#------------------------------------------------------------------------------ #$Date: 2023-04-11 18:54:56 +0300 (Tue, 11 Apr 2023) $ #$Revision: 282568 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/3/00/03/3000354.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_3000354 _diffrn_ambient_pressure 100 _diffrn_ambient_temperature 90 _diffrn_radiation_polarisn_ratio 0.9900 _diffrn_radiation_probe x-ray _diffrn_radiation_wavelength 0.39360 _pd_meas_2theta_range_inc 0.00960 _pd_meas_2theta_range_max 27.49040 _pd_meas_2theta_range_min 3.50000 _pd_proc_2theta_range_inc 0.00960 _pd_proc_2theta_range_max 27.49505 _pd_proc_2theta_range_min 3.50465 _pd_proc_ls_background_function ; Background function: "chebyschev-1" function with 8 terms: 124280.349, 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0.00001518443 59246.632 59714.654 48600.378 0.0000168786 55579.619 55241.771 48599.098 0.00001799221 53276.223 52379.166 48598.046 0.0000187701 52274.809 50718.848 48597.225 0.00001912967 51696.782 49834.655 48596.637 0.00001934356 51456.345 49392.7 48596.285 0.00001943395 50915.702 49176.937 48596.169 0.00001964031 50795.526 49067.142 48596.294 0.00001968677 50738.266 49004.568 48596.661 0.00001970899 50790.318 48963.584 48597.272 0.00001968879 50535.204 48934.414 48598.13 0.00001978819 50643.255 48914.37 48599.238 0.00001974597 50433.605 48904.108 48600.597 0.00001982805 50379.611 48906.005 48602.211 0.0000198493 50416.816 48922.949 48604.081 0.00001983465 50519.097 48956.659 48606.21 0.00001979449 50643.464 49005.682 48608.601 0.00001974588 50773.319 49063.799 48611.256 0.00001969538 50873.034 49119.933 48614.178 0.00001965678 51151.745 49160.244 48617.369 0.00001954968 51087.824 49172.391 48620.831 0.00001957414 50902.273 49151.144 48624.568 0.00001964549 51107.832 49101.295 48628.581 0.00001956647 50584.56 49034.828 48632.874 0.00001976888 50412.592 48965.375 48637.448 0.00001983631 50685.718 48903.834 48642.308 0.00001972942 50267.556 48856.276 48647.454 0.00001989355 50371.2 48823.878 48652.89 0.00001985261 50231.586 48804.515 48658.619 0.00001990779 49850.247 48794.71 48664.643 0.00002006008 50306.668 48791.119 48670.964 0.00001987808 50218.589 48791.238 48677.587 0.00001991294 50393.646 48793.507 48684.512 0.00001984377 50479.277 48797.09 48691.744 0.00001981011 50312.023 48801.624 48699.284 0.00001987596 loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 1 1 0 2008.3873 1985.8337 -0.0 3.22528 100.00 1 0 1 1075.8436 1095.0522 -0.0 2.44000 66.53 2 0 0 419.0631 367.2224 -0.0 2.28062 10.44 1 1 1 403.9434 392.3016 180.0 2.15150 19.08 2 1 0 105.9222 99.7840 0.0 2.03985 4.22 2 1 1 1440.6174 1344.6782 -0.0 1.66614 79.67 2 2 0 2136.8904 1917.4482 -0.0 1.61264 26.67 0 0 2 1908.3951 1891.6121 -0.0 1.44398 10.72 3 1 0 777.9594 748.2307 -0.0 1.44239 15.55 2 2 1 26.3563 11.7879 180.0 1.40800 0.52 3 0 1 1562.4833 1390.8283 -0.0 1.34536 27.86 1 1 2 745.9566 828.6810 -0.0 1.31792 13.71 3 1 1 49.5035 60.3054 0.0 1.29040 1.62 3 2 0 29.9837 16.1288 180.0 1.26506 0.46 2 0 2 215.7746 286.9565 -0.0 1.22000 3.35 2 1 2 29.6773 25.7951 0.0 1.17857 0.86 3 2 1 375.4343 353.5016 -0.0 1.15876 9.89 4 0 0 1093.3747 860.7529 -0.0 1.14031 6.85 4 1 0 186.8725 64.0239 180.0 1.10626 2.21 2 2 2 1046.0972 903.3494 -0.0 1.07575 12.44 3 3 0 907.4355 788.1057 -0.0 1.07509 5.06 4 1 1 472.2132 456.8307 -0.0 1.03306 9.88 3 1 2 412.3560 423.0087 -0.0 1.02048 8.78 4 2 0 341.9145 350.6941 -0.0 1.01992 3.44 3 3 1 30.5985 15.8779 180.0 1.00754 0.30 4 2 1 10.3344 12.4642 0.0 0.96171 0.19 3 2 2 19.3011 7.5015 180.0 0.95154 0.36 1 0 3 252.8653 339.8811 -0.0 0.94190 2.42 1 1 3 53.7740 47.6896 180.0 0.92244 0.49 4 3 0 9.1156 19.9006 0.0 0.91225 0.07 4 0 2 600.0230 519.5454 -0.0 0.89491 4.87 5 1 0 508.4544 450.9636 -0.0 0.89453 3.95 4 1 2 85.2721 35.1807 180.0 0.87817 1.33 2 1 3 398.3112 416.5658 -0.0 0.87058 6.43 4 3 1 424.2064 448.8805 -0.0 0.86988 6.30 5 0 1 137.9973 146.0239 -0.0 0.86988 1.02 3 3 2 620.8866 493.0357 -0.0 0.86233 4.67 5 1 1 11.2585 2.1440 180.0 0.85448 0.16 5 2 0 8.4160 0.5927 0.0 0.84700 0.06 4 2 2 198.8403 233.3377 -0.0 0.83307 2.79