#------------------------------------------------------------------------------
#$Date: 2021-01-05 08:10:12 +0200 (Tue, 05 Jan 2021) $
#$Revision: 260506 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/87/2108737.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_2108737
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   8.9756
_cell_length_b                   8.9756
_cell_length_c                   22.6248
_exptl_crystal_F_000             1944.00
_reflns_d_resolution_high        0.7137
_cod_data_source_file            rm5035300Ksup4.hkl
_cod_data_source_block           300K
_shelx_title                     ' Ag_NSP_F6_2_0m in R-3c'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            681.14
_shelx_f_squared_multiplier      1.000
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'y, x, -z+1/2'
'-x+y, -x, z'
'-x, -x+y, -z+1/2'
'x-y, -y, -z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'y+2/3, x+1/3, -z+5/6'
'-x+y+2/3, -x+1/3, z+1/3'
'-x+2/3, -x+y+1/3, -z+5/6'
'x-y+2/3, -y+1/3, -z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'y+1/3, x+2/3, -z+7/6'
'-x+y+1/3, -x+2/3, z+2/3'
'-x+1/3, -x+y+2/3, -z+7/6'
'x-y+1/3, -y+2/3, -z+7/6'
'-x, -y, -z'
'y, -x+y, -z'
'-y, -x, z-1/2'
'x-y, x, -z'
'x, x-y, z-1/2'
'-x+y, y, z-1/2'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'-y+2/3, -x+1/3, z-1/6'
'x-y+2/3, x+1/3, -z+1/3'
'x+2/3, x-y+1/3, z-1/6'
'-x+y+2/3, y+1/3, z-1/6'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'-y+1/3, -x+2/3, z+1/6'
'x-y+1/3, x+2/3, -z+2/3'
'x+1/3, x-y+2/3, z+1/6'
'-x+y+1/3, y+2/3, z+1/6'
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_calc
_refln_F_squared_meas
_refln_F_squared_sigma
_refln_observed_status
-1 2 0 2827.82 3104.94 36.05 o
0 3 0 463953.28 451000.53 5071.11 o
-2 4 0 31239.98 33223.08 222.88 o
-1 5 0 9909.00 10382.78 59.43 o
-3 6 0 127291.91 119622.29 721.93 o
0 6 0 195749.41 189142.19 1111.52 o
-2 7 0 505.93 561.23 19.49 o
-4 8 0 0.63 7.52 6.99 o
-1 8 0 1.87 2.15 6.71 o
-3 9 0 26150.85 25301.27 150.90 o
0 9 0 13104.18 13412.26 167.82 o
-5 10 0 4569.61 4535.11 87.72 o
-2 10 0 1298.26 1341.14 45.22 o
-4 11 0 12476.35 12783.56 132.29 o
-6 12 0 5030.05 5396.49 140.39 o
-3 12 0 2650.84 2834.68 244.15 o
-2 3 1 56973.77 58773.47 242.47 o
-1 4 1 19863.25 19805.31 92.44 o
-3 5 1 9326.24 9028.47 57.68 o
-5 6 1 53098.06 53395.96 225.37 o
-2 6 1 13148.75 13173.08 83.59 o
-4 7 1 6254.60 6307.66 51.22 o
-1 7 1 21463.08 21428.54 128.71 o
-6 8 1 9932.06 9624.07 87.37 o
-3 8 1 2778.44 2784.96 34.44 o
-8 9 1 21624.19 21607.63 154.81 o
-5 9 1 21766.68 21648.93 118.65 o
-2 9 1 18361.36 17951.75 135.34 o
-7 10 1 4922.48 5091.34 71.65 o
-4 10 1 2983.34 2856.28 45.62 o
-1 10 1 10658.28 10467.35 117.67 o
-9 11 1 3167.58 3001.15 67.82 o
-6 11 1 4656.82 4522.58 74.67 o
-3 11 1 475.93 474.06 28.62 o
-8 12 1 6527.23 6437.79 169.42 o
-5 12 1 8124.31 8119.40 127.48 o
0 1 2 21116.71 20739.57 129.42 o
-2 2 2 5803.99 5698.23 65.24 o
-1 3 2 6444.91 6752.82 36.52 o
-3 4 2 1937.46 2146.91 20.52 o
0 4 2 1093.61 1163.03 22.11 o
-5 5 2 30026.11 30001.23 186.22 o
-2 5 2 8406.52 8355.41 54.56 o
-4 6 2 216.64 172.61 9.88 o
-1 6 2 910.47 993.34 22.90 o
-6 7 2 315.00 356.19 18.00 o
-3 7 2 149.77 195.15 10.17 o
0 7 2 577.40 522.10 31.64 o
-8 8 2 18106.69 17766.50 208.68 o
-5 8 2 19288.93 19421.65 122.44 o
-2 8 2 2807.86 2866.52 42.31 o
-7 9 2 2144.62 2206.87 49.31 o
-4 9 2 467.95 458.07 19.77 o
-1 9 2 285.04 250.62 20.74 o
-9 10 2 1648.99 1617.17 52.44 o
-6 10 2 273.74 246.51 15.52 o
-3 10 2 539.02 588.05 49.50 o
0 10 2 1501.23 1506.01 73.46 o
-8 11 2 17559.41 16892.98 160.51 o
-5 11 2 7016.83 6630.98 94.97 o
-2 11 2 1258.26 1126.31 48.57 o
-7 12 2 2008.37 2198.83 78.80 o
-4 12 2 433.82 555.69 71.00 o
-1 2 3 5608.54 5771.91 33.98 o
-2 4 3 132550.41 136641.47 679.59 o
-4 5 3 9480.36 9478.47 56.99 o
-1 5 3 25253.98 25618.05 111.98 o
-3 6 3 8603.12 9046.37 60.97 o
-5 7 3 10075.35 10071.78 74.19 o
-2 7 3 3313.87 3555.89 39.16 o
-7 8 3 2750.15 2868.71 53.18 o
-4 8 3 15372.71 15175.33 91.64 o
-1 8 3 902.64 939.39 32.58 o
-6 9 3 705.99 671.82 27.55 o
-3 9 3 624.31 619.30 25.85 o
-8 10 3 11874.80 11915.47 137.67 o
-5 10 3 10682.20 10779.50 95.28 o
-2 10 3 6131.87 6414.68 87.05 o
-10 11 3 2013.31 2220.41 205.09 o
-7 11 3 3532.13 3384.46 59.69 o
-4 11 3 116.73 120.50 14.82 o
-1 11 3 2256.94 2489.98 184.13 o
-6 12 3 4719.69 4903.43 99.96 o
-1 1 4 199.27 155.13 7.48 o
0 2 4 2737.21 2726.91 34.94 o
-2 3 4 10.54 18.92 2.92 o
-4 4 4 165.53 190.72 10.89 o
-1 4 4 14236.77 14326.21 69.45 o
-3 5 4 7727.14 7804.74 46.93 o
0 5 4 4479.71 4397.71 50.61 o
-5 6 4 44693.61 43868.82 257.24 o
-2 6 4 22143.70 21734.32 114.79 o
-7 7 4 2037.56 2038.32 70.67 o
-4 7 4 5444.00 5705.46 47.73 o
-1 7 4 17359.90 17288.44 115.35 o
-6 8 4 10354.67 10345.96 97.67 o
-3 8 4 2045.31 1902.11 35.16 o
0 8 4 8.68 38.75 13.49 o
-8 9 4 5814.11 5910.25 92.53 o
-5 9 4 35455.46 35070.00 199.73 o
-2 9 4 20191.19 20353.59 157.94 o
-10 10 4 72.27 92.01 23.07 o
-7 10 4 813.66 739.25 36.11 o
-4 10 4 2572.18 2713.09 46.96 o
-1 10 4 12298.09 12329.85 130.78 o
-9 11 4 5937.56 5904.52 92.85 o
-6 11 4 258.79 216.79 17.71 o
-3 11 4 2864.07 3006.69 61.45 o
-8 12 4 9364.37 8898.73 274.69 o
-5 12 4 26734.39 25178.53 431.15 o
-1 3 5 16478.56 15810.48 77.42 o
-3 4 5 20414.46 20568.31 94.95 o
-2 5 5 27371.23 27263.01 117.52 o
-4 6 5 46890.96 46094.78 213.93 o
-1 6 5 51475.01 50924.11 225.89 o
-6 7 5 12796.24 12476.66 107.27 o
-3 7 5 787.13 913.72 25.82 o
-5 8 5 9092.36 9045.55 83.86 o
-2 8 5 29753.87 29897.75 184.11 o
-7 9 5 12019.74 11870.09 128.16 o
-4 9 5 29313.12 28808.49 178.43 o
-1 9 5 21785.73 21999.73 176.58 o
-9 10 5 2486.23 2378.62 73.93 o
-6 10 5 2893.26 3011.62 53.33 o
-3 10 5 1662.21 1783.03 52.04 o
-8 11 5 755.37 694.88 42.19 o
-5 11 5 7976.16 7954.36 107.00 o
-2 11 5 10912.65 10948.38 140.26 o
-7 12 5 9300.36 8859.82 211.14 o
-4 12 5 10243.20 10599.91 350.88 o
0 0 6 83032.70 93767.62 2722.79 o
-1 2 6 307762.47 309706.28 3625.33 o
-3 3 6 53587.54 53449.54 303.38 o
0 3 6 13626.23 12443.35 96.23 o
-2 4 6 156013.66 156255.05 1034.89 o
-4 5 6 56325.03 55417.11 225.53 o
-1 5 6 52048.14 51073.83 213.12 o
-6 6 6 28794.25 28293.43 236.85 o
-3 6 6 18812.77 18421.56 105.21 o
0 6 6 12509.25 11968.57 121.83 o
-5 7 6 39625.95 39691.29 223.90 o
-2 7 6 16458.25 16503.07 134.33 o
-7 8 6 10710.79 10671.11 127.95 o
-4 8 6 16495.23 15740.25 116.59 o
-1 8 6 16204.16 15987.83 136.29 o
-9 9 6 128.77 83.74 28.33 o
-6 9 6 24.84 15.06 8.39 o
-3 9 6 134.43 126.96 17.66 o
0 9 6 6595.34 7055.24 130.81 o
-8 10 6 12991.99 13373.33 161.31 o
-5 10 6 9699.46 10085.84 102.99 o
-2 10 6 5900.05 6160.14 100.32 o
-10 11 6 3296.83 3315.45 248.98 o
-7 11 6 576.66 652.81 56.31 o
-4 11 6 575.69 548.98 35.38 o
-1 11 6 113.27 9.50 53.84 o
-6 12 6 1106.85 1144.35 62.61 o
-2 3 7 6404.41 7314.62 44.79 o
-1 4 7 45316.64 46028.64 233.14 o
-3 5 7 3841.94 3807.00 35.27 o
-5 6 7 23376.64 22381.73 125.51 o
-2 6 7 14368.85 14211.20 102.72 o
-4 7 7 457.68 354.01 16.92 o
-1 7 7 17194.78 17082.17 148.57 o
-6 8 7 9015.55 9304.68 101.88 o
-3 8 7 209.95 150.31 13.63 o
-8 9 7 2934.72 2962.03 69.07 o
-5 9 7 4897.83 4991.06 64.14 o
-2 9 7 3235.44 3396.53 68.83 o
-7 10 7 8365.21 8506.81 116.38 o
-4 10 7 2585.18 2764.79 57.93 o
-1 10 7 6371.04 6390.55 105.30 o
-9 11 7 93.53 56.15 21.82 o
-6 11 7 412.09 461.95 30.22 o
-3 11 7 461.68 439.01 31.74 o
-5 12 7 7046.21 6940.03 153.54 o
0 1 8 19459.33 17458.85 121.59 o
-2 2 8 59341.34 60584.00 311.21 o
-1 3 8 59176.15 59614.58 299.95 o
-3 4 8 4734.87 4500.38 34.54 o
0 4 8 961.15 909.15 29.09 o
-5 5 8 309.33 334.24 17.50 o
-2 5 8 12996.86 12664.95 80.12 o
-4 6 8 272.21 299.82 18.03 o
-1 6 8 431.91 442.26 20.12 o
-6 7 8 75.93 89.60 19.24 o
-3 7 8 1032.52 910.21 29.11 o
0 7 8 3359.96 3407.46 91.50 o
-8 8 8 15394.40 15361.87 234.10 o
-5 8 8 16641.20 16468.86 127.33 o
-2 8 8 3722.77 3630.17 63.36 o
-7 9 8 8.80 22.63 13.71 o
-4 9 8 237.81 280.04 18.40 o
-1 9 8 2622.24 2868.86 65.35 o
-9 10 8 1305.66 1383.40 59.44 o
-6 10 8 397.45 365.56 23.23 o
-3 10 8 13.56 27.35 13.82 o
0 10 8 113.17 181.02 33.07 o
-8 11 8 12700.12 13029.77 166.52 o
-5 11 8 2676.70 2905.98 67.72 o
-2 11 8 557.78 555.71 56.38 o
-1 2 9 1838.24 2022.67 23.03 o
-2 4 9 6002.36 5818.85 47.87 o
-4 5 9 952.30 951.24 20.09 o
-1 5 9 1601.71 1719.43 27.41 o
-3 6 9 8.91 20.76 6.49 o
-5 7 9 8165.01 8455.58 81.36 o
-2 7 9 1840.70 1982.57 40.46 o
-7 8 9 4342.73 4491.19 80.85 o
-4 8 9 2468.13 2586.01 42.75 o
-1 8 9 1474.32 1513.53 51.74 o
-6 9 9 1955.65 1947.07 49.49 o
-3 9 9 1777.69 1874.75 56.99 o
-8 10 9 10127.82 10308.68 141.05 o
-5 10 9 7858.45 7892.10 101.94 o
-2 10 9 3416.38 3648.04 77.21 o
-7 11 9 1070.48 1069.68 51.14 o
-4 11 9 12.18 12.06 12.42 o
-1 1 10 22783.39 26101.42 162.64 o
0 2 10 1124.64 1251.44 22.92 o
-2 3 10 19844.31 20788.29 104.97 o
-4 4 10 32719.97 31694.02 210.28 o
-1 4 10 26648.71 25803.64 136.13 o
-3 5 10 10651.93 10657.39 71.50 o
0 5 10 584.17 584.05 30.31 o
-5 6 10 1737.48 1666.78 32.46 o
-2 6 10 3359.22 3535.75 48.37 o
-7 7 10 57803.78 55961.34 540.46 o
-4 7 10 61669.56 60412.99 305.32 o
-1 7 10 9355.18 9459.80 106.00 o
-6 8 10 5832.34 5827.81 79.24 o
-3 8 10 23604.11 23588.61 177.88 o
0 8 10 27813.36 28302.75 339.80 o
-8 9 10 1615.86 1756.83 63.86 o
-5 9 10 62.67 41.43 13.59 o
-2 9 10 1883.23 1953.70 57.00 o
-10 10 10 18292.46 17452.31 785.59 o
-7 10 10 23394.89 22666.17 220.92 o
-4 10 10 8478.53 8151.22 105.58 o
-1 10 10 290.91 190.01 22.70 o
-9 11 10 681.03 564.54 100.73 o
-6 11 10 3205.73 2850.27 92.19 o
-3 11 10 18818.13 18635.24 263.73 o
-1 3 11 955.53 866.89 18.41 o
-3 4 11 22017.56 22169.53 115.56 o
-2 5 11 12432.38 12024.66 81.25 o
-4 6 11 8459.82 8536.16 73.78 o
-1 6 11 42999.71 43066.69 261.42 o
-6 7 11 7970.56 8015.40 91.68 o
-3 7 11 767.05 717.76 29.52 o
-5 8 11 6943.79 6940.10 83.61 o
-2 8 11 24609.12 24394.20 199.67 o
-7 9 11 3485.21 3632.09 76.07 o
-4 9 11 11232.92 11605.57 119.71 o
-1 9 11 16560.06 17290.07 180.98 o
-9 10 11 2303.01 2341.72 77.11 o
-6 10 11 161.51 177.65 19.11 o
-3 10 11 1340.95 1459.12 56.79 o
-8 11 11 1885.49 1836.34 375.61 o
-5 11 11 10703.37 11163.06 152.56 o
0 0 12 280202.59 300515.84 5684.81 o
-1 2 12 2033.73 2168.64 27.43 o
-3 3 12 68208.86 70087.52 407.68 o
0 3 12 83317.71 85071.70 770.59 o
-2 4 12 2591.43 2430.99 31.29 o
-4 5 12 1463.68 1519.67 29.10 o
-1 5 12 889.74 884.72 26.48 o
-6 6 12 20630.78 20702.21 284.13 o
-3 6 12 19856.64 19368.84 133.48 o
0 6 12 18103.12 18832.78 261.10 o
-5 7 12 1495.41 1534.45 38.84 o
-2 7 12 1757.68 1839.33 45.14 o
-7 8 12 1202.18 1253.33 50.77 o
-4 8 12 669.48 729.26 30.84 o
-1 8 12 35.93 33.62 11.97 o
-9 9 12 4175.95 3919.96 120.45 o
-6 9 12 4981.78 5305.93 83.92 o
-3 9 12 1177.08 1154.85 45.84 o
0 9 12 27.44 34.24 22.28 o
-8 10 12 335.89 267.22 28.29 o
-5 10 12 257.87 159.06 19.53 o
-2 10 12 6.78 6.92 12.27 o
-7 11 12 213.18 287.20 46.27 o
-4 11 12 1665.20 1789.83 147.13 o
-2 3 13 761.81 905.99 27.33 o
-1 4 13 4785.86 4765.81 51.13 o
-3 5 13 3298.47 3000.38 40.08 o
-5 6 13 4257.72 4380.18 54.56 o
-2 6 13 9614.39 9299.92 94.04 o
-4 7 13 866.34 830.47 31.84 o
-1 7 13 1538.58 1557.59 46.47 o
-6 8 13 1172.33 1107.20 42.90 o
-3 8 13 107.85 118.55 15.83 o
-8 9 13 235.09 225.37 23.38 o
-5 9 13 3395.86 3358.59 63.67 o
-2 9 13 17.72 23.05 12.78 o
-7 10 13 1494.90 1536.61 64.69 o
-4 10 13 3329.65 3379.80 73.09 o
-1 10 13 472.42 321.33 54.85 o
-6 11 13 8.94 13.14 28.59 o
0 1 14 60096.50 61286.23 337.33 o
-2 2 14 76711.76 77613.30 445.27 o
-1 3 14 32433.98 31548.76 168.81 o
-3 4 14 19636.84 19593.45 115.14 o
0 4 14 1671.22 1827.19 46.45 o
-5 5 14 4779.73 4910.31 77.29 o
-2 5 14 15278.76 15026.90 112.87 o
-4 6 14 5493.89 5394.41 65.59 o
-1 6 14 15925.78 15828.23 134.00 o
-6 7 14 7412.71 7574.87 92.13 o
-3 7 14 5186.40 5097.20 74.09 o
0 7 14 18.11 40.27 17.19 o
-8 8 14 5501.35 5277.17 132.63 o
-5 8 14 103.11 87.22 14.76 o
-2 8 14 11284.44 11219.31 128.59 o
-7 9 14 6553.54 6758.72 120.74 o
-4 9 14 8768.75 8375.42 103.03 o
-1 9 14 2181.54 2209.90 75.20 o
-9 10 14 7436.32 7213.97 242.70 o
-6 10 14 2295.69 2573.22 63.46 o
-3 10 14 2934.57 3267.91 81.30 o
-5 11 14 1568.87 1822.32 164.70 o
-1 2 15 15658.06 15684.01 101.56 o
-2 4 15 514.17 344.80 17.09 o
-4 5 15 236.67 270.88 15.00 o
-1 5 15 1004.31 1090.72 32.98 o
-3 6 15 5328.06 5144.20 69.54 o
-5 7 15 27.99 27.86 9.34 o
-2 7 15 3.86 13.72 9.05 o
-7 8 15 34.64 15.80 12.78 o
-4 8 15 685.02 668.12 31.25 o
-1 8 15 114.48 118.52 17.71 o
-6 9 15 268.85 214.87 20.97 o
-3 9 15 375.99 412.43 31.30 o
-8 10 15 3744.96 3612.07 164.32 o
-5 10 15 4162.60 4158.00 81.84 o
-2 10 15 3110.15 2756.17 179.48 o
-1 1 16 2474.71 2325.93 40.16 o
0 2 16 633.03 605.49 40.77 o
-2 3 16 997.38 927.23 26.05 o
-4 4 16 1568.04 1417.77 41.13 o
-1 4 16 383.54 338.44 20.09 o
-3 5 16 12286.77 12270.36 96.54 o
0 5 16 13884.79 13913.63 152.52 o
-5 6 16 20097.60 19910.50 160.75 o
-2 6 16 8239.31 8080.39 94.99 o
-7 7 16 1442.18 1346.25 81.61 o
-4 7 16 749.44 702.66 30.95 o
-1 7 16 2054.77 2159.30 53.41 o
-6 8 16 10956.38 10900.24 131.74 o
-3 8 16 6612.88 6741.21 90.53 o
0 8 16 840.25 994.55 67.04 o
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-2 9 16 4592.10 4469.98 98.90 o
-7 10 16 1417.92 1710.86 99.68 o
-4 10 16 199.16 105.24 19.14 o
-1 3 17 13231.81 12781.78 103.96 o
-3 4 17 14.79 3.76 6.42 o
-2 5 17 764.48 724.57 27.27 o
-4 6 17 145.59 113.86 14.13 o
-1 6 17 11773.37 11528.73 119.01 o
-6 7 17 327.79 358.04 26.47 o
-3 7 17 133.64 118.85 14.25 o
-5 8 17 2085.88 2274.82 55.22 o
-2 8 17 3385.54 3551.69 75.32 o
-7 9 17 3985.09 4100.72 95.40 o
-4 9 17 4324.93 4631.33 77.71 o
-1 9 17 7905.08 8253.31 147.14 o
-6 10 17 1353.84 1494.04 101.57 o
-3 10 17 209.21 129.03 65.50 o
0 0 18 35509.47 34601.49 844.10 o
-1 2 18 9458.76 9799.97 84.32 o
-3 3 18 5061.93 4954.12 85.60 o
0 3 18 1247.59 1298.83 47.80 o
-2 4 18 6430.05 6548.15 67.02 o
-4 5 18 3314.58 3234.58 47.50 o
-1 5 18 2548.21 2471.38 46.01 o
-6 6 18 22341.76 22266.75 297.36 o
-3 6 18 5552.97 5450.35 73.26 o
0 6 18 15379.43 15008.59 241.47 o
-5 7 18 9.42 11.93 9.89 o
-2 7 18 450.37 482.01 28.73 o
-7 8 18 150.79 156.22 25.07 o
-4 8 18 393.99 472.79 27.31 o
-1 8 18 2.37 5.13 12.60 o
-6 9 18 1814.83 1541.57 58.17 o
-3 9 18 2453.75 2416.99 64.07 o
-5 10 18 1942.05 1708.96 114.82 o
-2 3 19 770.20 788.52 27.20 o
-1 4 19 1665.58 1663.72 40.72 o
-3 5 19 3342.44 3297.74 48.96 o
-5 6 19 3573.55 3814.02 69.76 o
-2 6 19 142.52 122.90 15.48 o
-4 7 19 40.78 23.60 10.37 o
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