#------------------------------------------------------------------------------
#$Date: 2018-05-01 18:57:40 +0300 (Tue, 01 May 2018) $
#$Revision: 207603 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/1/54/93/1549358.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_1549358
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   11.0702
_cell_length_b                   26.0585
_cell_length_c                   7.7302
_exptl_crystal_F_000             1216.00
_reflns_d_resolution_high        0.8409
_cod_data_source_file            wm4078Isup2.hkl
_cod_data_source_block           I
_shelx_title                     ' MLZNBR_a.res in Pna2(1)'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            264.31
_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+1/2'
'x+1/2, -y+1/2, z'
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 -9 27.01 128.45 94.54 o
0 1 -9 37.16 141.65 95.68 o
1 1 -9 93.75 133.55 67.27 o
2 1 -9 4.51 113.04 67.76 o
1 2 -9 79.57 130.08 71.75 o
2 2 -9 145.08 256.41 68.90 o
0 3 -9 635.91 852.24 125.14 o
1 3 -9 53.16 143.40 72.03 o
2 3 -9 345.86 524.60 73.96 o
1 4 -9 44.39 229.25 67.37 o
2 4 -9 55.54 204.82 79.29 o
0 5 -9 586.69 825.69 169.30 o
1 5 -9 286.28 479.20 148.68 o
0 0 -8 5852.38 5306.60 397.20 o
2 0 -8 486.89 527.19 96.87 o
4 0 -8 1671.96 1647.25 136.12 o
6 0 -8 2070.01 1719.21 146.76 o
1 1 -8 469.57 703.70 93.54 o
2 1 -8 528.62 800.83 97.74 o
3 1 -8 3331.62 3159.00 130.55 o
4 1 -8 721.88 919.08 109.09 o
5 1 -8 98.21 167.73 59.25 o
6 1 -8 9.74 166.11 61.48 o
0 2 -8 4384.08 4229.61 205.35 o
1 2 -8 4318.69 4068.49 132.24 o
2 2 -8 592.60 966.22 93.37 o
3 2 -8 191.47 542.30 86.37 o
4 2 -8 721.53 853.24 93.47 o
5 2 -8 141.43 235.96 59.91 o
6 2 -8 661.95 835.08 78.74 o
1 3 -8 81.72 1124.47 115.95 o
2 3 -8 3217.21 3058.69 117.76 o
3 3 -8 1091.96 1263.39 94.08 o
4 3 -8 2066.47 2154.13 120.79 o
5 3 -8 23.93 122.06 58.99 o
6 3 -8 289.05 517.97 96.82 o
0 4 -8 1255.36 1501.80 160.16 o
1 4 -8 8720.23 7831.34 211.83 o
2 4 -8 680.88 968.14 172.80 o
3 4 -8 257.45 316.45 79.81 o
4 4 -8 387.28 550.17 134.89 o
5 4 -8 518.12 618.96 104.20 o
6 4 -8 330.62 507.01 151.37 o
1 5 -8 113.19 996.92 139.51 o
2 5 -8 2919.60 2905.22 111.88 o
3 5 -8 94.85 119.02 74.80 o
4 5 -8 2288.72 2228.02 135.18 o
5 5 -8 10.98 108.86 67.52 o
6 5 -8 335.89 454.98 118.54 o
0 6 -8 238.19 210.52 116.13 o
1 6 -8 5299.59 4816.88 145.49 o
2 6 -8 462.85 512.77 102.63 o
3 6 -8 357.18 359.84 74.02 o
4 6 -8 2692.26 2657.66 154.07 o
5 6 -8 261.39 125.76 102.88 o
1 7 -8 457.93 834.98 148.31 o
2 7 -8 463.44 445.99 83.02 o
3 7 -8 1828.12 1458.70 158.23 o
4 7 -8 1074.49 1143.38 160.39 o
5 7 -8 30.67 246.62 117.62 o
0 8 -8 1532.24 1112.90 193.54 o
1 8 -8 857.94 710.56 124.05 o
2 8 -8 158.12 345.71 299.45 o
3 8 -8 479.52 424.51 164.31 o
4 8 -8 2078.58 1883.03 307.94 o
5 8 -8 380.38 276.27 121.71 o
1 9 -8 322.01 348.60 76.67 o
2 9 -8 149.09 801.95 250.59 o
3 9 -8 2646.75 2346.97 258.10 o
4 9 -8 35.96 122.92 135.82 o
5 9 -8 64.21 177.24 150.08 o
0 10 -8 2437.74 2708.65 308.99 o
1 10 -8 627.06 1347.87 265.53 o
3 10 -8 310.03 254.95 90.63 o
1 11 -8 14.90 1090.66 188.23 o
2 11 -8 1398.16 1252.12 215.27 o
3 11 -8 1018.14 779.54 132.42 o
0 12 -8 726.22 1569.94 273.00 o
1 12 -8 1653.40 2602.45 159.99 o
2 12 -8 124.47 1394.08 203.65 o
2 13 -8 1471.47 2383.45 225.73 o
3 13 -8 105.37 907.21 291.33 o
0 14 -8 201.15 1231.75 296.09 o
1 14 -8 759.07 1768.24 216.01 o
1 15 -8 312.41 1414.74 189.05 o
2 0 -7 119.96 163.56 61.52 o
4 0 -7 435.42 475.27 75.41 o
6 0 -7 459.17 533.58 94.01 o
8 0 -7 39.13 88.26 94.76 o
0 1 -7 836.67 760.14 86.56 o
1 1 -7 1917.04 1770.77 77.48 o
2 1 -7 59.79 83.48 43.16 o
3 1 -7 1714.80 1493.11 82.63 o
4 1 -7 155.71 248.34 51.93 o
5 1 -7 692.31 669.51 69.76 o
6 1 -7 18.68 92.20 50.68 o
7 1 -7 214.70 312.93 57.08 o
8 1 -7 27.53 101.18 64.49 o
1 2 -7 155.71 378.53 51.46 o
2 2 -7 296.16 374.08 47.03 o
3 2 -7 254.73 318.94 46.66 o
4 2 -7 471.18 561.75 73.26 o
5 2 -7 192.09 305.61 51.97 o
6 2 -7 1048.77 875.44 79.82 o
7 2 -7 46.57 95.98 57.73 o
8 2 -7 13.90 195.58 71.12 o
0 3 -7 4377.37 4031.36 180.48 o
1 3 -7 1878.21 1748.07 77.97 o
2 3 -7 1035.19 1113.86 69.09 o
3 3 -7 511.78 673.22 70.51 o
4 3 -7 2061.64 1990.01 125.07 o
5 3 -7 526.03 600.49 81.04 o
6 3 -7 638.82 620.54 74.14 o
7 3 -7 139.50 124.58 59.24 o
8 3 -7 238.93 404.97 76.73 o
1 4 -7 353.91 641.56 64.54 o
2 4 -7 196.58 291.96 68.30 o
3 4 -7 923.37 1031.16 96.32 o
4 4 -7 88.19 275.79 111.53 o
5 4 -7 122.97 196.44 52.63 o
6 4 -7 62.57 125.20 53.80 o
7 4 -7 106.52 202.68 76.49 o
8 4 -7 47.82 172.76 78.87 o
0 5 -7 5161.76 4956.99 201.45 o
1 5 -7 1538.74 1669.50 80.34 o
2 5 -7 1421.35 1338.69 73.49 o
3 5 -7 1309.30 1121.89 88.88 o
4 5 -7 3075.24 2733.79 113.19 o
5 5 -7 551.18 536.81 62.54 o
6 5 -7 180.58 287.00 80.87 o
7 5 -7 580.89 808.94 101.80 o
8 5 -7 216.29 321.19 81.77 o
1 6 -7 156.43 182.82 63.67 o
2 6 -7 70.77 150.26 65.67 o
3 6 -7 729.90 735.62 93.24 o
4 6 -7 51.16 105.61 51.84 o
5 6 -7 258.96 286.67 63.78 o
6 6 -7 633.97 604.02 70.65 o
7 6 -7 57.96 146.67 76.32 o
8 6 -7 146.04 157.70 93.96 o
0 7 -7 4908.21 4520.11 192.65 o
1 7 -7 1606.72 1487.41 134.96 o
2 7 -7 1478.14 1627.89 108.44 o
3 7 -7 1904.34 1790.92 115.13 o
4 7 -7 617.54 732.97 130.05 o
5 7 -7 458.89 419.54 71.05 o
6 7 -7 433.82 401.52 92.97 o
7 7 -7 1171.75 1180.80 312.69 o
1 8 -7 222.60 223.17 62.06 o
2 8 -7 71.07 310.35 154.83 o
3 8 -7 809.87 631.55 121.22 o
4 8 -7 72.15 82.87 51.66 o
5 8 -7 56.10 220.92 86.34 o
6 8 -7 772.62 718.36 117.79 o
7 8 -7 62.42 223.45 122.54 o
0 9 -7 3452.01 3324.35 236.10 o
1 9 -7 596.76 575.69 125.86 o
2 9 -7 1275.19 1521.14 124.16 o
3 9 -7 1077.72 1274.28 153.86 o
4 9 -7 210.03 127.39 56.38 o
5 9 -7 220.43 469.53 128.60 o
6 9 -7 3.57 59.30 87.77 o
7 9 -7 899.11 1008.92 232.22 o
1 10 -7 440.27 476.24 140.92 o
2 10 -7 353.69 511.24 240.74 o
3 10 -7 478.47 508.37 122.82 o
4 10 -7 575.01 489.54 302.84 o
5 10 -7 149.28 347.14 112.47 o
6 10 -7 252.07 526.23 192.18 o
7 10 -7 232.43 1312.92 232.25 o
0 11 -7 2131.35 2149.37 210.82 o
1 11 -7 772.61 703.67 76.31 o
2 11 -7 876.53 901.12 153.18 o
3 11 -7 103.22 376.40 141.56 o
4 11 -7 2.51 977.15 253.98 o
5 11 -7 573.52 558.15 193.54 o
6 11 -7 301.52 479.37 196.94 o
7 11 -7 290.78 573.09 217.31 o
1 12 -7 59.81 788.09 160.62 o
2 12 -7 871.82 1076.16 246.02 o
3 12 -7 156.54 843.81 160.91 o
4 12 -7 456.27 1089.91 146.17 o
5 12 -7 127.67 1091.59 190.36 o
6 12 -7 193.68 437.27 197.62 o
0 13 -7 897.27 928.26 146.68 o
1 13 -7 1679.50 1908.52 248.44 o
2 13 -7 225.35 475.99 141.28 o
3 13 -7 125.66 997.96 150.76 o
4 13 -7 103.60 216.86 80.30 o
6 13 -7 570.49 1043.64 287.94 o
1 14 -7 350.46 1377.57 173.04 o
2 14 -7 556.46 1261.13 180.17 o
3 14 -7 462.82 1140.75 263.49 o
4 14 -7 189.38 444.06 191.51 o
6 14 -7 225.20 503.14 221.39 o
0 15 -7 280.87 732.00 348.31 o
1 15 -7 1637.98 2477.69 169.05 o
2 15 -7 697.77 1341.81 205.35 o
3 15 -7 916.54 1685.55 173.59 o
4 15 -7 504.90 1008.77 301.15 o
1 16 -7 372.80 1382.54 158.28 o
2 16 -7 27.19 1108.86 174.73 o
3 16 -7 848.25 904.97 403.35 o
4 16 -7 30.25 501.11 231.57 o
5 16 -7 182.81 401.96 239.72 o
0 17 -7 508.82 1308.04 211.16 o
1 17 -7 665.33 1464.34 151.62 o
2 17 -7 642.00 1543.79 162.55 o
3 17 -7 841.21 1038.15 206.64 o
4 17 -7 858.73 1334.47 198.18 o
1 18 -7 429.25 1242.96 173.99 o
2 18 -7 154.04 299.57 148.68 o
3 18 -7 1061.39 1606.84 165.16 o
0 19 -7 979.30 1500.62 230.57 o
1 19 -7 272.65 394.22 108.86 o
2 19 -7 810.15 1359.79 186.07 o
0 0 -6 6371.50 6084.05 286.30 o
2 0 -6 8618.36 8124.62 319.86 o
4 0 -6 9253.03 8717.51 310.78 o
6 0 -6 5867.30 5177.33 184.08 o
8 0 -6 563.78 525.55 140.57 o
1 1 -6 7502.79 7259.54 166.29 o
2 1 -6 1451.26 1779.55 86.17 o
3 1 -6 6004.25 5640.15 156.65 o
5 1 -6 1824.39 1928.13 86.58 o
6 1 -6 555.69 833.24 63.45 o
7 1 -6 1480.87 1588.83 82.14 o
8 1 -6 1102.79 1126.66 90.66 o
9 1 -6 1018.54 1026.45 96.75 o
0 2 -6 4965.86 4080.28 153.93 o
1 2 -6 555.19 1085.54 60.55 o
2 2 -6 3316.95 3441.42 97.94 o
3 2 -6 2044.60 2134.78 77.98 o
4 2 -6 8011.41 7462.95 186.72 o
5 2 -6 9973.83 9155.86 208.54 o
6 2 -6 4379.94 4228.78 118.17 o
7 2 -6 667.19 741.97 76.77 o
8 2 -6 408.88 681.09 76.46 o
9 2 -6 10.82 102.28 62.37 o
1 3 -6 2405.56 2243.25 73.61 o
2 3 -6 8698.06 8118.03 196.30 o
3 3 -6 1025.82 1105.26 99.51 o
4 3 -6 1085.19 1384.02 85.78 o
5 3 -6 32.40 980.65 128.22 o
6 3 -6 454.68 798.56 80.78 o
7 3 -6 545.46 667.12 75.99 o
8 3 -6 3783.09 3610.81 158.38 o
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0 4 -6 1921.65 1685.81 98.86 o
1 4 -6 545.23 729.58 57.34 o
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4 4 -6 1700.13 1799.93 72.62 o
5 4 -6 16622.23 15658.35 362.36 o
6 4 -6 1232.65 1207.48 75.18 o
7 4 -6 1836.29 1737.49 106.74 o
8 4 -6 314.70 866.84 102.97 o
9 4 -6 79.50 145.93 86.68 o
1 5 -6 195.23 271.36 50.98 o
2 5 -6 9340.18 8885.06 214.73 o
3 5 -6 1347.19 1469.23 78.72 o
4 5 -6 1291.03 1218.52 68.73 o
5 5 -6 58.55 930.29 164.34 o
6 5 -6 244.21 226.35 49.53 o
7 5 -6 131.13 234.28 74.57 o
8 5 -6 4376.52 4022.00 189.56 o
9 5 -6 110.21 182.19 83.66 o
0 6 -6 13023.66 11361.77 413.04 o
1 6 -6 611.72 611.72 124.83 o
2 6 -6 5024.33 5142.67 129.97 o
3 6 -6 1622.22 1700.04 124.95 o
4 6 -6 216.86 183.64 40.18 o
5 6 -6 14961.15 14194.46 327.83 o
6 6 -6 124.59 124.84 58.56 o
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8 6 -6 1062.13 1044.99 163.66 o
9 6 -6 296.96 342.22 87.81 o
1 7 -6 3686.57 3584.57 105.68 o
2 7 -6 3850.69 4390.33 127.78 o
3 7 -6 4301.58 4225.62 105.41 o
4 7 -6 7.82 97.05 53.47 o
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6 7 -6 134.32 155.49 60.69 o
7 7 -6 1084.79 973.67 198.60 o
8 7 -6 1678.84 1556.53 156.24 o
9 7 -6 474.56 576.14 99.69 o
0 8 -6 11455.33 10669.67 318.61 o
1 8 -6 1558.33 1645.62 102.70 o
2 8 -6 8347.22 7769.13 185.10 o
3 8 -6 1231.78 1356.71 73.75 o
4 8 -6 1400.13 1397.18 81.86 o
5 8 -6 3116.59 2790.27 111.62 o
6 8 -6 326.18 466.79 94.03 o
7 8 -6 532.76 581.76 85.73 o
8 8 -6 477.74 641.08 80.20 o
9 8 -6 713.22 615.52 98.87 o
1 9 -6 4947.79 5153.76 118.26 o
2 9 -6 276.14 487.79 65.53 o
3 9 -6 3482.14 3449.73 89.63 o
4 9 -6 87.54 68.89 32.40 o
5 9 -6 1020.00 996.75 79.45 o
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8 9 -6 2.56 64.92 112.05 o
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0 10 -6 2982.61 2847.68 123.22 o
1 10 -6 3973.98 4222.90 130.09 o
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3 10 -6 1877.21 1770.78 71.01 o
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1 11 -6 3453.53 3760.50 110.94 o
2 11 -6 2832.79 2984.67 108.03 o
3 11 -6 517.14 744.82 152.24 o
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7 11 -6 226.57 243.80 95.73 o
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0 12 -6 199.66 218.67 83.53 o
1 12 -6 4891.43 5208.62 144.86 o
2 12 -6 101.40 990.83 115.42 o
3 12 -6 1587.50 1581.54 102.79 o
4 12 -6 1123.04 1148.17 88.60 o
5 12 -6 3748.33 3929.44 232.18 o
6 12 -6 382.48 617.23 211.20 o
7 12 -6 285.64 191.51 209.84 o
8 12 -6 115.01 146.68 228.86 o
2 13 -6 4022.05 4271.27 140.17 o
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3 16 -6 925.10 1127.20 108.57 o
4 16 -6 31.73 75.69 56.56 o
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6 16 -6 26.92 35.82 140.98 o
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1 17 -6 1106.69 1614.13 133.03 o
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8 2 -5 918.41 960.45 42.73 o
9 2 -5 169.32 449.91 65.94 o
10 2 -5 774.96 834.42 85.03 o
11 2 -5 78.32 108.03 46.61 o
0 3 -5 8600.49 7496.56 246.64 o
1 3 -5 2220.30 2312.60 68.87 o
2 3 -5 1104.44 1085.78 46.95 o
3 3 -5 1635.93 1789.37 61.55 o
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6 3 -5 2088.04 1963.32 72.05 o
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1 23 1 7508.38 9178.95 321.96 o
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