#------------------------------------------------------------------------------
#$Date: 2016-04-03 06:52:24 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181305 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/83/2238357.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_2238357_Fobs
loop_
_publ_author_name
'Fakhar Bourguiba, Noura'
'Driss, Ahmed'
_publ_section_title
;
 Na~7~Al~3~(As~2~O~7~)~4~
;
_journal_coeditor_code           HB7105
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i53
_journal_volume                  69
_journal_year                    2013
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 94.140
_cell_angle_gamma                90.000
_cell_length_a                   9.8000
_cell_length_b                   8.4680
_cell_length_c                   28.6370
_exptl_crystal_F_000             2416.00
_reflns_d_resolution_high        0.7832
_cod_data_source_file            hb7105Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     '  noura1 in C 2/c'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            890.51
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -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 10642.86 8987.34 176.71 o
4 0 0 140209.84 129838.27 1324.52 o
6 0 0 21315.24 20908.68 663.72 o
8 0 0 9869.17 9268.71 555.09 o
10 0 0 110212.76 106356.16 2106.59 o
12 0 0 97.45 0.00 494.19 o
1 1 0 28650.17 28231.43 474.24 o
3 1 0 11687.10 11124.04 362.33 o
5 1 0 50431.95 44219.71 621.42 o
7 1 0 1840.57 1733.20 91.21 o
9 1 0 22469.22 22498.38 662.61 o
11 1 0 2862.22 3082.13 705.19 o
0 2 0 270883.06 277234.25 1651.07 o
2 2 0 1112.82 1832.80 101.04 o
4 2 0 1221.76 1032.97 86.32 o
6 2 0 4009.24 3808.60 282.65 o
8 2 0 3043.82 3327.03 283.26 o
10 2 0 43067.37 44366.98 1415.20 o
12 2 0 1072.64 506.38 506.38 o
1 3 0 31611.66 32771.59 485.24 o
3 3 0 101.91 244.85 98.00 o
5 3 0 507384.63 473015.59 3526.78 o
7 3 0 35.70 118.38 266.71 o
9 3 0 44081.61 41565.91 1339.08 o
11 3 0 93.07 237.47 416.46 o
0 4 0 37007.57 37956.06 842.41 o
2 4 0 25579.33 29793.49 1169.38 o
4 4 0 117520.43 112392.53 1744.52 o
6 4 0 3509.03 2947.15 239.77 o
8 4 0 20267.28 21501.41 984.46 o
10 4 0 466.69 0.00 539.86 o
1 5 0 27607.25 29652.56 607.89 o
3 5 0 25.95 499.29 159.10 o
5 5 0 49417.75 49989.53 1328.85 o
7 5 0 2357.70 2693.04 181.91 o
9 5 0 163.29 45.64 446.42 o
11 5 0 1440.17 1619.77 239.65 o
0 6 0 150564.67 151740.06 2155.33 o
2 6 0 11053.77 11811.06 1052.05 o
4 6 0 49938.33 49894.37 1432.81 o
6 6 0 639.45 726.02 452.16 o
8 6 0 3944.25 4150.53 268.28 o
10 6 0 4663.49 4732.91 311.10 o
1 7 0 45739.60 46109.95 926.07 o
3 7 0 25116.46 26766.17 730.13 o
5 7 0 3879.52 4585.26 258.30 o
7 7 0 292.70 1321.45 457.12 o
9 7 0 18331.15 17757.21 1205.16 o
0 8 0 822.29 936.44 166.89 o
2 8 0 9953.86 9897.31 536.02 o
4 8 0 11242.16 12056.95 927.18 o
6 8 0 2822.29 2715.88 254.68 o
8 8 0 174.70 234.62 531.99 o
1 9 0 5504.46 5409.96 617.34 o
3 9 0 14990.67 14783.67 700.45 o
5 9 0 1857.43 1719.03 273.19 o
0 10 0 5779.31 5128.40 468.88 o
2 10 0 149.25 23.29 342.82 o
4 10 0 24662.63 25949.45 1486.55 o
-11 1 1 13.59 536.43 262.84 o
-9 1 1 55081.36 54927.97 998.89 o
-7 1 1 30501.65 28423.10 612.79 o
-5 1 1 5983.00 5208.13 365.37 o
-3 1 1 14386.36 13401.29 332.98 o
-1 1 1 189.70 392.88 54.77 o
1 1 1 107.04 1560.00 56.13 o
3 1 1 246481.39 238602.55 1117.53 o
5 1 1 867.80 916.73 116.98 o
7 1 1 113.47 0.00 156.76 o
9 1 1 3964.56 3417.83 185.61 o
11 1 1 28405.72 28912.08 1137.24 o
-12 2 1 9193.28 8636.01 678.26 o
-10 2 1 8760.44 10113.62 733.32 o
-8 2 1 4045.70 3500.33 288.30 o
-6 2 1 6823.96 7300.66 470.66 o
-4 2 1 699.30 539.23 186.16 o
-2 2 1 44572.51 43275.84 1610.07 o
0 2 1 50419.03 50093.93 479.57 o
2 2 1 39928.71 44687.61 2174.95 o
4 2 1 12526.62 12594.00 478.19 o
6 2 1 19218.72 17921.74 668.91 o
8 2 1 10011.48 10047.67 660.80 o
10 2 1 1479.78 1549.93 174.75 o
12 2 1 364.99 1111.79 474.24 o
-11 3 1 6317.59 5844.64 449.64 o
-9 3 1 12.59 0.00 360.83 o
-7 3 1 54672.25 50906.93 1311.18 o
-5 3 1 93845.04 89988.40 1502.21 o
-3 3 1 442.83 513.03 74.17 o
-1 3 1 90565.52 98164.87 4020.79 o
1 3 1 665.24 1155.93 64.48 o
3 3 1 19271.11 20410.27 1458.40 o
5 3 1 20609.02 20070.70 718.01 o
7 3 1 9650.54 8464.94 576.52 o
9 3 1 16358.27 15969.29 872.92 o
11 3 1 2312.49 2522.34 226.84 o
-10 4 1 32.84 691.01 398.63 o
-8 4 1 672.91 978.49 360.87 o
-6 4 1 116.39 244.60 252.45 o
-4 4 1 26849.40 26696.01 858.29 o
-2 4 1 31007.06 33162.73 1016.13 o
0 4 1 2963.78 3309.41 204.49 o
2 4 1 1475.81 1373.65 78.85 o
4 4 1 49371.20 48392.85 1132.55 o
6 4 1 2218.59 1997.57 178.35 o
8 4 1 40950.67 38472.10 1265.51 o
10 4 1 3571.87 3848.43 290.38 o
-11 5 1 647.61 937.82 570.54 o
-9 5 1 16254.89 15915.08 964.94 o
-7 5 1 2958.76 3336.84 256.85 o
-5 5 1 50791.49 51978.79 1356.57 o
-3 5 1 41313.51 44047.38 1423.48 o
-1 5 1 99568.62 100207.27 1103.00 o
1 5 1 42001.88 43233.12 1046.44 o
3 5 1 405.88 598.97 159.75 o
5 5 1 24443.98 24396.37 934.96 o
7 5 1 35710.42 33591.73 1184.23 o
9 5 1 24939.38 25481.34 1132.15 o
11 5 1 6381.40 6945.62 528.84 o
-10 6 1 46269.14 48069.36 1746.07 o
-8 6 1 1094.40 1223.18 420.80 o
-6 6 1 36581.57 37106.18 1345.77 o
-4 6 1 536.15 944.96 401.52 o
-2 6 1 90255.21 92739.18 2701.23 o
0 6 1 79456.90 80977.41 2423.78 o
2 6 1 4029.36 4087.37 220.45 o
4 6 1 56740.98 57413.38 1519.56 o
6 6 1 4.57 480.64 309.49 o
8 6 1 12562.32 12535.59 905.15 o
10 6 1 515.81 978.45 479.24 o
-9 7 1 18071.83 19080.43 1170.10 o
-7 7 1 752.71 641.16 403.66 o
-5 7 1 16410.76 16955.29 977.35 o
-3 7 1 8435.25 8486.73 530.61 o
-1 7 1 6610.16 6322.01 431.23 o
1 7 1 6893.42 7104.16 343.06 o
3 7 1 2405.70 2475.75 152.65 o
5 7 1 8872.61 9267.71 739.10 o
7 7 1 4714.07 4949.47 424.59 o
9 7 1 3286.94 3883.11 280.37 o
-8 8 1 42.38 0.00 519.86 o
-6 8 1 15643.54 17622.31 1084.15 o
-4 8 1 3780.03 4369.58 278.98 o
-2 8 1 31914.74 32040.99 884.96 o
0 8 1 29616.51 30062.93 1007.08 o
2 8 1 26465.92 25666.18 791.83 o
4 8 1 64314.72 70640.36 1983.53 o
6 8 1 5681.12 6154.74 478.88 o
8 8 1 16622.58 16581.66 1202.02 o
-5 9 1 13133.17 15158.97 1093.70 o
-3 9 1 26.10 266.68 261.69 o
-1 9 1 17051.42 18104.77 736.14 o
1 9 1 2057.38 1700.62 146.26 o
3 9 1 9994.29 10795.85 1649.97 o
5 9 1 74.78 407.19 453.54 o
-4 10 1 7812.39 8413.18 616.75 o
-2 10 1 8558.55 7898.93 438.60 o
0 10 1 12755.77 11689.94 742.55 o
2 10 1 2520.61 2319.00 182.69 o
4 10 1 787.03 834.42 632.59 o
-12 0 2 47046.84 46283.70 1597.85 o
-10 0 2 17084.38 18116.29 893.70 o
-8 0 2 18504.64 18745.09 780.66 o
-6 0 2 56702.57 52274.35 1071.19 o
-4 0 2 241.40 303.81 120.53 o
-2 0 2 120292.37 111511.17 5067.71 o
2 0 2 306398.88 313462.97 1651.20 o
4 0 2 556.54 509.26 57.06 o
6 0 2 1534.73 1260.53 107.01 o
8 0 2 11856.26 11347.26 621.75 o
10 0 2 12720.76 11883.85 788.07 o
12 0 2 63157.35 68575.03 1954.81 o
-11 1 2 4301.51 5179.50 272.85 o
-9 1 2 277.69 195.17 228.42 o
-7 1 2 136.02 381.26 170.98 o
-5 1 2 136.44 314.55 204.67 o
-3 1 2 89415.11 84326.34 1247.79 o
-1 1 2 49281.37 46092.14 1171.27 o
1 1 2 15515.53 17486.63 293.97 o
3 1 2 6120.61 6957.77 426.12 o
5 1 2 6980.68 7181.51 265.98 o
7 1 2 40198.78 40461.25 717.32 o
9 1 2 687.84 829.67 263.42 o
11 1 2 2663.02 3002.85 358.83 o
-12 2 2 17010.37 16882.04 1097.03 o
-10 2 2 422.59 927.82 354.44 o
-8 2 2 53161.96 50338.48 1324.49 o
-6 2 2 68019.70 62787.82 1273.49 o
-4 2 2 7555.22 8432.92 416.71 o
-2 2 2 44535.78 45107.77 2557.58 o
0 2 2 4204.07 4194.00 253.42 o
2 2 2 399167.19 453454.47 28067.67 o
4 2 2 2442.34 2374.99 179.12 o
6 2 2 161.29 0.00 263.15 o
8 2 2 177.58 629.70 279.55 o
10 2 2 149.94 507.03 345.87 o
12 2 2 32545.59 32189.32 1359.84 o
-11 3 2 11214.71 11418.46 905.59 o
-9 3 2 12599.45 11080.70 827.41 o
-7 3 2 32890.39 31323.42 1025.34 o
-5 3 2 369.52 288.12 263.16 o
-3 3 2 1978.80 1345.89 72.24 o
-1 3 2 4500.11 4976.96 371.82 o
1 3 2 7156.26 8120.48 255.65 o
3 3 2 1001.40 924.52 149.44 o
5 3 2 56254.92 57418.48 1162.46 o
7 3 2 184532.11 170967.83 2348.22 o
9 3 2 1417.13 1115.55 397.29 o
11 3 2 7918.50 7831.13 607.50 o
-10 4 2 596.26 513.48 468.55 o
-8 4 2 3347.61 3529.68 275.41 o
-6 4 2 291.12 62.76 299.52 o
-4 4 2 31288.88 33542.83 994.22 o
-2 4 2 3494.37 4074.31 474.69 o
0 4 2 22632.79 24079.28 660.24 o
2 4 2 8075.86 9488.22 1059.95 o
4 4 2 78.22 332.32 221.07 o
6 4 2 58778.25 56767.26 1351.38 o
8 4 2 133.36 362.98 329.46 o
10 4 2 14735.81 15281.09 958.95 o
-11 5 2 22521.86 23797.48 1265.11 o
-9 5 2 1030.88 1152.56 425.08 o
-7 5 2 28533.99 29945.06 1165.68 o
-5 5 2 306.83 629.71 283.12 o
-3 5 2 125831.96 134803.88 1308.61 o
-1 5 2 9911.05 9804.27 368.42 o
1 5 2 1423.85 1338.08 225.78 o
3 5 2 1873.54 2079.29 110.85 o
5 5 2 30.85 532.70 275.26 o
7 5 2 97234.59 90381.80 1953.63 o
9 5 2 1627.70 1609.15 201.86 o
-10 6 2 391.35 1157.44 581.21 o
-8 6 2 4622.07 4875.94 376.77 o
-6 6 2 19.00 369.39 432.15 o
-4 6 2 15518.08 17353.74 866.76 o
-2 6 2 24146.04 24285.63 1767.81 o
0 6 2 54807.27 52546.42 1767.78 o
2 6 2 50702.70 51904.94 2067.79 o
4 6 2 801.29 1024.18 364.45 o
6 6 2 28544.66 27510.77 1144.10 o
8 6 2 2627.19 2500.40 231.85 o
10 6 2 37945.52 37432.37 1580.79 o
-9 7 2 743.83 1123.97 521.33 o
-7 7 2 6567.59 7646.03 630.27 o
-5 7 2 130.78 178.99 447.13 o
-3 7 2 562.87 372.44 252.78 o
-1 7 2 177.72 186.72 235.94 o
1 7 2 134574.02 135843.30 2498.16 o
3 7 2 1036.07 771.86 261.70 o
5 7 2 25331.10 26070.57 1146.23 o
7 7 2 1853.72 2018.64 224.69 o
9 7 2 394.22 1158.15 514.18 o
-8 8 2 157.48 353.71 596.89 o
-6 8 2 2593.45 2406.91 259.67 o
-4 8 2 3463.13 3263.47 293.95 o
-2 8 2 598.43 642.01 280.52 o
0 8 2 6574.33 6260.23 339.07 o
2 8 2 15249.27 17480.27 657.68 o
4 8 2 208.70 1077.54 426.45 o
6 8 2 1617.82 1673.33 243.23 o
8 8 2 506.44 1281.54 443.58 o
-5 9 2 3788.34 4018.29 327.48 o
-3 9 2 2404.73 2445.28 170.99 o
-1 9 2 4582.68 4597.60 264.93 o
1 9 2 28031.04 28208.24 1407.33 o
3 9 2 5695.50 5685.38 747.94 o
5 9 2 28942.59 30577.31 1451.09 o
-4 10 2 32786.86 35788.64 1647.78 o
-2 10 2 5741.81 5442.48 288.32 o
0 10 2 139.99 0.00 385.74 o
2 10 2 2156.67 2398.47 207.90 o
4 10 2 194.32 515.59 597.60 o
-11 1 3 4383.25 4441.09 277.93 o
-9 1 3 47216.69 43764.52 916.67 o
-7 1 3 27890.37 27577.21 796.80 o
-5 1 3 65189.53 60795.20 759.97 o
-3 1 3 6180.72 5601.45 200.73 o
-1 1 3 25025.35 23639.04 530.01 o
1 1 3 125726.55 135407.48 2447.00 o
3 1 3 2549.16 3356.93 258.42 o
5 1 3 316471.19 314593.56 3964.24 o
7 1 3 827.82 859.06 92.76 o
9 1 3 5189.46 5099.66 288.34 o
11 1 3 59.10 294.98 284.07 o
-12 2 3 20939.73 22875.41 1204.12 o
-10 2 3 182.88 204.67 357.99 o
-8 2 3 9972.93 9746.93 647.22 o
-6 2 3 2616.57 3113.85 259.73 o
-4 2 3 2942.96 2295.43 154.88 o
-2 2 3 45213.79 44261.65 507.46 o
0 2 3 56927.00 56143.20 535.98 o
2 2 3 4869.85 5097.51 184.37 o
4 2 3 1494.03 1185.72 79.19 o
6 2 3 10368.09 10495.26 523.19 o
8 2 3 9357.75 8504.92 573.57 o
10 2 3 41919.89 38393.13 1310.12 o
12 2 3 6851.32 6766.92 491.76 o
-11 3 3 132.81 146.90 423.60 o
-9 3 3 14284.23 13228.41 808.33 o
-7 3 3 14.21 280.25 269.56 o
-5 3 3 19744.05 19263.57 724.32 o
-3 3 3 1716.08 1325.77 76.68 o
-1 3 3 10.57 319.33 105.03 o
1 3 3 11947.74 14174.58 720.26 o
3 3 3 397.35 558.34 65.27 o
5 3 3 52009.27 50540.12 1095.51 o
7 3 3 14713.52 13616.77 682.16 o
9 3 3 831.75 554.16 344.48 o
11 3 3 1275.89 1257.43 210.40 o
-10 4 3 10132.03 9403.55 644.14 o
-8 4 3 3358.56 3332.04 220.47 o
-6 4 3 498.93 634.02 313.80 o
-4 4 3 83690.36 83017.47 1532.57 o
-2 4 3 10242.24 9677.99 321.59 o
0 4 3 107752.58 106656.77 1022.98 o
2 4 3 108.73 105.84 196.11 o
4 4 3 10275.29 9772.15 542.54 o
6 4 3 9773.34 8744.74 610.13 o
8 4 3 1333.30 1487.87 165.48 o
10 4 3 68181.02 67979.51 1871.52 o
-11 5 3 147.56 614.00 405.77 o
-9 5 3 16432.15 14947.65 984.26 o
-7 5 3 52541.43 54059.80 1549.99 o
-5 5 3 271.15 741.67 293.10 o
-3 5 3 125919.61 132980.34 4125.72 o
-1 5 3 4610.49 4893.41 225.40 o
1 5 3 51502.16 52585.98 820.47 o
3 5 3 3726.35 3722.84 195.53 o
5 5 3 15890.64 16089.68 753.88 o
7 5 3 10056.41 9037.04 685.71 o
9 5 3 543.40 1324.35 445.73 o
-10 6 3 2388.66 2623.63 258.23 o
-8 6 3 26214.42 26736.08 1203.99 o
-6 6 3 86.40 166.16 415.04 o
-4 6 3 1629.35 1259.02 467.94 o
-2 6 3 12796.96 13680.04 492.07 o
0 6 3 56673.24 57180.45 944.77 o
2 6 3 28183.28 29295.24 696.45 o
4 6 3 7208.58 8457.17 615.51 o
6 6 3 23685.14 24548.13 1069.46 o
8 6 3 4176.75 3980.11 343.21 o
10 6 3 13755.95 11743.52 784.38 o
-9 7 3 13896.59 14933.04 1046.59 o
-7 7 3 17633.49 17802.66 1098.10 o
-5 7 3 19754.14 20198.11 1040.81 o
-3 7 3 8777.22 9334.44 1292.32 o
-1 7 3 1052.43 788.00 255.36 o
1 7 3 61710.16 60664.55 2169.80 o
3 7 3 1258.02 1490.24 119.42 o
5 7 3 19534.00 19213.46 1110.13 o
7 7 3 3931.56 4362.39 309.66 o
9 7 3 127.39 55.62 541.26 o
-8 8 3 98925.95 103812.80 2656.77 o
-6 8 3 192.96 215.37 503.47 o
-4 8 3 17500.29 18513.79 1088.92 o
-2 8 3 21728.74 22038.42 743.11 o
0 8 3 2751.68 2636.18 157.73 o
2 8 3 68862.13 70073.27 1476.97 o
4 8 3 4047.87 4274.83 283.28 o
6 8 3 12549.47 13483.40 951.52 o
8 8 3 76.36 1336.38 509.88 o
-5 9 3 156.71 58.48 540.55 o
-3 9 3 16650.57 16963.82 786.27 o
-1 9 3 4759.60 4575.23 253.23 o
1 9 3 29384.68 29341.26 924.00 o
3 9 3 16959.37 17134.30 1096.53 o
5 9 3 212.47 289.53 528.43 o
-4 10 3 5502.59 5571.20 532.36 o
-2 10 3 5013.81 4657.54 249.33 o
0 10 3 32.66 290.43 329.61 o
2 10 3 6859.43 7678.51 477.86 o
4 10 3 241.19 516.31 532.71 o
-12 0 4 11495.31 11651.17 742.04 o
-10 0 4 51411.43 52950.27 1525.68 o
-8 0 4 31062.18 30220.20 1003.32 o
-6 0 4 88133.12 89105.02 1436.99 o
-4 0 4 142741.55 129108.25 1430.56 o
-2 0 4 7343.18 7490.20 502.46 o
0 0 4 113342.63 116777.12 6352.75 o
2 0 4 13807.22 13781.87 226.11 o
4 0 4 13302.63 17925.32 491.34 o
6 0 4 12722.58 11547.06 523.53 o
8 0 4 116.70 516.30 222.50 o
10 0 4 2223.29 2336.92 190.46 o
12 0 4 29487.62 29304.32 1283.47 o
-11 1 4 2225.23 2252.19 163.66 o
-9 1 4 3443.24 3465.30 165.79 o
-7 1 4 11886.32 11839.02 448.30 o
-5 1 4 25145.55 24404.68 992.68 o
-3 1 4 30.70 77.54 228.91 o
-1 1 4 991.42 933.77 34.39 o
1 1 4 6982.06 7574.85 131.62 o
3 1 4 7167.23 6686.87 196.66 o
5 1 4 1931.79 2168.45 130.63 o
7 1 4 39244.88 38547.55 905.54 o
9 1 4 6972.11 7361.51 789.23 o
11 1 4 3049.00 2620.23 221.16 o
-12 2 4 11319.04 12071.29 788.42 o
-10 2 4 60850.39 57763.85 1668.55 o
-8 2 4 17924.99 17028.06 826.26 o
-6 2 4 13491.72 12778.86 628.00 o
-4 2 4 14785.38 13254.99 535.79 o
-2 2 4 59840.59 60796.56 1314.18 o
0 2 4 85675.71 85959.18 2507.68 o
2 2 4 11185.50 12234.28 788.07 o
4 2 4 6420.42 6218.56 354.37 o
6 2 4 2502.74 2177.60 199.07 o
8 2 4 17265.67 17969.90 798.22 o
10 2 4 1546.75 1908.71 184.02 o
12 2 4 3502.54 3671.31 357.43 o
-11 3 4 161.03 49.21 502.04 o
-9 3 4 62042.74 61546.38 1663.16 o
-7 3 4 3952.06 3555.35 319.71 o
-5 3 4 13195.55 14428.71 658.81 o
-3 3 4 1907.14 1817.95 99.62 o
-1 3 4 35603.09 40083.66 2536.67 o
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