#------------------------------------------------------------------------------
#$Date: 2020-07-22 08:19:20 +0300 (Wed, 22 Jul 2020) $
#$Revision: 254475 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/35/2243506.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_2243506
_cell_angle_alpha                90.000
_cell_angle_beta                 92.977
_cell_angle_gamma                90.000
_cell_length_a                   15.1743
_cell_length_b                   4.1188
_cell_length_c                   15.7853
_exptl_crystal_F_000             696.00
_reflns_d_resolution_high        0.6492
_cod_data_source_file            zl2791Vsup11.hkl
_cod_data_source_block           V
_shelx_title                     ' Berry838_b.res in Cc'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            309.10
_shelx_f_squared_multiplier      1.000
loop_
_space_group_symop_operation_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'
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
-3 1 -23 1592.20 1793.07 361.47 o
-1 1 -23 1904.99 1925.00 261.65 o
1 1 -23 1332.82 1021.15 227.35 o
3 1 -23 969.59 832.27 223.68 o
5 1 -23 67.22 172.17 280.61 o
-6 0 -22 4442.92 4210.16 425.20 o
-4 0 -22 1961.02 1931.00 320.57 o
-2 0 -22 82.16 116.05 231.15 o
0 0 -22 2432.91 2494.13 333.88 o
2 0 -22 3385.59 3799.22 397.62 o
4 0 -22 8891.70 9632.18 588.81 o
6 0 -22 3372.30 3671.76 410.93 o
8 0 -22 536.64 384.30 276.81 o
10 0 -22 203.55 -63.73 294.88 o
-7 1 -22 146.53 91.32 260.64 o
-5 1 -22 1910.28 2122.03 241.79 o
-3 1 -22 3601.76 3415.31 322.47 o
-1 1 -22 2309.60 2326.73 264.92 o
1 1 -22 1646.78 1624.20 224.27 o
3 1 -22 313.70 432.02 184.94 o
5 1 -22 493.25 573.42 196.73 o
7 1 -22 2638.37 2470.71 266.23 o
9 1 -22 2748.12 2757.62 387.15 o
-4 2 -22 89.03 39.00 253.98 o
-2 2 -22 397.48 331.05 208.17 o
0 2 -22 12.97 -36.42 181.16 o
2 2 -22 298.01 451.40 198.76 o
4 2 -22 17.06 -168.05 193.11 o
6 2 -22 247.38 88.46 269.20 o
-9 1 -21 108.42 352.55 212.52 o
-7 1 -21 1131.48 1389.28 300.59 o
-5 1 -21 1465.53 1494.92 293.46 o
-3 1 -21 4849.47 4396.13 295.05 o
-1 1 -21 2355.46 2680.47 384.77 o
1 1 -21 145.93 -39.97 154.95 o
3 1 -21 182.91 287.61 168.37 o
5 1 -21 2189.52 2667.08 243.74 o
7 1 -21 3975.42 4229.68 472.29 o
9 1 -21 791.62 655.81 241.14 o
11 1 -21 2410.16 2618.74 472.76 o
-6 2 -21 2085.26 2448.63 666.81 o
-4 2 -21 853.68 1195.79 218.08 o
-2 2 -21 973.90 1094.43 368.60 o
0 2 -21 4941.13 5238.46 333.10 o
2 2 -21 4906.88 4919.89 672.05 o
4 2 -21 5370.73 5753.46 342.70 o
6 2 -21 1380.49 849.41 208.55 o
8 2 -21 215.14 137.93 359.57 o
-3 3 -21 2400.23 2461.74 791.43 o
-1 3 -21 2435.60 2115.27 393.81 o
1 3 -21 897.18 703.25 173.84 o
3 3 -21 680.74 319.66 217.91 o
5 3 -21 1649.10 868.48 390.01 o
-12 0 -20 2417.94 2042.30 348.15 o
-10 0 -20 6141.19 6370.40 495.59 o
-8 0 -20 4364.76 5213.71 448.03 o
-6 0 -20 1133.19 746.72 239.71 o
-4 0 -20 1752.29 2093.66 292.98 o
-2 0 -20 3908.33 3591.85 346.25 o
0 0 -20 11560.90 13572.19 650.64 o
2 0 -20 7354.29 8526.85 506.06 o
4 0 -20 4095.42 3721.22 366.22 o
6 0 -20 1091.12 1155.75 276.81 o
8 0 -20 3550.24 3293.17 351.96 o
10 0 -20 3008.15 3471.05 378.59 o
12 0 -20 3788.41 3443.46 392.86 o
-11 1 -20 387.53 367.18 364.32 o
-9 1 -20 606.26 649.17 230.67 o
-7 1 -20 2021.52 1599.64 213.07 o
-5 1 -20 2695.05 2731.87 235.59 o
-3 1 -20 4438.23 4893.14 410.93 o
-1 1 -20 3235.90 3214.45 294.88 o
1 1 -20 17.45 18.33 150.77 o
3 1 -20 1113.63 1285.67 214.98 o
5 1 -20 4580.88 4464.70 287.91 o
7 1 -20 3678.74 3710.40 266.23 o
9 1 -20 1805.94 1627.62 219.20 o
11 1 -20 1018.89 497.49 286.32 o
13 1 -20 102.04 129.37 298.69 o
-8 2 -20 560.77 463.25 312.00 o
-6 2 -20 1632.18 1717.84 229.07 o
-4 2 -20 47.16 7.22 161.22 o
-2 2 -20 72.28 75.53 158.65 o
0 2 -20 118.75 148.66 160.41 o
2 2 -20 1502.54 1808.21 209.50 o
4 2 -20 178.92 238.46 164.83 o
6 2 -20 304.17 190.99 163.48 o
8 2 -20 540.49 585.96 303.44 o
10 2 -20 387.62 308.20 309.15 o
-5 3 -20 1514.23 1906.27 402.37 o
-3 3 -20 442.07 334.42 154.57 o
-1 3 -20 574.36 523.48 133.37 o
1 3 -20 385.93 248.01 128.95 o
3 3 -20 465.81 530.01 135.93 o
5 3 -20 939.90 950.89 197.96 o
7 3 -20 2543.92 3546.19 520.32 o
-11 1 -19 1371.96 1543.85 335.79 o
-9 1 -19 264.50 -41.75 321.52 o
-7 1 -19 3620.04 3696.76 263.15 o
-5 1 -19 1214.02 875.41 170.81 o
-3 1 -19 2513.52 2697.21 225.32 o
-1 1 -19 1264.59 1602.94 189.27 o
1 1 -19 1831.24 1944.08 196.28 o
3 1 -19 2036.84 2391.95 209.90 o
5 1 -19 2352.50 2719.34 224.72 o
7 1 -19 4123.45 4250.38 272.25 o
9 1 -19 641.88 432.30 166.61 o
11 1 -19 485.43 405.17 190.97 o
13 1 -19 138.13 6.66 267.30 o
-10 2 -19 3427.01 3433.95 454.69 o
-8 2 -19 2423.65 2360.01 372.88 o
-6 2 -19 1709.81 1912.61 224.41 o
-4 2 -19 1711.09 2185.63 222.42 o
-2 2 -19 3062.39 3097.33 193.68 o
0 2 -19 6389.74 6358.90 267.62 o
2 2 -19 5017.31 5092.62 339.61 o
4 2 -19 1823.94 2084.16 181.72 o
6 2 -19 333.86 139.13 133.11 o
8 2 -19 3341.74 3697.16 303.86 o
10 2 -19 4401.56 5018.31 487.51 o
12 2 -19 4098.68 4205.78 361.13 o
-7 3 -19 975.94 653.95 229.38 o
-5 3 -19 4230.42 4336.64 386.75 o
-3 3 -19 3442.48 3894.92 414.50 o
-1 3 -19 1593.79 1637.02 175.88 o
1 3 -19 702.40 693.61 124.87 o
3 3 -19 1623.72 1531.98 210.84 o
5 3 -19 4201.25 4010.25 519.52 o
7 3 -19 2388.84 2432.91 294.47 o
9 3 -19 2519.30 2374.28 473.71 o
-12 0 -18 1251.75 1259.43 285.37 o
-10 0 -18 4727.44 4635.36 425.20 o
-8 0 -18 6754.06 7686.91 477.52 o
-6 0 -18 1954.71 1846.34 260.64 o
-4 0 -18 3658.57 3550.95 328.18 o
-2 0 -18 2420.00 2375.23 284.42 o
0 0 -18 11675.43 12206.22 570.74 o
2 0 -18 2808.16 3101.97 302.49 o
4 0 -18 5038.99 5855.79 398.57 o
6 0 -18 679.02 450.88 212.12 o
8 0 -18 5134.51 5455.32 403.32 o
10 0 -18 7156.20 7144.71 461.35 o
12 0 -18 3908.87 4029.42 385.25 o
14 0 -18 665.41 442.32 289.17 o
-13 1 -18 1613.82 1189.99 330.08 o
-11 1 -18 1811.20 1519.12 311.05 o
-9 1 -18 598.64 595.33 166.01 o
-7 1 -18 2297.77 2292.42 208.75 o
-5 1 -18 3915.49 3942.67 819.01 o
-3 1 -18 3835.41 3629.43 239.73 o
-1 1 -18 1241.06 1501.88 171.04 o
1 1 -18 1254.31 1087.51 162.57 o
3 1 -18 3083.87 3153.07 225.81 o
5 1 -18 3352.08 3504.13 235.82 o
7 1 -18 4736.75 4614.98 272.05 o
9 1 -18 947.77 773.66 171.13 o
11 1 -18 294.23 132.49 151.09 o
13 1 -18 1370.23 1705.56 331.03 o
15 1 -18 3133.80 2703.40 396.66 o
-12 2 -18 854.68 1075.84 563.13 o
-10 2 -18 554.78 535.29 236.00 o
-8 2 -18 288.69 145.09 173.86 o
-6 2 -18 238.50 300.88 115.23 o
-4 2 -18 505.55 441.83 113.12 o
-2 2 -18 1129.93 1128.66 114.29 o
0 2 -18 160.94 75.10 88.62 o
2 2 -18 1316.48 1335.68 113.72 o
4 2 -18 938.26 960.81 177.94 o
6 2 -18 132.37 133.07 125.13 o
8 2 -18 115.83 139.06 143.04 o
10 2 -18 623.26 675.78 215.39 o
12 2 -18 669.54 513.15 227.86 o
14 2 -18 12.92 168.37 393.81 o
-9 3 -18 198.40 144.45 210.99 o
-7 3 -18 775.19 622.57 172.27 o
-5 3 -18 12.81 303.50 154.93 o
-3 3 -18 984.83 987.03 140.00 o
-1 3 -18 838.72 692.51 126.13 o
1 3 -18 664.08 557.11 112.98 o
3 3 -18 1251.32 1370.30 293.27 o
5 3 -18 695.39 573.40 162.53 o
7 3 -18 380.38 171.70 150.71 o
9 3 -18 13.47 3.71 154.43 o
11 3 -18 1047.00 644.94 403.32 o
-2 4 -18 1561.05 1393.54 431.82 o
0 4 -18 2128.46 2063.20 170.77 o
2 4 -18 3122.19 3264.26 215.58 o
4 4 -18 574.39 445.62 196.66 o
-15 1 -17 3118.05 2380.94 405.23 o
-13 1 -17 786.22 879.89 295.83 o
-11 1 -17 2193.33 1503.90 308.20 o
-9 1 -17 101.03 -7.38 129.74 o
-7 1 -17 3443.95 3473.54 238.32 o
-5 1 -17 1790.32 1704.34 261.11 o
-3 1 -17 5013.54 5557.25 439.95 o
-1 1 -17 2362.44 2305.66 192.99 o
1 1 -17 924.01 1117.27 308.41 o
3 1 -17 2645.93 2907.74 175.17 o
5 1 -17 1516.66 1439.15 143.25 o
7 1 -17 3509.13 3606.99 250.46 o
9 1 -17 253.18 160.96 131.88 o
11 1 -17 2107.51 2220.51 179.05 o
13 1 -17 611.64 522.95 200.64 o
15 1 -17 1646.51 1700.11 483.70 o
17 1 -17 377.47 327.22 430.91 o
-14 2 -17 1255.19 1370.73 343.39 o
-12 2 -17 2735.49 3206.38 311.05 o
-10 2 -17 5904.44 5950.84 886.55 o
-8 2 -17 6537.70 7139.47 298.31 o
-6 2 -17 1311.72 1403.90 132.89 o
-4 2 -17 1626.60 1793.42 138.88 o
-2 2 -17 3245.10 3732.37 159.93 o
0 2 -17 8738.98 9732.16 234.61 o
2 2 -17 4990.79 5050.53 199.99 o
4 2 -17 2829.82 2911.19 162.16 o
6 2 -17 1828.71 2091.35 146.82 o
8 2 -17 3203.21 3011.80 198.59 o
10 2 -17 4406.71 4641.77 330.51 o
12 2 -17 2079.68 1808.22 384.30 o
14 2 -17 1352.35 1011.67 252.59 o
-11 3 -17 99.23 79.00 216.36 o
-9 3 -17 1906.45 1928.00 209.47 o
-7 3 -17 1821.84 1916.01 250.72 o
-5 3 -17 7513.66 7730.73 551.34 o
-3 3 -17 3127.41 3207.00 161.26 o
-1 3 -17 1005.36 971.93 143.52 o
1 3 -17 653.49 660.88 119.26 o
3 3 -17 3961.24 4056.14 216.79 o
5 3 -17 6142.74 6526.72 295.34 o
7 3 -17 2226.51 2257.39 433.59 o
9 3 -17 1841.35 1939.09 201.47 o
11 3 -17 117.93 164.98 192.92 o
-4 4 -17 441.29 368.62 171.55 o
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2 4 -17 1235.10 1306.05 185.22 o
4 4 -17 245.77 177.09 155.87 o
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-10 0 -16 11309.54 11590.77 579.30 o
-8 0 -16 9824.61 10833.59 539.35 o
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-4 0 -16 4646.26 4810.38 346.25 o
-2 0 -16 7813.95 8176.80 438.52 o
0 0 -16 22188.62 22626.97 847.55 o
2 0 -16 7218.36 8069.31 435.66 o
4 0 -16 5151.82 5157.58 356.71 o
6 0 -16 941.82 859.91 196.91 o
8 0 -16 7766.59 7637.45 435.66 o
10 0 -16 6237.40 6690.97 416.64 o
12 0 -16 4297.16 4246.30 363.37 o
14 0 -16 3669.68 3437.75 339.59 o
-15 1 -16 3820.62 3192.34 401.42 o
-13 1 -16 1577.49 1329.82 301.54 o
-11 1 -16 226.55 140.14 184.33 o
-9 1 -16 1596.10 1718.22 156.79 o
-7 1 -16 7711.38 7870.73 258.11 o
-5 1 -16 8235.60 8517.64 439.08 o
-3 1 -16 3816.41 3945.68 162.48 o
-1 1 -16 1167.51 1262.42 92.30 o
1 1 -16 1491.70 1375.52 95.25 o
3 1 -16 5765.71 6211.43 202.86 o
5 1 -16 6414.15 6825.81 375.04 o
7 1 -16 4784.39 5256.37 222.49 o
9 1 -16 1544.30 1788.50 156.05 o
11 1 -16 957.74 854.88 137.60 o
13 1 -16 1756.54 1627.50 287.27 o
15 1 -16 2197.90 1961.92 260.78 o
17 1 -16 1681.19 1321.69 340.14 o
-14 2 -16 112.92 167.09 210.80 o
-12 2 -16 606.21 535.46 202.67 o
-10 2 -16 1026.98 842.11 169.56 o
-8 2 -16 142.46 248.45 125.83 o
-6 2 -16 283.78 241.70 106.96 o
-4 2 -16 403.78 414.59 95.93 o
-2 2 -16 2580.48 2946.61 137.53 o
0 2 -16 208.37 167.83 79.24 o
2 2 -16 588.54 514.96 98.53 o
4 2 -16 442.87 495.60 100.72 o
6 2 -16 1157.40 1409.33 194.28 o
8 2 -16 326.97 220.11 100.70 o
10 2 -16 748.85 577.81 193.11 o
12 2 -16 1042.73 801.94 213.91 o
14 2 -16 75.41 405.07 215.72 o
16 2 -16 36.32 -53.39 223.97 o
-11 3 -16 249.46 319.61 177.43 o
-9 3 -16 18.65 2.62 144.25 o
-7 3 -16 2217.21 2182.71 198.26 o
-5 3 -16 1852.45 1992.39 185.33 o
-3 3 -16 1933.98 2113.06 134.32 o
-1 3 -16 1197.60 1239.11 127.21 o
1 3 -16 61.30 -0.41 86.62 o
3 3 -16 762.73 744.62 118.94 o
5 3 -16 945.12 840.60 148.30 o
7 3 -16 1657.41 1637.30 174.18 o
9 3 -16 868.36 643.90 154.49 o
11 3 -16 590.99 527.09 165.19 o
13 3 -16 112.25 208.66 240.79 o
-6 4 -16 1209.79 1194.94 247.26 o
-4 4 -16 860.90 794.93 204.41 o
-2 4 -16 5001.50 4889.74 479.17 o
0 4 -16 3148.08 3241.35 370.94 o
2 4 -16 4427.28 4679.83 432.35 o
4 4 -16 833.28 816.52 165.24 o
6 4 -16 1755.23 1443.74 185.66 o
8 4 -16 1372.71 1153.22 190.80 o
-17 1 -15 1545.52 892.26 511.76 o
-15 1 -15 3137.08 2949.53 271.04 o
-13 1 -15 38.47 48.71 157.34 o
-11 1 -15 850.03 1142.39 243.04 o
-9 1 -15 2187.66 2409.89 162.68 o
-7 1 -15 9765.83 10189.61 257.32 o
-5 1 -15 6464.68 6934.84 237.66 o
-3 1 -15 1800.66 1909.32 116.00 o
-1 1 -15 747.38 845.01 78.57 o
1 1 -15 3395.74 3651.32 131.87 o
3 1 -15 7968.56 8496.52 236.02 o
5 1 -15 4040.61 4331.89 184.67 o
7 1 -15 7565.54 8452.89 266.23 o
9 1 -15 281.39 262.97 107.55 o
11 1 -15 1118.82 946.06 238.68 o
13 1 -15 549.64 391.77 178.59 o
15 1 -15 3260.62 3368.53 327.22 o
17 1 -15 1308.48 1181.68 260.32 o
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-10 2 -15 5847.23 6424.97 285.04 o
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-6 2 -15 183.13 195.63 90.47 o
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0 2 -15 14428.23 15264.40 328.19 o
2 2 -15 6738.19 6984.76 211.80 o
4 2 -15 1307.05 1236.69 111.73 o
6 2 -15 2691.65 2561.17 143.15 o
8 2 -15 6686.43 6611.64 218.97 o
10 2 -15 8718.08 8891.12 316.63 o
12 2 -15 5078.48 5180.41 341.43 o
14 2 -15 1477.51 963.53 234.48 o
16 2 -15 462.58 258.43 226.25 o
-13 3 -15 1370.88 974.64 243.12 o
-11 3 -15 281.58 248.79 163.37 o
-9 3 -15 4210.80 4039.31 248.43 o
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-3 3 -15 2750.87 3034.69 148.00 o
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1 3 -15 4192.69 3946.98 184.53 o
3 3 -15 5510.58 5774.99 320.73 o
5 3 -15 8433.13 8659.44 273.87 o
7 3 -15 2037.31 2223.14 259.38 o
9 3 -15 1301.31 1425.72 170.06 o
11 3 -15 626.38 459.83 153.18 o
13 3 -15 4079.72 3848.67 271.29 o
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1 1 -14 11384.98 11772.92 262.37 o
3 1 -14 13299.83 13902.72 296.58 o
5 1 -14 11354.64 11616.15 264.80 o
7 1 -14 2307.65 2275.81 128.64 o
9 1 -14 240.16 280.77 99.74 o
11 1 -14 1986.22 2099.00 153.93 o
13 1 -14 5357.54 5338.04 318.00 o
15 1 -14 4343.57 4591.67 331.53 o
17 1 -14 2367.75 2257.33 279.06 o
19 1 -14 160.63 168.37 454.69 o
-16 2 -14 501.82 260.20 212.69 o
-14 2 -14 45.95 178.22 181.30 o
-12 2 -14 378.62 389.57 145.36 o
-10 2 -14 439.79 305.36 129.67 o
-8 2 -14 289.03 212.59 114.26 o
-6 2 -14 1092.79 1078.80 108.23 o
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-2 2 -14 668.76 793.33 85.43 o
0 2 -14 289.20 283.31 73.12 o
2 2 -14 459.09 300.05 81.30 o
4 2 -14 198.19 244.57 81.64 o
6 2 -14 527.12 664.31 95.76 o
8 2 -14 857.76 828.72 116.15 o
10 2 -14 391.64 306.74 118.70 o
12 2 -14 288.99 207.69 170.87 o
14 2 -14 114.81 89.00 177.38 o
16 2 -14 310.46 348.25 215.91 o
18 2 -14 88.73 54.22 305.35 o
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