0.00000 12 2 2 275.10 264.49 0.00000 9 8 3 0.99 0.98 180.00000 12 3 1 6.77 6.73 0.00000 10 7 3 7.41 7.29 180.00000 11 6 1 12.99 12.78 0.00000 0 12 4 5.16 5.07 0.00000 11 5 4 0.28 0.27 180.00000 0 10 8 0.51 0.51 180.00000 12 4 2 0.01 0.01 0.00000 9 7 6 0.03 0.03 0.00000 11 6 3 2.13 2.18 180.00000 9 9 2 0.16 0.17 0.00000 10 8 2 3.97 4.01 0.00000 9 8 5 4.03 4.18 180.00000 12 5 1 0.01 0.01 0.00000 10 7 5 11.48 11.82 0.00000 11 7 2 1.61 1.66 180.00000 13 2 1 18.14 18.68 0.00000 12 4 4 90.51 91.07 180.00000 12 5 3 5.44 5.54 0.00000 10 8 4 353.25 349.99 180.00000 0 12 6 126.55 125.41 180.00000 11 6 5 5.21 5.21 0.00000 10 9 1 5.92 5.91 0.00000 13 3 2 1.81 1.81 180.00000 12 6 2 276.11 261.75 0.00000 11 7 4 13.19 13.46 180.00000 11 8 1 2.08 2.13 180.00000 13 4 1 0.08 0.08 180.00000 10 9 3 12.21 12.39 180.00000