#------------------------------------------------------------------------------ #$Date: 2016-04-07 01:50:15 +0300 (Thu, 07 Apr 2016) $ #$Revision: 181928 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/4/10/52/4105292.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_4105292 _pd_meas_2theta_range_inc 0.02 _pd_meas_2theta_range_max 90.0 _pd_meas_2theta_range_min 10.02 _pd_meas_number_of_points 4000 _pd_proc_2theta_range_inc 0.02 _pd_proc_2theta_range_max 90.0 _pd_proc_2theta_range_min 10.02 _pd_proc_number_of_points 4000 _cod_data_source_file ja905730n_si_003.hkl _cod_data_source_block x loop_ _pd_meas_counts_total _pd_proc_ls_weight _pd_proc_intensity_bkg_calc _pd_calc_intensity_total 1165.0 0.000858 1071.02454 1071.01904 1094.0 0.000914 1074.79199 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0.000996 966.13666 976.41675 1054.0 0.000949 965.69489 975.76068 1065.0 0.000939 965.25128 975.11011 990.0 0.001010 964.80646 974.46332 977.0 0.001024 964.35992 973.82373 949.0 0.001054 963.91162 973.18835 1048.0 0.000954 963.46167 972.55573 973.0 0.001028 963.01074 971.93011 1030.0 0.000971 962.55768 971.30682 1050.0 0.000952 962.10413 970.68787 1016.0 0.000984 961.64648 970.07172 1028.0 0.000973 961.18762 969.45947 1016.0 0.000984 960.72882 968.85120 1039.0 0.000962 960.26642 968.24493 971.0 0.001030 959.80286 967.64093 1029.0 0.000972 959.33740 967.04065 1003.0 0.000997 958.87146 966.44202 992.0 0.001008 958.40234 965.84607 1018.0 0.000982 957.93085 965.25073 1035.0 0.000966 957.45923 964.65997 973.0 0.001028 956.98694 964.07019 1012.0 0.000988 956.51019 963.48157 1010.0 0.000990 956.03381 962.89557 957.0 0.001045 955.55377 962.31030 955.0 0.001047 955.07220 961.72656 924.0 0.001082 954.58978 961.14435 908.0 0.001101 954.10419 960.56165 1003.0 0.000997 953.61951 959.98291 1030.0 0.000971 953.13159 959.40381 930.0 0.001075 952.64160 958.82538 955.0 0.001047 952.15021 958.25018 1021.0 0.000979 951.65704 957.67279 1037.0 0.000964 951.16162 957.09766 996.0 . . . loop_ _refln_index_h _refln_index_k _refln_index_l _pd_refln_wavelength_id _refln_observed_status _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 1 0 1 1 o 1372.903 2081.236 -135.00 5.17901 4.49 1 0 1 2 o 1206.981 2081.236 -135.00 5.17901 2.05 1 1 2 1 o 122872.20 118202.70 -40.47 3.34175 100.00 1 1 2 2 o 122125.02 118202.70 -40.47 3.34175 49.42 1 0 3 1 o 4666.186 2772.569 135.00 3.20732 4.23 1 0 3 2 o 4953.909 2772.569 135.00 3.20732 2.22 2 0 0 1 o 4571.158 1451.771 0.00 2.89683 1.46 2 0 0 2 o 4383.243 1451.771 0.00 2.89683 0.69 0 0 4 1 o 4250.357 1410.036 0.00 2.88848 0.67 0 0 4 2 o 4230.176 1410.036 0.00 2.88848 0.33 2 0 2 1 o 0.015 0.261 90.00 2.58951 0.00 2 0 2 2 o 0.015 0.261 90.00 2.58951 0.00 2 1 1 1 o -676.531 2486.140 146.63 2.52821 0.00 2 1 1 2 o -676.531 2486.140 146.63 2.52821 0.00 2 1 3 1 o -543.491 1417.005 -120.77 2.14978 0.00 1 0 5 1 o -627.402 2090.407 -135.00 2.14636 0.00 2 1 3 2 o -543.491 1417.005 -120.77 2.14978 0.00 1 0 5 2 o -627.402 2090.407 -135.00 2.14636 0.00 2 2 0 1 o 205229.06 153040.55 0.00 2.04837 27.90 2 0 4 1 o 214541.11 153132.23 0.00 2.04541 58.23 2 2 0 2 o 221119.08 153040.55 0.00 2.04837 14.99 2 0 4 2 o 232350.23 153132.23 0.00 2.04541 31.45 3 0 1 1 o 33800.406 2680.462 -135.00 1.90480 8.22 3 0 1 2 o 31685.320 2680.462 -135.00 1.90480 3.83 3 1 0 1 o 0.044 0.710 -180.00 1.83212 0.00 3 1 0 2 o 0.044 0.710 -180.00 1.83212 0.00 3 1 2 1 o 61792.47 62350.36 40.02 1.74640 22.46 1 1 6 1 o 59164.22 62418.31 40.16 1.74273 10.67 3 1 2 2 o 58493.88 62350.36 40.02 1.74640 10.53 1 1 6 2 o 55670.43 62418.31 40.16 1.74273 4.97 3 0 3 1 o 365.306 621.183 135.00 1.72634 0.14 2 1 5 1 o 693.135 1147.986 121.28 1.72457 0.44 3 0 3 2 o 278.405 621.183 135.00 1.72634 0.06 2 1 5 2 o 565.486 1147.986 121.28 1.72457 0.19 2 2 4 1 o -82.829 854.244 0.00 1.67088 0.00 2 2 4 2 o -82.829 854.244 0.00 1.67088 0.00 2 0 6 1 o 0.010 0.146 -90.00 1.60366 0.00 2 0 6 2 o 0.010 0.146 -90.00 1.60366 0.00 3 2 1 1 o -375.463 632.114 -152.47 1.59155 0.00 3 2 1 2 o -375.463 632.114 -152.47 1.59155 0.00 1 0 7 1 o -444.595 989.427 135.00 1.58740 0.00 1 0 7 2 o -444.595 989.427 135.00 1.58740 0.00 3 1 4 1 o 0.037 0.549 0.00 1.54714 0.00 3 1 4 2 o 0.037 0.549 0.00 1.54714 0.00 3 2 3 1 o -515.434 2021.789 125.91 1.48297 0.00 3 0 5 1 o -357.080 534.919 -135.00 1.48185 0.00 3 2 3 2 o -515.434 2021.789 125.91 1.48297 0.00 3 0 5 2 o -357.080 534.919 -135.00 1.48185 0.00 4 0 0 1 o 59180.80 89893.35 0.00 1.44842 3.26 4 0 0 2 o 64782.05 89893.35 0.00 1.44842 1.79 0 0 8 1 o 66182.29 90227.40 0.00 1.44424 1.83 0 0 8 2 o 74162.97 90227.40 0.00 1.44424 1.03 4 0 2 1 o 5.118 1.835 -90.00 1.40493 0.00 4 0 2 2 o 4.951 1.835 -90.00 1.40493 0.00 4 1 1 1 o 3549.385 1022.392 110.35 1.39489 0.87 2 1 7 1 o 4883.954 1320.604 -145.60 1.39209 1.18 4 1 1 2 o 3970.012 1022.392 110.35 1.39489 0.48 2 1 7 2 o 5765.849 1320.604 -145.60 1.39209 0.68 3 3 2 1 o 46523.61 37891.96 -40.17 1.32896 4.38 3 1 6 1 o 45060.32 37952.04 -40.32 1.32734 8.44 3 3 2 2 o 43935.34 37891.96 -40.17 1.32896 2.05 3 1 6 2 o 44207.45 37952.04 -40.32 1.32734 4.11 4 1 3 1 o 1788.769 1337.353 -155.14 1.32005 0.43 3 2 5 1 o 2329.593 1689.779 -126.15 1.31926 0.54 4 1 3 2 o 2104.071 1337.353 -155.14 1.32005 0.24 3 2 5 2 o 2781.263 1689.779 -126.15 1.31926 0.31 4 2 0 1 o 1969.888 508.367 0.00 1.29550 0.19 4 0 4 1 o 1981.249 493.643 0.00 1.29475 0.19 2 0 8 1 o 2041.710 451.018 0.00 1.29251 0.20 4 2 0 2 o 2287.093 508.367 0.00 1.29550 0.11 4 0 4 2 o 2315.813 493.643 0.00 1.29475 0.11 2 0 8 2 o 2427.141 451.018 0.00 1.29251 0.12 4 2 2 1 o 9.359 0.822 90.00 1.26411 0.00 4 2 2 2 o 6.278 0.822 90.00 1.26411 0.00 3 0 7 1 o 8138.793 1515.663 135.00 1.25473 0.75 1 0 9 1 o 4186.353 727.528 -135.00 1.25337 0.40 3 0 7 2 o 7791.144 1515.663 135.00 1.25473 0.36 1 0 9 2 o 4370.889 727.528 -135.00 1.25337 0.21 4 1 5 1 o 36.286 1136.767 154.53 1.20062 0.06 4 1 5 2 o 296.084 1136.767 154.53 1.20062 0.05 4 2 4 1 o 48709.86 56874.10 0.00 1.18206 6.97 2 2 8 1 o 49611.88 57059.29 0.00 1.18035 3.55 4 2 4 2 o 49927.98 56874.10 0.00 1.18206 3.57 2 2 8 2 o 51296.86 57059.29 0.00 1.18035 1.83 4 0 6 1 o 1.983 1.176 90.00 1.15753 0.00 4 0 6 2 o 1.879 1.176 90.00 1.15753 0.00 4 3 1 1 o 2469.083 1410.747 151.54 1.15295 0.42 5 0 1 1 o 478.126 214.543 -135.00 1.15295 0.05 3 2 7 1 o 818.710 424.802 150.08 1.15137 0.16 2 1 9 1 o 1722.798 964.362 144.93 1.15031 0.31 5 0 1 2 o 474.742 214.543 -135.00 1.15295 0.03 4 3 1 2 o 2455.496 1410.747 151.54 1.15295 0.21 3 2 7 2 o 902.816 424.802 150.08 1.15137 0.09 2 1 9 2 o 2006.495 964.362 144.93 1.15031 0.17 5 1 0 1 o 4.618 2.505 0.00 1.13623 0.00 3 1 8 1 o 0.481 0.279 -180.00 1.13421 0.00 5 1 0 2 o 4.214 2.505 0.00 1.13623 0.00 3 1 8 2 o 0.453 0.279 -180.00 1.13421 0.00 5 1 2 1 o 24565.516 24372.561 -40.10 1.11487 3.26 3 3 6 1 o 24119.053 24416.410 40.24 1.11392 1.60 5 1 2 2 o 23353.842 24372.561 -40.10 1.11487 1.54 1 1 10 1 o 23446.498 24506.809 -40.53 1.11201 1.54 3 3 6 2 o 23253.109 24416.410 40.24 1.11392 0.76 4 3 3 1 o 454.153 479.029 -107.40 1.10960 0.10 5 0 3 1 o 1505.472 1572.054 135.00 1.10960 0.13 1 1 10 2 o 23951.154 24506.809 -40.53 1.11201 0.79 5 0 3 2 o 1768.118 1572.054 135.00 1.10960 0.08 4 3 3 2 o 552.276 479.029 -107.40 1.10960 0.06