#------------------------------------------------------------------------------
#$Date: 2016-04-06 19:41:49 +0300 (Wed, 06 Apr 2016) $
#$Revision: 181913 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/12/2241243.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_2241243
_cell_angle_alpha                90.000
_cell_angle_beta                 94.970
_cell_angle_gamma                90.000
_cell_length_a                   7.7790
_cell_length_b                   12.7470
_cell_length_c                   18.2520
_exptl_crystal_F_000             1528.00
_reflns_d_resolution_high        0.7829
_cod_data_source_file            vn2100Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' mahdi234 in P 21/n'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            726.73
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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 7838.52 7451.04 169.12 o
4 0 0 4051.80 4641.15 216.13 o
6 0 0 114006.48 114787.07 1346.69 o
8 0 0 314.72 344.65 330.65 o
1 1 0 2412.52 2951.11 63.01 o
2 1 0 160718.39 166505.95 8536.79 o
3 1 0 216.96 233.83 64.01 o
4 1 0 73807.30 73450.52 904.43 o
5 1 0 2145.69 2206.41 113.72 o
6 1 0 63.70 323.35 150.12 o
7 1 0 14153.90 12598.95 1508.41 o
8 1 0 251.82 561.98 332.95 o
9 1 0 4017.96 3224.75 276.84 o
0 2 0 74742.44 69488.97 372.35 o
1 2 0 5732.21 6107.25 152.52 o
2 2 0 121391.86 128627.59 727.30 o
3 2 0 19670.21 21073.13 348.75 o
4 2 0 99723.74 107183.30 945.13 o
5 2 0 3683.65 3404.67 257.74 o
6 2 0 21129.41 22759.66 617.99 o
7 2 0 21.35 35.80 253.04 o
8 2 0 6063.30 5870.82 405.66 o
9 2 0 5283.40 5208.82 458.56 o
1 3 0 458.39 593.88 31.20 o
2 3 0 7429.25 7502.64 200.73 o
3 3 0 18019.04 18277.84 347.45 o
4 3 0 77546.88 80264.77 850.02 o
5 3 0 10907.45 11161.15 390.45 o
6 3 0 1889.89 1887.76 158.92 o
7 3 0 450.58 572.68 272.14 o
8 3 0 64.84 -363.85 363.85 o
9 3 0 2456.31 2892.80 291.54 o
0 4 0 78757.66 70776.74 540.48 o
1 4 0 1444.21 1408.10 73.71 o
2 4 0 265782.72 275522.53 1315.28 o
3 4 0 17358.63 19147.36 374.75 o
4 4 0 79625.42 82885.13 903.93 o
5 4 0 16478.28 18204.03 502.07 o
6 4 0 1043.19 919.83 148.42 o
7 4 0 3355.99 3395.57 315.94 o
8 4 0 35177.49 32223.38 994.24 o
9 4 0 271.01 -377.55 475.07 o
1 5 0 3956.41 4000.26 122.12 o
2 5 0 128548.19 125543.27 937.83 o
3 5 0 175.60 386.75 72.31 o
4 5 0 27182.93 27773.36 556.58 o
5 5 0 6228.63 6336.88 349.85 o
6 5 0 5013.51 5504.17 389.05 o
7 5 0 5832.28 5728.30 385.15 o
8 5 0 5572.82 5930.92 442.56 o
9 5 0 1164.69 -295.64 524.57 o
0 6 0 110181.12 99620.46 825.51 o
1 6 0 42667.59 40305.21 533.57 o
2 6 0 22407.23 21508.49 418.36 o
3 6 0 3015.41 3170.34 209.73 o
4 6 0 1563.56 1794.15 132.12 o
5 6 0 7159.97 6996.77 393.75 o
6 6 0 19466.51 20045.99 694.70 o
7 6 0 9361.57 9091.26 588.78 o
8 6 0 8222.07 7218.00 517.87 o
9 6 0 417.64 853.02 278.54 o
1 7 0 2081.24 1975.77 100.71 o
2 7 0 178.41 215.53 148.12 o
3 7 0 1229.40 1374.09 112.02 o
4 7 0 7521.45 7828.89 364.15 o
5 7 0 630.98 729.60 148.12 o
6 7 0 21213.85 21563.30 730.00 o
7 7 0 5193.45 4640.45 362.45 o
8 7 0 2676.71 2140.70 276.74 o
0 8 0 83021.70 77547.48 893.12 o
1 8 0 30248.89 29899.86 403.66 o
2 8 0 1240.63 1179.56 116.82 o
3 8 0 18865.95 19494.91 531.47 o
4 8 0 13619.50 14864.17 534.07 o
5 8 0 5491.76 5803.21 420.26 o
6 8 0 29275.97 28293.63 888.82 o
7 8 0 1616.23 1919.17 261.24 o
8 8 0 1146.34 1389.99 278.54 o
1 9 0 1682.65 1639.33 95.51 o
2 9 0 9314.43 9145.87 396.76 o
3 9 0 3754.69 4691.45 332.65 o
4 9 0 26585.92 27748.46 756.31 o
5 9 0 361.82 39.41 345.75 o
6 9 0 60.06 -211.43 361.65 o
7 9 0 565.47 858.92 414.86 o
8 9 0 255.91 726.50 545.88 o
0 10 0 176.11 346.25 207.13 o
1 10 0 6903.44 7144.89 380.75 o
2 10 0 7406.27 7501.24 437.36 o
3 10 0 23234.31 22234.79 686.00 o
4 10 0 7537.38 6870.46 493.87 o
5 10 0 25797.22 25171.80 869.62 o
6 10 0 43.86 551.78 404.56 o
7 10 0 1485.86 1169.96 514.77 o
1 11 0 1434.10 1517.51 176.12 o
2 11 0 1084.86 1167.96 173.42 o
3 11 0 3745.43 4300.60 331.05 o
4 11 0 5968.56 5989.33 402.96 o
5 11 0 3884.35 3946.75 312.84 o
6 11 0 100.21 471.67 379.85 o
7 11 0 594.87 420.76 563.18 o
0 12 0 7.14 357.85 261.64 o
1 12 0 25674.54 26078.03 789.81 o
2 12 0 5922.48 6121.45 468.17 o
3 12 0 4685.36 4714.46 396.56 o
4 12 0 242.59 479.77 377.05 o
5 12 0 4656.30 4311.70 320.04 o
6 12 0 638.47 983.54 297.54 o
1 13 0 1224.27 1235.67 423.16 o
2 13 0 878.96 827.32 365.45 o
3 13 0 113.32 613.69 396.16 o
4 13 0 311.81 823.31 254.64 o
5 13 0 685.58 1206.37 288.54 o
0 14 0 302.08 940.33 433.96 o
1 14 0 9152.47 10226.42 670.09 o
2 14 0 434.15 1214.27 455.16 o
3 14 0 13173.91 13181.13 784.41 o
4 14 0 4.58 166.92 446.76 o
5 14 0 1213.65 1873.36 337.95 o
1 15 0 20.41 438.76 429.66 o
2 15 0 798.30 706.30 507.67 o
3 15 0 1603.56 1166.06 542.28 o
0 16 0 219.62 828.02 535.17 o
1 16 0 2651.33 3078.13 345.25 o
-9 0 1 388.08 237.83 407.56 o
-7 0 1 3795.25 3303.76 254.84 o
-5 0 1 634.47 635.29 86.11 o
-3 0 1 2657.34 2618.26 137.12 o
-1 0 1 25106.73 25908.31 385.95 o
1 0 1 45530.16 48950.01 664.79 o
3 0 1 350.81 276.14 106.01 o
5 0 1 3692.55 4737.36 257.14 o
7 0 1 23986.65 23681.70 712.70 o
9 0 1 17128.76 14421.71 806.81 o
-9 1 1 2265.61 1952.57 400.56 o
-8 1 1 2589.09 2495.65 196.03 o
-7 1 1 319.70 228.53 261.44 o
-6 1 1 122723.66 124442.30 925.83 o
-5 1 1 56.91 22.80 93.81 o
-4 1 1 2488.72 2577.36 118.22 o
-3 1 1 344.12 403.16 33.80 o
-2 1 1 1993.43 2012.28 72.61 o
-1 1 1 871.16 1234.37 32.80 o
1 1 1 14842.43 14777.26 450.56 o
2 1 1 2927.25 3985.65 218.53 o
3 1 1 10863.39 11172.95 226.03 o
4 1 1 27291.56 28864.71 317.44 o
5 1 1 1181.29 1214.17 76.01 o
6 1 1 11195.32 12012.27 326.75 o
7 1 1 2911.48 3093.53 248.83 o
8 1 1 135.32 518.57 220.63 o
9 1 1 1980.92 2190.20 197.23 o
-9 2 1 1615.50 2082.39 271.64 o
-8 2 1 12561.03 12154.19 639.09 o
-7 2 1 15.32 -36.41 284.34 o
-6 2 1 13.19 211.63 211.63 o
-5 2 1 2047.72 2228.71 182.13 o
-4 2 1 100495.73 100166.62 923.03 o
-3 2 1 77.72 138.32 84.81 o
-2 2 1 373274.84 389459.47 1402.70 o
-1 2 1 1283.44 1479.01 75.21 o
0 2 1 485.99 414.46 40.61 o
1 2 1 6891.48 7200.20 375.65 o
2 2 1 40975.05 43433.34 414.76 o
3 2 1 22351.37 22197.79 358.15 o
4 2 1 25067.54 26934.15 474.57 o
5 2 1 34515.99 36998.95 660.59 o
6 2 1 9070.59 8838.03 419.86 o
7 2 1 4403.57 4813.77 384.65 o
8 2 1 5164.30 4901.08 376.75 o
9 2 1 4966.39 4492.12 405.76 o
-9 3 1 2170.10 2008.38 261.64 o
-8 3 1 24246.97 23235.43 869.62 o
-7 3 1 65.94 112.22 271.04 o
-6 3 1 7411.59 7999.31 401.26 o
-5 3 1 4773.69 4993.59 291.84 o
-4 3 1 120915.68 124946.18 1069.05 o
-3 3 1 8873.20 8720.41 250.93 o
-2 3 1 208083.25 208154.05 1046.35 o
-1 3 1 641.18 676.79 47.71 o
0 3 1 41837.84 38988.72 732.60 o
1 3 1 11184.08 11145.95 660.49 o
2 3 1 61479.40 63294.40 544.38 o
3 3 1 3849.34 4190.28 182.93 o
4 3 1 19085.10 20297.92 433.36 o
5 3 1 6859.24 6708.93 338.05 o
6 3 1 3546.16 3821.73 263.84 o
7 3 1 452.99 496.57 293.74 o
8 3 1 7134.10 7537.35 576.38 o
9 3 1 72.38 363.35 399.46 o
-9 4 1 135.78 569.88 438.66 o
-8 4 1 890.22 1191.47 429.96 o
-7 4 1 93.57 58.51 280.84 o
-6 4 1 232.46 400.46 230.53 o
-5 4 1 1792.66 2191.90 170.02 o
-4 4 1 29048.77 30056.08 550.68 o
-3 4 1 10700.69 10211.92 289.14 o
-2 4 1 212.21 219.63 51.41 o
-1 4 1 784.90 808.81 41.71 o
0 4 1 22508.30 22375.91 258.24 o
1 4 1 666.00 721.30 50.61 o
2 4 1 44458.90 44779.62 506.57 o
3 4 1 21471.30 21275.86 399.66 o
4 4 1 9304.56 10178.02 335.95 o
5 4 1 23048.74 24356.59 577.58 o
6 4 1 118.64 15.20 230.63 o
7 4 1 7140.74 7631.16 492.27 o
8 4 1 2467.50 2706.48 259.64 o
9 4 1 1272.09 816.21 500.27 o
-9 5 1 138.76 0.00 491.27 o
-8 5 1 17296.64 15435.55 801.21 o
-7 5 1 5160.70 5748.30 445.36 o
-6 5 1 537.30 801.91 148.82 o
-5 5 1 9084.95 10148.61 404.96 o
-4 5 1 41504.08 43290.12 697.20 o
-3 5 1 17008.46 16688.22 390.15 o
-2 5 1 10725.76 10001.09 278.14 o
-1 5 1 29927.71 27500.82 282.44 o
0 5 1 11846.35 10476.56 264.34 o
1 5 1 6643.18 6665.93 187.93 o
2 5 1 173226.52 181939.70 1138.56 o
3 5 1 130.88 -97.91 136.72 o
4 5 1 647.97 966.53 104.11 o
5 5 1 11365.69 11456.19 452.96 o
6 5 1 553.83 1109.85 149.62 o
7 5 1 14598.05 13243.84 641.79 o
8 5 1 4021.85 3998.96 318.94 o
9 5 1 720.96 986.64 490.07 o
-9 6 1 18.28 346.65 438.46 o
-8 6 1 6284.33 6133.75 447.76 o
-7 6 1 1626.60 1746.74 220.73 o
-6 6 1 589.15 624.79 305.54 o
-5 6 1 2863.92 3174.54 249.73 o
-4 6 1 35710.91 36875.13 684.40 o
-3 6 1 4905.47 5407.95 256.74 o
-2 6 1 48260.04 45256.00 605.78 o
-1 6 1 10139.73 9450.71 193.23 o
0 6 1 57489.12 51610.08 418.26 o
1 6 1 24405.82 23227.73 415.86 o
2 6 1 26468.65 25960.31 459.66 o
3 6 1 7258.30 8037.92 302.64 o
4 6 1 7699.42 8079.82 359.35 o
5 6 1 1781.25 2210.71 157.32 o
6 6 1 29903.77 32438.11 834.32 o
7 6 1 20318.20 19499.51 790.11 o
8 6 1 1521.01 1326.08 448.86 o
9 6 1 5437.32 4267.39 378.25 o
-8 7 1 204.88 265.24 424.06 o
-7 7 1 18527.85 18111.02 793.01 o
-6 7 1 43316.10 43065.89 999.24 o
-5 7 1 4544.23 4731.86 311.24 o
-4 7 1 656.63 816.51 120.32 o
-3 7 1 3884.98 3829.03 251.63 o
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0 7 1 125969.46 117682.77 959.13 o
1 7 1 27635.31 26276.25 553.68 o
2 7 1 566.21 532.67 87.61 o
3 7 1 47447.29 48711.68 752.10 o
4 7 1 2555.05 2582.36 209.83 o
5 7 1 149.05 125.12 234.03 o
6 7 1 8750.43 8369.36 532.17 o
7 7 1 318.85 287.94 367.05 o
8 7 1 227.08 207.43 454.36 o
-8 8 1 32.90 -285.64 482.37 o
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-6 8 1 302.78 822.31 355.95 o
-5 8 1 5066.02 5777.20 402.26 o
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-3 8 1 165.86 47.81 212.33 o
-2 8 1 7302.61 6907.46 323.65 o
-1 8 1 123.72 76.71 104.41 o
0 8 1 45993.67 43305.82 566.08 o
1 8 1 577.82 649.59 68.61 o
2 8 1 1874.01 2144.80 175.82 o
3 8 1 20947.52 21922.75 563.68 o
4 8 1 12366.51 13357.16 513.17 o
5 8 1 5548.49 5562.77 428.36 o
6 8 1 16628.06 17381.62 697.20 o
7 8 1 117.10 393.35 408.76 o
8 8 1 1104.46 993.54 509.77 o
-8 9 1 125.67 0.00 526.97 o
-7 9 1 1807.00 1978.48 274.34 o
-6 9 1 5166.44 4669.05 367.25 o
-5 9 1 14648.83 14487.81 644.39 o
-4 9 1 462.96 596.38 149.92 o
-3 9 1 35031.08 36092.42 758.71 o
-2 9 1 31363.67 30797.08 676.79 o
-1 9 1 24926.54 23584.48 446.96 o
0 9 1 2704.51 2634.97 128.82 o
1 9 1 2777.24 2715.18 150.82 o
2 9 1 15647.79 15846.10 490.17 o
3 9 1 19041.81 20314.42 587.98 o
4 9 1 24912.06 25036.48 715.80 o
5 9 1 13202.93 13941.54 637.29 o
6 9 1 923.54 804.51 369.55 o
7 9 1 61.47 -144.12 418.76 o
8 9 1 76.30 383.35 510.97 o
-7 10 1 324.52 -220.53 468.27 o
-6 10 1 236.19 -368.75 368.75 o
-5 10 1 53.17 -361.65 361.65 o
-4 10 1 812.64 716.90 331.15 o
-3 10 1 368.22 634.19 271.64 o
-2 10 1 16350.97 16688.62 549.68 o
-1 10 1 8497.26 8371.86 416.76 o
0 10 1 4642.50 4981.39 230.63 o
1 10 1 180.39 263.04 227.93 o
2 10 1 10787.04 10227.22 467.47 o
3 10 1 512.29 408.26 256.64 o
4 10 1 42857.36 43819.70 1014.54 o
5 10 1 14933.61 14848.67 692.60 o
6 10 1 202.05 952.83 383.55 o
7 10 1 357.92 31.90 475.67 o
-7 11 1 2851.01 2447.64 351.95 o
-6 11 1 666.56 911.53 444.96 o
-5 11 1 19950.26 20992.52 868.42 o
-4 11 1 948.88 1022.34 219.33 o
-3 11 1 12278.27 11406.09 560.08 o
-2 11 1 1414.51 877.82 308.34 o
-1 11 1 17525.52 17911.09 620.49 o
0 11 1 4003.90 4063.57 218.83 o
1 11 1 28269.15 28151.42 745.90 o
2 11 1 13272.17 14526.92 568.78 o
3 11 1 449.78 550.58 300.74 o
4 11 1 257.05 551.38 350.85 o
5 11 1 11307.26 11164.55 681.49 o
6 11 1 1415.70 1277.78 461.36 o
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-6 12 1 1695.94 2172.10 322.74 o
-5 12 1 202.05 721.20 394.45 o
-4 12 1 3062.42 3291.06 284.34 o
-3 12 1 739.95 975.64 208.93 o
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-1 12 1 114.22 447.96 289.54 o
0 12 1 641.50 852.62 159.52 o
1 12 1 4286.38 3781.43 248.13 o
2 12 1 19248.45 18622.59 725.50 o
3 12 1 2098.13 2124.50 227.13 o
4 12 1 829.92 533.87 401.16 o
5 12 1 268.22 465.76 449.06 o
6 12 1 1593.09 1603.72 536.67 o
-5 13 1 4824.76 5540.57 466.46 o
-4 13 1 1203.74 784.11 479.77 o
-3 13 1 5879.10 5499.77 444.06 o
-2 13 1 4158.49 5007.20 405.46 o
-1 13 1 6647.10 7078.78 538.07 o
0 13 1 1.50 -250.43 250.43 o
1 13 1 30719.84 29938.86 943.53 o
2 13 1 2764.35 2526.45 263.24 o
3 13 1 7867.80 8763.32 594.48 o
4 13 1 4737.90 4991.79 400.66 o
5 13 1 115.28 596.08 493.47 o
-5 14 1 1667.34 1533.71 563.58 o
-4 14 1 215.57 900.83 451.36 o
-3 14 1 701.34 -148.22 488.07 o
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-1 14 1 4743.00 4525.33 402.66 o
0 14 1 10916.61 11915.76 506.87 o
1 14 1 67.42 538.47 423.96 o
2 14 1 912.31 896.22 250.13 o
3 14 1 3506.46 3757.32 326.65 o
4 14 1 490.52 -335.85 565.98 o
-3 15 1 16704.83 16119.44 920.33 o
-2 15 1 389.30 514.17 489.47 o
-1 15 1 6789.80 6901.36 585.48 o
0 15 1 14.96 293.34 359.95 o
1 15 1 237.77 785.81 463.06 o
2 15 1 3145.47 3526.09 331.65 o
3 15 1 11215.70 10847.71 847.62 o
-1 16 1 1580.20 511.77 647.79 o
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1 16 1 2623.58 2183.70 358.35 o
-8 0 2 2217.15 2219.41 211.73 o
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-4 0 2 3122.95 3248.25 164.42 o
-2 0 2 14065.93 14907.57 198.93 o
0 0 2 64144.75 66507.64 444.46 o
2 0 2 35133.82 39251.56 350.05 o
4 0 2 71449.70 77483.68 764.01 o
6 0 2 1768.91 2007.28 182.73 o
8 0 2 6.48 -67.91 300.94 o
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-8 1 2 10911.47 9764.06 389.75 o
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-5 1 2 1552.08 1876.16 362.35 o
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5 1 2 10148.62 10850.31 251.33 o
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8 1 2 2267.18 2139.60 157.52 o
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-3 2 2 1632.35 1572.52 104.71 o
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0 2 2 48366.02 44625.00 2853.10 o
1 2 2 392.93 384.05 62.11 o
2 2 2 10105.51 10767.80 219.73 o
3 2 2 2964.16 3556.79 168.72 o
4 2 2 9359.15 9588.93 300.24 o
5 2 2 19995.08 21029.13 516.17 o
6 2 2 1561.33 1658.93 152.02 o
7 2 2 18351.88 20161.90 674.79 o
8 2 2 1089.58 1448.60 193.73 o
9 2 2 531.85 89.21 452.06 o
-9 3 2 7.71 -247.83 446.86 o
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-6 3 2 1121.85 1209.47 150.02 o
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-1 3 2 24273.76 22367.91 489.47 o
0 3 2 16200.65 15026.39 665.79 o
1 3 2 16986.99 15399.74 1303.08 o
2 3 2 16232.29 16577.11 290.24 o
3 3 2 7312.76 7756.38 241.83 o
4 3 2 6543.32 7050.18 276.14 o
5 3 2 104046.52 113485.07 1190.67 o
6 3 2 860.63 1067.15 145.92 o
7 3 2 16798.56 16970.56 649.79 o
8 3 2 5161.55 4636.65 395.15 o
9 3 2 373.19 550.58 479.77 o
-9 4 2 2047.90 1311.78 506.87 o
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-7 4 2 581.21 830.72 294.74 o
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-5 4 2 8400.38 7510.24 389.75 o
-4 4 2 96864.55 96576.83 993.04 o
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