#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/58/2205825.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_2205825_Fobs
loop_
_publ_author_name
'Bobev, Svilen'
'Bauer, Eric D.'
_publ_section_title
;
 Ce~5~Au~<i>x~</i>Ge~4{-~<i>x</i>} [<i>x</i> = 0.43(2)] with the
 orthorhombic Sm~5~Ge~4~ structure type
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i73
_journal_page_last               i75
_journal_volume                  61
_journal_year                    2005
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   7.8676
_cell_length_b                   15.2578
_cell_length_c                   8.0519
_exptl_crystal_F_000             1751.90
_reflns_d_resolution_high        0.7621
_[local]_cod_data_source_file    wm6062Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' Ce5AuxGe4-x in Pnma'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            863.38
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z'
'x+1/2, -y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z'
'-x-1/2, y-1/2, z-1/2'
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
2 0 0 8.40 142.26 121.93 o
4 0 0 10868.16 10259.22 508.55 o
6 0 0 51182.65 50013.38 1780.37 o
8 0 0 14759.71 16255.66 1260.86 o
2 1 0 871.76 1445.86 152.44 o
4 1 0 10300.83 9805.25 644.13 o
6 1 0 140460.94 139049.98 2092.67 o
8 1 0 6150.94 7180.25 668.29 o
0 2 0 6254.24 6164.07 278.33 o
2 2 0 8200.85 8021.37 318.79 o
4 2 0 18649.34 17279.44 451.43 o
6 2 0 7555.44 7482.43 532.11 o
8 2 0 45630.14 45384.84 1520.65 o
2 3 0 101631.55 104453.07 1321.98 o
4 3 0 2689.98 3224.83 294.39 o
6 3 0 120569.72 117095.37 2493.81 o
8 3 0 18142.30 17820.07 1423.77 o
0 4 0 14351.62 15048.46 522.89 o
2 4 0 260018.08 253317.14 8771.56 o
4 4 0 16359.52 15823.61 1261.64 o
6 4 0 48155.14 48781.40 1626.94 o
8 4 0 254721.53 256708.84 4548.55 o
2 5 0 176428.73 177520.47 4456.39 o
4 5 0 10738.76 11267.02 535.87 o
6 5 0 13288.48 14051.85 841.96 o
8 5 0 30258.87 31338.54 1885.79 o
0 6 0 745432.75 733375.63 8653.83 o
2 6 0 16841.67 17160.23 440.15 o
4 6 0 22118.88 21241.87 767.24 o
6 6 0 24930.07 23733.51 939.50 o
8 6 0 247.05 463.68 362.42 o
2 7 0 43602.10 44430.26 800.85 o
4 7 0 93842.47 90084.47 1778.49 o
6 7 0 76318.52 71668.35 2166.30 o
8 7 0 5141.52 4910.41 1087.49 o
0 8 0 400878.50 408739.00 5444.43 o
2 8 0 1792.03 2294.40 226.61 o
4 8 0 47301.77 44328.46 1224.22 o
6 8 0 4343.18 4425.23 501.68 o
8 8 0 2330.71 2228.39 592.79 o
2 9 0 4993.50 5857.29 349.80 o
4 9 0 8099.74 7546.13 558.37 o
6 9 0 19479.90 18019.79 1197.90 o
8 9 0 51894.16 50384.37 2458.68 o
0 10 0 4056.15 5109.13 535.31 o
2 10 0 260754.50 244970.86 3279.51 o
4 10 0 61.19 463.45 436.93 o
6 10 0 47154.31 45376.31 2118.28 o
8 10 0 163648.17 151034.56 3837.27 o
2 11 0 107671.91 103643.51 2176.22 o
4 11 0 58.72 137.45 222.39 o
6 11 0 38707.05 37846.45 1430.08 o
8 11 0 11511.34 13455.13 1206.35 o
0 12 0 1893.06 3035.14 650.39 o
2 12 0 20758.68 20421.79 964.56 o
4 12 0 37030.20 36337.37 1349.76 o
6 12 0 1424.79 1542.02 384.12 o
8 12 0 30943.28 33348.74 1620.98 o
2 13 0 14224.60 15636.19 1256.60 o
4 13 0 22062.51 23626.11 1138.59 o
6 13 0 13065.43 12352.54 1128.52 o
0 14 0 518866.91 534643.94 9937.00 o
2 14 0 673.35 1322.75 448.83 o
4 14 0 2288.65 1738.56 528.68 o
6 14 0 12883.41 13011.52 1270.75 o
2 15 0 6592.89 7592.39 943.25 o
4 15 0 1036.65 1240.52 443.56 o
6 15 0 84605.34 83476.44 5040.08 o
0 16 0 19424.95 23811.98 2847.67 o
2 16 0 46127.82 45756.92 6618.47 o
4 16 0 69949.00 66544.70 2543.17 o
6 16 0 15238.36 19331.24 1952.10 o
2 17 0 1075.47 2675.16 1100.84 o
4 17 0 3243.67 3371.20 542.11 o
0 18 0 34.81 -176.13 535.15 o
2 18 0 5347.80 7135.94 1033.02 o
4 18 0 12313.23 12016.30 1911.22 o
2 19 0 86272.30 77374.52 15151.02 o
1 0 1 921.77 1635.75 107.72 o
2 0 1 54600.83 54740.58 781.13 o
3 0 1 421191.66 420931.19 3693.51 o
4 0 1 13025.77 13231.62 1098.65 o
5 0 1 46261.11 43540.76 999.94 o
6 0 1 32600.14 32276.40 1005.48 o
7 0 1 19985.21 19870.44 860.46 o
8 0 1 43026.40 45407.37 1432.71 o
9 0 1 12236.31 12016.58 1018.83 o
10 0 1 81273.04 79905.13 4111.46 o
0 1 1 2104.00 2495.55 101.68 o
1 1 1 336.05 524.64 66.49 o
2 1 1 13914.29 14299.00 285.58 o
3 1 1 113881.20 115199.13 985.89 o
4 1 1 128731.84 124590.01 3127.98 o
5 1 1 933.26 1092.86 147.25 o
6 1 1 37523.24 37953.58 724.96 o
7 1 1 2913.44 3060.41 290.82 o
8 1 1 812.73 1117.02 215.95 o
9 1 1 8222.30 9564.87 642.62 o
10 1 1 7151.74 7911.12 924.20 o
1 2 1 1574.80 1996.65 105.63 o
2 2 1 28780.01 30088.30 373.23 o
3 2 1 543.99 752.39 87.85 o
4 2 1 4102.78 4685.61 204.99 o
5 2 1 25231.63 24044.29 453.95 o
6 2 1 1792.19 1969.30 300.20 o
7 2 1 5949.41 6540.97 447.00 o
8 2 1 662.11 1303.36 272.60 o
9 2 1 39.84 241.75 171.55 o
10 2 1 159.21 74.52 467.42 o
0 3 1 2443.80 2640.07 212.89 o
1 3 1 951.72 1226.86 85.15 o
2 3 1 222483.66 233171.78 1672.13 o
3 3 1 4333.50 4675.52 171.81 o
4 3 1 179985.66 179139.48 1564.22 o
5 3 1 14005.54 13698.76 414.63 o
6 3 1 5865.91 6559.18 402.11 o
7 3 1 155.31 492.26 158.47 o
8 3 1 66.89 415.57 180.90 o
9 3 1 25538.11 27177.60 946.21 o
10 3 1 6579.13 7263.71 1165.45 o
1 4 1 44.59 261.67 51.70 o
2 4 1 232651.23 235238.81 2260.84 o
3 4 1 1047.45 1175.42 136.90 o
4 4 1 1798.75 2010.90 198.47 o
5 4 1 234279.11 224804.11 2113.81 o
6 4 1 1431.67 1776.43 205.53 o
7 4 1 16305.79 16398.41 598.64 o
8 4 1 5959.14 6201.83 472.72 o
9 4 1 3505.83 3621.27 355.96 o
0 5 1 9559.41 11004.47 327.47 o
1 5 1 116811.67 116378.64 1767.94 o
2 5 1 2452.58 2947.56 153.99 o
3 5 1 68116.03 64865.91 969.86 o
4 5 1 10528.49 10227.83 366.13 o
5 5 1 1374.44 1298.91 178.68 o
6 5 1 12460.99 12496.68 472.65 o
7 5 1 405.71 765.17 164.73 o
8 5 1 7534.90 7628.71 712.05 o
9 5 1 145.95 238.43 274.75 o
1 6 1 7952.09 8402.52 221.57 o
2 6 1 614.84 950.98 121.99 o
3 6 1 114389.37 114780.67 1594.82 o
4 6 1 4741.81 4639.27 349.18 o
5 6 1 16425.31 16077.45 484.38 o
6 6 1 778.40 1052.68 175.53 o
7 6 1 5221.95 4264.65 852.82 o
8 6 1 19181.10 20208.99 717.89 o
9 6 1 525.33 687.57 213.44 o
0 7 1 2699.54 2929.86 242.44 o
1 7 1 72437.66 71762.50 1330.78 o
2 7 1 22733.46 22538.23 409.08 o
3 7 1 26358.84 25856.03 548.90 o
4 7 1 228543.56 222147.00 2907.14 o
5 7 1 253.03 360.38 131.57 o
6 7 1 51787.98 48949.82 1107.18 o
7 7 1 506.70 652.02 223.91 o
8 7 1 1051.85 1271.73 262.80 o
9 7 1 3362.92 4098.82 401.93 o
1 8 1 806.79 838.69 101.55 o
2 8 1 21262.14 20743.56 390.47 o
3 8 1 56526.00 53548.13 849.17 o
4 8 1 221.75 515.22 143.73 o
5 8 1 1998.65 2309.34 280.80 o
6 8 1 29427.29 27073.16 822.60 o
7 8 1 7276.27 7087.38 535.31 o
8 8 1 4956.25 4560.91 796.76 o
9 8 1 935.01 1200.14 736.35 o
0 9 1 80112.80 83430.63 1267.65 o
1 9 1 19530.31 18776.35 382.98 o
2 9 1 49214.62 47319.05 1301.01 o
3 9 1 51320.23 49171.09 954.17 o
4 9 1 5395.35 5876.76 413.85 o
5 9 1 2224.04 2554.66 289.74 o
6 9 1 1344.48 1678.11 246.06 o
7 9 1 8359.17 8101.47 572.87 o
8 9 1 12298.45 12926.95 746.92 o
9 9 1 289.20 453.87 474.19 o
1 10 1 6284.48 7355.57 330.65 o
2 10 1 80514.34 78566.30 1068.77 o
3 10 1 8878.80 9495.60 503.84 o
4 10 1 2175.62 2191.53 333.46 o
5 10 1 190642.88 183523.55 2307.64 o
6 10 1 4932.05 4979.34 416.66 o
7 10 1 11490.32 11390.30 718.91 o
8 10 1 4786.66 5009.65 541.78 o
0 11 1 9068.20 10207.78 786.25 o
1 11 1 15854.81 16288.76 505.58 o
2 11 1 42461.73 42648.64 932.18 o
3 11 1 289.17 399.08 155.96 o
4 11 1 75098.59 71334.42 1201.59 o
5 11 1 8931.09 9246.37 819.72 o
6 11 1 217.15 254.00 199.29 o
7 11 1 217.19 27.86 354.93 o
8 11 1 5108.17 5995.16 600.47 o
1 12 1 26756.80 26103.22 628.89 o
2 12 1 45857.82 44674.50 975.67 o
3 12 1 54.88 415.52 209.48 o
4 12 1 190.96 168.93 215.35 o
5 12 1 8708.80 10034.26 624.90 o
6 12 1 19505.16 20869.50 820.82 o
7 12 1 516.45 928.80 227.54 o
0 13 1 49029.77 51148.98 2604.84 o
1 13 1 564.53 694.33 216.09 o
2 13 1 16133.99 15760.75 786.61 o
3 13 1 10307.92 10236.60 682.62 o
4 13 1 38346.53 38078.01 1117.22 o
5 13 1 6039.24 6299.49 557.28 o
6 13 1 42027.49 41806.21 1229.38 o
7 13 1 197.94 222.31 227.35 o
1 14 1 107.53 382.69 586.64 o
2 14 1 5653.19 6355.35 679.92 o
3 14 1 103872.00 101863.32 2050.18 o
4 14 1 2801.66 3399.99 406.80 o
5 14 1 21826.84 21415.73 940.62 o
6 14 1 10007.73 10382.71 697.08 o
7 14 1 6645.82 5657.85 718.24 o
0 15 1 57240.57 57115.11 1735.98 o
1 15 1 2759.11 2941.76 440.05 o
2 15 1 2742.28 2819.97 480.30 o
3 15 1 61092.43 59158.71 1951.16 o
4 15 1 21666.07 22629.81 1108.70 o
5 15 1 7419.60 8068.42 679.40 o
6 15 1 799.61 743.55 840.02 o
1 16 1 8455.90 10372.62 769.91 o
2 16 1 120.71 363.32 324.62 o
3 16 1 4119.96 4569.56 570.14 o
4 16 1 4774.51 4647.06 518.52 o
5 16 1 18271.10 18189.79 984.15 o
0 17 1 11213.58 15012.12 1595.15 o
1 17 1 3001.11 3478.87 462.51 o
2 17 1 49197.10 50259.13 1487.69 o
3 17 1 147.72 750.48 317.77 o
4 17 1 17857.52 19668.76 1167.48 o
1 18 1 3341.54 3343.75 500.61 o
2 18 1 37591.00 40510.50 1326.92 o
3 18 1 354.39 1259.49 438.87 o
0 19 1 47463.50 51946.57 2609.12 o
1 19 1 29861.13 36237.07 1510.06 o
2 19 1 4806.31 5447.95 567.78 o
0 0 2 468.00 826.51 142.27 o
1 0 2 7544.26 8287.33 233.68 o
2 0 2 301366.38 310192.13 2771.11 o
3 0 2 139113.14 141823.58 1739.92 o
4 0 2 5127.54 5761.93 359.58 o
5 0 2 44690.85 42992.61 962.93 o
6 0 2 26042.99 26353.96 905.74 o
7 0 2 90489.95 89933.26 2650.78 o
8 0 2 89722.65 93391.90 2428.66 o
9 0 2 1791.28 2065.20 388.63 o
10 0 2 4250.20 3916.08 806.25 o
1 1 2 29051.77 29503.57 341.34 o
2 1 2 60616.29 62668.13 618.13 o
3 1 2 1457.31 1703.42 133.16 o
4 1 2 43932.95 43714.39 704.51 o
5 1 2 1160.71 1563.08 160.63 o
6 1 2 1739.59 1886.43 214.10 o
7 1 2 75101.20 74415.94 1406.61 o
8 1 2 18382.49 19157.08 727.64 o
9 1 2 24544.99 25944.18 895.60 o
10 1 2 17.87 326.44 304.14 o
0 2 2 17465.10 17899.76 394.00 o
1 2 2 682.99 1019.88 77.48 o
2 2 2 12510.84 12959.00 305.20 o
3 2 2 12178.25 12690.15 292.52 o
4 2 2 151.98 372.61 83.24 o
5 2 2 27675.63 27958.60 567.14 o
6 2 2 3060.42 3496.03 361.84 o
7 2 2 458.27 678.05 218.84 o
8 2 2 3.32 270.23 178.94 o
9 2 2 362.14 242.97 179.52 o
10 2 2 1390.32 1728.79 317.11 o
1 3 2 412937.25 428051.50 2606.46 o
2 3 2 363.24 695.08 86.79 o
3 3 2 4112.63 4281.44 187.17 o
4 3 2 3548.02 4256.23 211.59 o
5 3 2 7470.42 7982.88 417.16 o
6 3 2 36587.92 34934.55 801.65 o
7 3 2 13407.04 12901.64 553.73 o
8 3 2 4211.38 5083.86 443.39 o
9 3 2 19083.41 19360.64 842.52 o
10 3 2 139.81 1049.99 413.22 o
0 4 2 432299.97 430625.94 7545.73 o
1 4 2 86883.13 90375.02 849.39 o
2 4 2 512.48 747.26 127.71 o
3 4 2 3117.60 3399.82 171.31 o
4 4 2 10755.65 10955.68 292.50 o
5 4 2 111783.64 107566.29 1566.64 o
6 4 2 14713.65 14651.99 1065.65 o
7 4 2 11722.90 11500.71 570.19 o
8 4 2 3499.79 3234.22 556.43 o
9 4 2 2547.27 2919.64 319.92 o
1 5 2 50134.65 50581.04 635.01 o
2 5 2 21691.29 21895.55 414.50 o
3 5 2 12818.68 12943.96 295.59 o
4 5 2 59396.02 56807.89 3002.51 o
5 5 2 21774.54 20490.94 592.44 o
6 5 2 80192.78 76894.13 1864.86 o
7 5 2 315.87 567.43 167.84 o
8 5 2 24758.64 24867.70 1619.07 o
9 5 2 884.63 1803.42 283.49 o
0 6 2 1186.36 1485.04 227.64 o
1 6 2 309.20 577.32 109.87 o
2 6 2 85531.05 84773.63 877.59 o
3 6 2 28332.54 28002.51 459.54 o
4 6 2 3658.25 3981.17 264.68 o
5 6 2 1998.77 2297.31 219.06 o
6 6 2 13661.46 13467.50 593.52 o
7 6 2 33511.61 34186.38 870.95 o
8 6 2 30646.51 30595.61 878.80 o
9 6 2 2212.68 3638.02 631.78 o
1 7 2 61309.07 61537.32 1303.27 o
2 7 2 14882.20 14773.09 334.25 o
3 7 2 13761.60 13338.88 358.16 o
4 7 2 2723.11 2991.55 271.10 o
5 7 2 480.47 655.34 164.61 o
6 7 2 24435.63 22841.55 1174.78 o
7 7 2 150610.70 147292.34 2642.74 o
8 7 2 2990.11 3306.18 352.39 o
9 7 2 26518.65 28338.96 2041.16 o
0 8 2 8979.08 10353.13 582.55 o
1 8 2 34779.34 33488.57 766.66 o
2 8 2 3009.08 3393.27 276.77 o
3 8 2 58483.32 55828.41 1006.07 o
4 8 2 2334.78 2231.23 275.87 o
5 8 2 5557.45 5226.43 497.83 o
6 8 2 912.22 1101.22 212.51 o
7 8 2 31810.88 32799.26 962.54 o
8 8 2 19105.82 17399.50 1731.05 o
9 8 2 3422.51 3157.16 494.58 o
1 9 2 41657.19 40967.90 1364.00 o
2 9 2 44569.70 42974.59 925.78 o
3 9 2 21802.01 19718.29 1168.05 o
4 9 2 19588.75 19416.12 621.46 o
5 9 2 7187.57 7635.98 585.90 o
6 9 2 39139.72 36234.14 940.42 o
7 9 2 504.68 450.70 177.68 o
8 9 2 2950.26 3394.96 335.89 o
0 10 2 301831.94 313413.75 4569.73 o
1 10 2 30775.02 31381.24 670.76 o
2 10 2 1610.40 1567.98 220.24 o
3 10 2 19408.58 19562.34 654.27 o
4 10 2 36770.36 34790.49 875.39 o
5 10 2 46996.38 44623.44 1035.79 o
6 10 2 13252.77 13470.61 698.04 o
7 10 2 4817.25 5161.11 479.51 o
8 10 2 786.52 1417.82 222.31 o
1 11 2 144636.81 142162.27 2958.81 o
2 11 2 66.07 192.49 210.38 o
3 11 2 16349.72 17257.94 705.28 o
4 11 2 1380.92 2104.85 265.21 o
5 11 2 2039.74 2333.21 319.96 o
6 11 2 38892.11 38419.73 1114.15 o
7 11 2 9216.10 9336.75 724.13 o
8 11 2 561.63 1043.24 684.20 o
0 12 2 226.60 291.06 287.90 o
1 12 2 8306.46 8868.83 457.60 o
2 12 2 875.87 1146.98 235.65 o
3 12 2 2603.65 2664.21 307.44 o
4 12 2 25287.12 24046.71 780.85 o
5 12 2 28732.51 27480.69 838.23 o
6 12 2 878.75 1458.78 314.62 o
7 12 2 89.78 219.74 220.01 o
1 13 2 3370.77 4038.62 384.33 o
2 13 2 1176.42 1422.99 238.63 o
3 13 2 44197.85 42945.76 1218.41 o
4 13 2 9054.28 9930.83 723.08 o
5 13 2 14536.82 13588.46 903.35 o
6 13 2 1.86 -83.77 232.64 o
7 13 2 33446.80 36015.63 1318.38 o
0 14 2 2456.88 3183.18 1023.02 o
1 14 2 847.36 1009.45 234.28 o
2 14 2 64877.19 64240.34 1597.55 o
3 14 2 37941.30 38918.24 1404.43 o
4 14 2 1556.57 1976.62 441.68 o
5 14 2 7771.08 7725.67 675.07 o
6 14 2 5704.15 6096.94 537.45 o
1 15 2 1317.72 1657.99 332.25 o
2 15 2 44177.38 43259.88 1316.66 o
3 15 2 19467.64 20460.41 1018.72 o
4 15 2 20034.58 21013.71 1787.67 o
5 15 2 5239.31 5520.41 552.45 o
6 15 2 7291.62 8026.94 823.70 o
0 16 2 18612.83 21250.12 1895.84 o
1 16 2 7725.09 8096.13 692.68 o
2 16 2 6367.33 7390.58 719.34 o
3 16 2 31941.97 30117.53 1546.29 o
4 16 2 24079.87 22862.93 1387.23 o
5 16 2 1233.63 680.30 474.21 o
1 17 2 58112.84 58177.20 1750.96 o
2 17 2 724.22 1182.17 332.78 o
3 17 2 686.87 819.78 317.18 o
4 17 2 1829.36 2559.16 429.97 o
0 18 2 27717.37 34811.21 3038.27 o
1 18 2 11840.58 16713.28 1396.74 o
2 18 2 743.86 1379.59 532.75 o
3 18 2 72.22 -367.99 367.99 o
2 19 2 384.41 1024.58 341.77 o
1 0 3 45954.49 50627.01 2182.57 o
2 0 3 33854.70 33211.01 1373.04 o
3 0 3 136270.91 139448.52 1636.80 o
4 0 3 290.31 496.91 182.90 o
5 0 3 302902.09 305940.09 3538.45 o
6 0 3 43471.54 41450.82 1312.07 o
7 0 3 37145.31 37483.94 1822.19 o
8 0 3 5546.18 5738.21 672.54 o
9 0 3 10719.64 12795.17 1321.54 o
0 1 3 45288.60 46374.50 851.35 o
1 1 3 258612.84 264875.84 4088.83 o
2 1 3 16531.49 17115.56 503.40 o
3 1 3 6391.25 6575.60 223.46 o
4 1 3 31.80 219.31 75.53 o
5 1 3 2052.15 2267.02 194.45 o
6 1 3 4726.17 5279.66 350.73 o
7 1 3 6116.36 6483.78 463.18 o
8 1 3 124.61 497.47 188.08 o
9 1 3 483.69 610.68 276.46 o
1 2 3 2100.06 2636.92 149.78 o
2 2 3 7960.45 8300.37 208.98 o
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