#------------------------------------------------------------------------------
#$Date: 2016-04-06 16:53:24 +0300 (Wed, 06 Apr 2016) $
#$Revision: 181894 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/94/2239488.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_2239488
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   20.8535
_cell_length_b                   14.0985
_cell_length_c                   14.3640
_exptl_crystal_F_000             2080.00
_reflns_d_resolution_high        0.8348
_cod_data_source_file            xu5742Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' mo_YFL1211_0ma in Fdd2'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            653.27
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'x+1/4, -y+1/4, z+1/4'
'-x+1/4, y+1/4, z+1/4'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'x+1/4, -y+3/4, z+3/4'
'-x+1/4, y+3/4, z+3/4'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'x+3/4, -y+1/4, z+3/4'
'-x+3/4, y+1/4, z+3/4'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'x+3/4, -y+3/4, z+1/4'
'-x+3/4, y+3/4, z+1/4'
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
11 1 -15 984.44 1204.97 91.38 o
11 3 -15 1962.57 2267.94 151.77 o
10 0 -14 2835.88 2757.95 164.78 o
14 0 -14 1794.99 1960.05 156.11 o
10 2 -14 18365.94 18471.93 550.72 o
12 2 -14 70.39 145.27 110.58 o
14 2 -14 8363.74 9032.85 237.62 o
10 4 -14 4252.99 4332.07 190.80 o
12 4 -14 892.76 970.59 76.66 o
7 1 -13 9763.12 10151.52 338.24 o
9 1 -13 2460.80 2096.67 104.25 o
11 1 -13 8769.90 8953.58 229.91 o
13 1 -13 1569.12 1592.12 97.98 o
15 1 -13 5570.57 5540.17 169.99 o
7 3 -13 5020.34 5034.56 203.81 o
9 3 -13 4304.04 4153.16 342.58 o
11 3 -13 15344.89 15680.99 357.21 o
13 3 -13 2401.36 2379.32 109.88 o
15 3 -13 5265.04 5497.89 173.23 o
9 5 -13 792.96 581.08 86.73 o
11 5 -13 5643.18 5667.17 163.85 o
13 5 -13 289.60 328.79 67.46 o
8 0 -12 9366.52 9626.82 320.89 o
12 0 -12 6346.47 6365.84 247.18 o
16 0 -12 2820.11 2627.86 177.79 o
6 2 -12 242.31 130.09 69.38 o
8 2 -12 18958.82 18147.57 464.00 o
12 2 -12 30148.24 29835.99 643.90 o
14 2 -12 127.77 62.88 61.33 o
16 2 -12 12550.29 12924.70 315.83 o
6 4 -12 1304.14 1292.25 108.41 o
8 4 -12 8046.61 7816.18 193.18 o
10 4 -12 1215.38 1360.62 153.94 o
12 4 -12 5415.29 5267.46 159.36 o
14 4 -12 1013.39 1098.92 81.21 o
16 4 -12 2006.63 1874.14 113.45 o
8 6 -12 11046.22 11755.99 364.26 o
10 6 -12 370.53 238.50 82.39 o
12 6 -12 15487.10 15504.28 358.72 o
14 6 -12 365.82 293.08 80.22 o
12 8 -12 1519.68 1747.57 151.77 o
5 1 -11 17556.87 18204.22 563.73 o
7 1 -11 6208.49 5770.88 154.83 o
9 1 -11 8973.73 8919.56 216.16 o
11 1 -11 5845.75 5886.23 170.16 o
13 1 -11 17547.97 17473.19 386.32 o
15 1 -11 2640.12 2524.13 114.71 o
17 1 -11 6532.44 6440.61 190.11 o
19 1 -11 1076.05 936.33 88.76 o
5 3 -11 11714.05 11903.43 372.93 o
7 3 -11 12430.73 12467.17 286.69 o
9 3 -11 12173.93 12484.51 289.75 o
11 3 -11 6050.56 6001.91 168.56 o
13 3 -11 19713.83 19099.64 433.87 o
15 3 -11 4343.75 4380.67 179.96 o
17 3 -11 7231.02 7605.39 392.44 o
7 5 -11 9221.26 9273.46 223.78 o
9 5 -11 6666.11 6642.13 174.70 o
11 5 -11 390.96 286.79 55.19 o
13 5 -11 7013.42 6780.13 188.56 o
15 5 -11 210.01 187.50 64.17 o
17 5 -11 5166.31 5271.62 168.56 o
7 7 -11 6443.02 6669.39 225.49 o
9 7 -11 10260.74 10776.93 537.71 o
11 7 -11 8090.74 8030.48 464.00 o
13 7 -11 11297.91 12282.26 288.18 o
15 7 -11 5224.19 5564.34 394.61 o
13 9 -11 1471.22 1357.29 143.10 o
6 0 -10 25007.50 25550.09 763.21 o
10 0 -10 18718.95 17718.55 546.39 o
14 0 -10 4664.50 4635.62 203.81 o
18 0 -10 4963.46 5043.24 234.17 o
4 2 -10 5093.17 5281.74 199.47 o
6 2 -10 27954.14 27123.37 577.99 o
8 2 -10 786.83 917.66 138.76 o
10 2 -10 32582.79 33726.62 703.71 o
12 2 -10 1852.90 1852.14 101.19 o
14 2 -10 43814.00 44410.89 971.36 o
16 2 -10 422.87 336.85 67.46 o
18 2 -10 13945.66 14137.38 338.82 o
20 2 -10 55.28 43.36 67.25 o
4 4 -10 912.77 815.24 78.06 o
6 4 -10 36623.26 34951.32 746.60 o
8 4 -10 3281.59 3141.68 114.71 o
10 4 -10 6741.67 6649.93 171.71 o
12 4 -10 1753.34 1914.25 201.64 o
14 4 -10 4351.62 4466.00 142.56 o
16 4 -10 1012.53 933.04 112.75 o
18 4 -10 4549.79 4453.49 151.76 o
6 6 -10 18664.97 19487.80 581.08 o
8 6 -10 5093.35 5133.64 179.96 o
10 6 -10 20204.99 19063.18 420.05 o
12 6 -10 781.80 655.77 67.25 o
14 6 -10 22980.35 23739.02 512.04 o
16 6 -10 668.60 450.26 70.33 o
18 6 -10 9475.49 9888.70 257.51 o
10 8 -10 6552.37 6214.07 247.18 o
12 8 -10 4567.27 4141.27 208.15 o
14 8 -10 1426.54 1561.11 147.44 o
16 8 -10 2565.39 2983.45 173.46 o
12 10 -10 1724.12 1908.02 147.44 o
3 1 -9 39891.03 38706.75 1162.16 o
5 1 -9 20964.84 21930.07 453.81 o
7 1 -9 16437.16 16026.70 360.28 o
9 1 -9 16595.99 15934.27 355.69 o
11 1 -9 20233.57 20172.55 485.68 o
13 1 -9 4416.94 4922.22 355.59 o
15 1 -9 21263.93 20449.39 468.33 o
17 1 -9 3321.02 2978.49 132.26 o
19 1 -9 7791.17 7733.84 216.16 o
21 1 -9 1815.07 1708.82 116.52 o
3 3 -9 19935.20 19526.83 602.76 o
5 3 -9 9125.37 9453.36 286.20 o
7 3 -9 29410.33 28572.57 849.94 o
9 3 -9 21889.98 21196.34 663.47 o
11 3 -9 12220.15 12395.75 288.23 o
13 3 -9 9136.84 9428.05 231.37 o
15 3 -9 26293.37 25854.93 693.82 o
17 3 -9 4934.54 4451.68 148.69 o
19 3 -9 9254.66 9091.19 243.76 o
5 5 -9 19203.99 18720.26 563.73 o
7 5 -9 24765.44 25502.57 530.44 o
9 5 -9 10828.55 10515.60 459.66 o
11 5 -9 5788.74 5498.56 159.45 o
13 5 -9 1275.37 1401.94 99.74 o
15 5 -9 10534.46 10147.08 251.38 o
17 5 -9 489.00 426.96 70.33 o
19 5 -9 5659.41 5740.98 182.27 o
5 7 -9 8272.79 8269.52 251.51 o
7 7 -9 11165.15 11431.02 262.05 o
9 7 -9 9243.46 9407.64 225.23 o
11 7 -9 16666.03 17360.01 378.60 o
13 7 -9 10117.68 9920.85 290.54 o
15 7 -9 12675.33 13094.11 309.65 o
17 7 -9 6325.09 6304.44 182.27 o
9 9 -9 2272.73 2003.42 138.76 o
11 9 -9 4320.82 4375.43 195.14 o
13 9 -9 128.68 112.75 82.39 o
15 9 -9 1682.83 1773.59 151.77 o
13 11 -9 6997.02 6925.24 273.19 o
4 0 -8 93927.99 92248.32 2632.20 o
8 0 -8 64436.66 62782.46 1816.95 o
12 0 -8 1328.68 1608.81 143.10 o
16 0 -8 7817.13 7874.91 277.53 o
20 0 -8 7750.00 7666.76 307.88 o
4 2 -8 44045.06 43617.39 881.56 o
6 2 -8 5239.23 5784.76 203.81 o
8 2 -8 48146.91 51689.94 1452.70 o
10 2 -8 477.83 572.41 78.06 o
12 2 -8 45308.21 45225.25 921.42 o
14 2 -8 373.41 395.26 82.39 o
16 2 -8 50477.46 49425.42 1018.01 o
18 2 -8 763.85 631.85 70.52 o
20 2 -8 12809.68 12772.35 316.56 o
4 4 -8 100141.70 97191.78 1965.49 o
6 4 -8 2501.19 2404.05 87.03 o
8 4 -8 36026.16 35084.54 749.71 o
10 4 -8 5704.99 5605.86 153.32 o
12 4 -8 2335.41 2451.77 149.61 o
14 4 -8 2346.99 2450.53 138.76 o
16 4 -8 7162.55 7434.20 202.31 o
18 4 -8 2063.44 2129.89 107.32 o
20 4 -8 7630.97 7491.83 212.96 o
4 6 -8 13615.34 13677.02 398.95 o
6 6 -8 6626.02 6575.76 216.82 o
8 6 -8 30286.87 30381.82 637.77 o
10 6 -8 3001.72 2942.83 107.32 o
12 6 -8 33999.28 34058.90 712.87 o
14 6 -8 1445.05 1280.49 82.62 o
16 6 -8 26434.29 26300.52 624.44 o
18 6 -8 599.83 498.04 71.62 o
20 6 -8 7987.99 8138.62 223.59 o
6 8 -8 4531.34 4652.96 164.78 o
8 8 -8 19560.54 19496.20 661.30 o
10 8 -8 10389.40 11160.50 383.77 o
12 8 -8 2085.19 2256.68 171.29 o
14 8 -8 4307.95 4732.63 147.09 o
16 8 -8 1502.96 1534.84 104.12 o
18 8 -8 4301.87 4712.44 157.71 o
10 10 -8 1404.73 1157.82 121.42 o
12 10 -8 13417.87 13494.89 446.65 o
14 10 -8 854.31 724.18 99.74 o
16 10 -8 7505.60 7809.86 299.21 o
3 1 -7 11579.10 10190.67 236.11 o
5 1 -7 55220.38 53564.52 1093.13 o
7 1 -7 65338.77 61768.51 1326.17 o
9 1 -7 41620.71 41050.67 835.56 o
11 1 -7 12767.16 13486.22 394.61 o
13 1 -7 22200.68 22331.93 487.54 o
15 1 -7 5539.09 5498.24 216.82 o
17 1 -7 19186.80 19339.08 455.32 o
19 1 -7 6026.81 5860.69 210.32 o
21 1 -7 8012.85 7708.42 214.58 o
3 3 -7 40890.54 41356.54 824.82 o
5 3 -7 52236.19 51240.99 1070.13 o
7 3 -7 13610.57 12793.66 271.35 o
9 3 -7 35052.98 35974.81 1049.41 o
11 3 -7 26829.11 25636.82 797.90 o
13 3 -7 18514.33 18574.05 398.58 o
15 3 -7 13571.28 13989.24 317.35 o
17 3 -7 28530.75 28310.89 605.59 o
19 3 -7 4531.37 4360.38 145.63 o
21 3 -7 8243.96 8072.48 222.29 o
3 5 -7 31530.60 30294.12 871.62 o
5 5 -7 42617.41 43337.15 863.13 o
7 5 -7 26416.02 26720.77 548.84 o
9 5 -7 27120.84 27746.08 587.19 o
11 5 -7 8766.76 8113.67 200.68 o
13 5 -7 7375.92 7570.22 194.55 o
15 5 -7 2878.61 2688.17 109.88 o
17 5 -7 9835.53 9433.56 344.74 o
19 5 -7 1211.55 1123.15 82.79 o
21 5 -7 6925.47 6899.87 202.31 o
3 7 -7 14325.88 14930.24 420.63 o
5 7 -7 14257.20 14756.78 429.30 o
7 7 -7 15124.08 14328.59 311.13 o
9 7 -7 19593.52 19493.38 420.05 o
11 7 -7 15564.22 15170.74 324.98 o
13 7 -7 17738.94 18696.30 852.10 o
15 7 -7 13409.64 13372.14 318.73 o
17 7 -7 17083.94 17195.46 390.87 o
19 7 -7 5584.12 5499.16 168.56 o
9 9 -7 12223.08 12159.28 398.95 o
11 9 -7 93.57 20.73 49.87 o
13 9 -7 3871.11 3614.89 123.93 o
15 9 -7 76.24 32.52 55.19 o
17 9 -7 1399.85 1429.29 97.55 o
9 11 -7 7821.99 8330.23 247.18 o
11 11 -7 11410.00 10624.19 372.93 o
13 11 -7 8956.62 9501.06 329.57 o
15 11 -7 8148.40 7888.47 200.40 o
9 13 -7 2472.16 2653.88 130.09 o
2 0 -6 143570.56 138474.39 4102.24 o
6 0 -6 285150.38 283136.84 8122.08 o
10 0 -6 7541.94 7003.29 251.51 o
14 0 -6 2433.36 2558.48 151.77 o
18 0 -6 9226.75 9847.97 329.57 o
22 0 -6 12345.00 11860.07 420.63 o
2 2 -6 29721.65 27883.08 802.23 o
4 2 -6 1159.67 1058.08 69.38 o
6 2 -6 65939.16 70748.43 1977.40 o
8 2 -6 6394.31 6179.38 212.48 o
10 2 -6 87910.84 87868.55 2549.81 o
12 2 -6 1059.13 897.64 86.73 o
14 2 -6 57788.41 58723.70 1180.53 o
16 2 -6 54.62 34.03 50.52 o
18 2 -6 49255.69 47559.02 996.55 o
20 2 -6 321.43 232.00 64.39 o
22 2 -6 7934.28 7689.66 214.58 o
2 4 -6 159049.28 152637.08 4306.05 o
4 4 -6 6588.75 5762.23 139.49 o
6 4 -6 96313.19 92505.30 2586.66 o
8 4 -6 3479.76 3587.32 143.10 o
10 4 -6 24827.86 24910.94 408.21 o
12 4 -6 6408.49 6891.13 136.24 o
14 4 -6 544.61 468.09 60.41 o
16 4 -6 3275.95 3295.09 116.04 o
18 4 -6 10580.62 10163.31 254.45 o
20 4 -6 979.53 914.94 78.15 o
22 4 -6 10636.66 10994.34 277.39 o
2 6 -6 4855.45 4657.30 143.10 o
4 6 -6 10409.17 9723.22 217.45 o
6 6 -6 37581.61 39580.46 795.67 o
8 6 -6 2647.45 2341.91 91.38 o
10 6 -6 50654.17 50791.86 702.03 o
12 6 -6 5309.48 5019.28 110.13 o
14 6 -6 39905.27 39307.54 837.66 o
16 6 -6 3736.95 3480.39 125.76 o
18 6 -6 24182.81 24193.34 531.94 o
20 6 -6 1019.42 892.32 79.55 o
4 8 -6 8859.89 8850.60 277.53 o
6 8 -6 44430.95 44503.18 1227.20 o
8 8 -6 10151.65 9760.54 274.78 o
10 8 -6 5922.55 5944.79 107.66 o
12 8 -6 9074.65 9408.90 177.44 o
14 8 -6 1164.01 1205.70 66.47 o
16 8 -6 7986.23 7917.20 236.33 o
18 8 -6 3636.18 3495.75 129.64 o
20 8 -6 2069.29 2089.29 114.22 o
8 10 -6 13489.69 12570.67 283.52 o
10 10 -6 19219.89 20025.00 335.21 o
12 10 -6 563.31 457.16 54.18 o
14 10 -6 16800.31 16963.68 376.82 o
16 10 -6 409.20 318.33 57.30 o
18 10 -6 5875.73 5906.18 251.51 o
8 12 -6 6846.84 6825.50 216.82 o
10 12 -6 3952.38 3936.23 112.34 o
12 12 -6 8442.13 8851.84 217.64 o
14 12 -6 294.12 361.41 84.56 o
6 14 -6 1642.85 1708.54 112.75 o
8 14 -6 2919.35 3000.79 138.76 o
10 14 -6 4627.19 4687.65 177.79 o
1 1 -5 46658.84 44842.75 1305.26 o
3 1 -5 91094.48 90453.26 1832.11 o
5 1 -5 83618.82 84467.66 4650.79 o
7 1 -5 111453.47 107408.39 3139.56 o
9 1 -5 30162.58 29071.25 832.59 o
11 1 -5 36178.78 35051.16 1045.07 o
13 1 -5 13040.61 13503.55 466.16 o
15 1 -5 12578.46 13204.35 420.63 o
17 1 -5 8690.08 8210.59 211.57 o
19 1 -5 20456.49 20107.31 433.87 o
21 1 -5 5578.81 5836.81 171.71 o
23 1 -5 7943.75 7681.57 213.09 o
1 3 -5 56478.40 54005.58 1556.77 o
3 3 -5 47855.27 48036.27 1001.14 o
5 3 -5 44965.18 45702.54 958.22 o
7 3 -5 61559.48 58144.81 2736.27 o
9 3 -5 21776.40 20493.13 283.23 o
11 3 -5 46781.52 49096.17 672.00 o
13 3 -5 30840.07 30271.21 509.35 o
15 3 -5 22193.96 23073.29 482.94 o
17 3 -5 13136.27 13009.73 302.02 o
19 3 -5 22146.73 21497.41 472.21 o
21 3 -5 5219.85 5017.48 162.51 o
23 3 -5 5382.46 5314.30 167.09 o
3 5 -5 56295.46 54826.39 1093.11 o
5 5 -5 37558.44 35722.69 745.09 o
7 5 -5 48037.91 49060.57 794.96 o
9 5 -5 23530.25 23868.34 335.35 o
11 5 -5 28490.46 28612.28 403.28 o
13 5 -5 3828.05 3518.70 111.99 o
15 5 -5 4305.90 4018.07 98.86 o
17 5 -5 5838.30 5743.34 160.78 o
19 5 -5 11923.78 11839.36 283.52 o
21 5 -5 3481.83 3384.56 131.85 o
3 7 -5 21758.28 23069.67 659.13 o
5 7 -5 31579.64 31581.85 534.00 o
7 7 -5 27669.65 28500.94 477.20 o
9 7 -5 20199.14 19487.04 279.37 o
11 7 -5 21396.21 21248.02 311.14 o
13 7 -5 26176.12 25632.45 433.63 o
15 7 -5 27162.44 27937.16 470.30 o
17 7 -5 12022.12 11788.05 487.85 o
19 7 -5 10486.32 10749.10 268.18 o
21 7 -5 3131.50 2918.02 128.35 o
5 9 -5 28896.37 28904.61 594.84 o
7 9 -5 18170.16 18299.38 309.53 o
9 9 -5 10521.36 9613.87 204.05 o
11 9 -5 7432.30 7774.54 127.85 o
13 9 -5 103.16 107.52 38.02 o
15 9 -5 1659.10 1712.02 73.62 o
17 9 -5 1391.11 1377.73 90.62 o
19 9 -5 2109.67 1778.47 104.96 o
5 11 -5 12824.04 12267.69 385.94 o
7 11 -5 6970.21 7193.47 323.06 o
9 11 -5 8571.43 8605.10 180.28 o
11 11 -5 12175.51 12860.28 225.23 o
13 11 -5 13291.02 13527.32 308.06 o
15 11 -5 13035.80 14094.43 315.43 o
17 11 -5 6386.63 6427.53 177.53 o
5 13 -5 3635.24 3291.33 138.76 o
7 13 -5 4280.33 4294.35 121.62 o
9 13 -5 4223.62 3960.71 186.47 o
11 13 -5 1569.61 1452.22 80.87 o
13 13 -5 338.64 385.94 82.39 o
3 15 -5 759.94 763.21 82.39 o
5 15 -5 2615.85 2467.41 134.43 o
7 15 -5 2844.15 2723.26 138.76 o
4 0 -4 386152.62 384678.09 10936.41 o
8 0 -4 86018.27 86667.38 2562.81 o
12 0 -4 7413.32 7146.39 199.47 o
16 0 -4 5439.04 5312.10 208.15 o
20 0 -4 13240.28 13278.07 424.97 o
24 0 -4 17737.37 17254.55 576.74 o
2 2 -4 19875.22 19474.79 550.72 o
6 2 -4 14618.18 15336.55 326.55 o
8 2 -4 157425.22 161535.75 2208.88 o
10 2 -4 3367.00 3541.43 173.07 o
12 2 -4 130578.12 131113.64 2108.73 o
14 2 -4 1813.06 2026.72 63.56 o
16 2 -4 62973.19 64666.75 1322.60 o
18 2 -4 852.95 746.16 62.80 o
20 2 -4 31647.06 30903.41 671.52 o
22 2 -4 1173.63 1079.83 82.79 o
24 2 -4 2122.37 2026.07 145.27 o
2 4 -4 1998.11 1860.32 78.06 o
4 4 -4 144853.30 145575.94 4836.23 o
6 4 -4 17602.03 18643.17 318.61 o
8 4 -4 73108.35 75310.56 1030.95 o
10 4 -4 5965.34 5859.89 78.35 o
12 4 -4 8157.68 8262.33 115.40 o
14 4 -4 6097.68 6464.05 132.74 o
16 4 -4 1471.34 1563.16 63.02 o
18 4 -4 1952.41 1812.21 92.58 o
20 4 -4 13170.44 12829.27 302.02 o
22 4 -4 780.18 738.18 76.47 o
2 6 -4 39059.36 39803.85 1118.79 o
4 6 -4 46517.70 44413.45 744.22 o
6 6 -4 9050.17 9144.41 173.50 o
8 6 -4 70052.53 72287.78 988.35 o
10 6 -4 4790.09 4242.61 76.66 o
12 6 -4 71891.80 72480.12 1185.42 o
14 6 -4 821.92 817.39 49.12 o
16 6 -4 34656.13 34382.38 582.94 o
18 6 -4 4813.84 4492.15 140.95 o
20 6 -4 18362.74 18316.71 522.54 o
22 6 -4 752.76 712.63 77.79 o
2 8 -4 1560.49 1691.20 95.40 o
4 8 -4 100542.38 98418.21 2015.59 o
6 8 -4 11567.71 10750.12 257.61 o
8 8 -4 15104.50 14177.04 214.05 o
10 8 -4 10481.38 10235.82 151.62 o
12 8 -4 4382.87 4285.39 82.17 o
14 8 -4 16125.99 15483.31 275.19 o
16 8 -4 1688.88 1707.95 90.09 o
18 8 -4 3723.33 3762.75 133.15 o
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