#------------------------------------------------------------------------------
#$Date: 2018-04-30 19:24:07 +0300 (Mon, 30 Apr 2018) $
#$Revision: 207545 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/24/2242447.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_2242447
_cell_angle_alpha                90.000
_cell_angle_beta                 100.557
_cell_angle_gamma                90.000
_cell_length_a                   3.9431
_cell_length_b                   10.7566
_cell_length_c                   9.9643
_exptl_crystal_F_000             356.00
_reflns_d_resolution_high        0.7544
_cod_data_source_file            su5433Mo-Absorb7-Ciso_hsup9.hkl
_cod_data_source_block           Mo-Absorb7-Ciso_h
_shelx_title                     ' '
_shelx_refln_list_code           4
_shelx_f_calc_maximum            160.54
_shelx_f_squared_multiplier      1.000
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 0 852.90 784.86 69.10 o
4 0 0 1008.52 844.09 159.78 o
1 1 0 5581.97 5837.32 100.79 o
2 1 0 1428.66 1365.04 55.50 o
3 1 0 1250.75 1295.27 91.95 o
4 1 0 719.92 640.61 91.28 o
5 1 0 0.31 -181.68 181.68 o
1 2 0 7538.51 6987.98 308.98 o
2 2 0 1298.11 1284.90 63.50 o
3 2 0 599.57 587.92 59.05 o
4 2 0 2.75 -23.48 46.03 o
5 2 0 68.40 210.80 119.54 o
1 3 0 4854.19 4952.83 227.59 o
2 3 0 10208.28 9431.21 186.38 o
3 3 0 61.26 12.50 30.37 o
4 3 0 23.17 243.34 141.83 o
5 3 0 38.82 231.46 173.67 o
2 4 0 246.02 210.49 36.48 o
3 4 0 576.36 525.79 91.01 o
4 4 0 1.17 -9.05 107.72 o
3 5 0 631.17 483.63 72.78 o
4 5 0 92.71 314.25 232.13 o
2 6 0 251.83 113.38 180.89 o
3 6 0 1865.02 2774.17 250.10 o
4 6 0 294.40 459.49 383.36 o
3 7 0 890.97 352.94 806.36 o
4 7 0 9.32 3482.39 1747.40 o
-5 0 1 10.77 -3.87 351.95 o
-3 0 1 586.27 691.27 86.83 o
-1 0 1 1161.40 1240.63 35.04 o
1 0 1 25774.10 24650.82 392.77 o
3 0 1 114.10 66.19 50.78 o
-5 1 1 46.10 107.18 100.43 o
-4 1 1 244.13 238.88 49.85 o
-3 1 1 3738.86 3668.85 133.18 o
-2 1 1 4653.31 4785.11 90.77 o
-1 1 1 217.47 272.68 18.30 o
0 1 1 363.72 409.98 21.56 o
1 1 1 19865.17 21027.78 240.33 o
2 1 1 7430.87 7507.08 187.56 o
3 1 1 452.36 449.63 62.24 o
4 1 1 0.26 14.67 80.12 o
5 1 1 0.26 556.25 205.19 o
-5 2 1 59.67 161.42 134.28 o
-4 2 1 3.54 -54.43 66.94 o
-3 2 1 458.58 452.76 37.33 o
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0 2 1 3678.91 3798.70 61.31 o
1 2 1 293.41 278.93 19.44 o
2 2 1 512.31 462.31 66.09 o
3 2 1 1606.21 1523.31 130.11 o
4 2 1 229.79 208.88 87.81 o
5 2 1 2.19 601.18 386.41 o
-5 3 1 105.13 211.97 280.34 o
-4 3 1 0.63 -20.64 117.87 o
-3 3 1 445.61 469.13 46.53 o
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-1 3 1 409.27 460.61 66.72 o
0 3 1 3213.71 4305.38 356.22 o
1 3 1 516.50 502.32 34.86 o
2 3 1 78.50 65.87 22.33 o
3 3 1 2149.27 2555.37 190.40 o
4 3 1 147.00 146.47 79.34 o
-4 4 1 819.28 866.53 349.48 o
-3 4 1 42.88 119.53 51.00 o
-2 4 1 4383.74 6163.21 516.77 o
2 4 1 3163.11 3107.02 108.97 o
3 4 1 375.19 317.96 77.85 o
4 4 1 94.45 56.89 109.13 o
-4 5 1 161.75 418.31 150.03 o
-3 5 1 1158.65 1528.06 174.36 o
1 5 1 4493.16 5261.16 207.77 o
2 5 1 1656.93 1541.61 95.27 o
3 5 1 266.35 141.25 52.50 o
4 5 1 416.88 602.62 170.29 o
-4 6 1 381.41 187.50 202.34 o
1 6 1 1964.28 2640.39 271.44 o
2 6 1 3327.87 3867.12 182.29 o
3 6 1 266.41 214.64 67.73 o
4 6 1 261.31 139.28 134.95 o
3 7 1 15.72 252.62 104.74 o
4 7 1 47.34 -165.12 200.79 o
3 8 1 20.14 -10.10 687.48 o
-4 0 2 258.34 234.82 123.41 o
-2 0 2 18763.75 18970.86 337.95 o
2 0 2 1755.17 1911.84 168.80 o
4 0 2 54.85 95.15 232.33 o
-5 1 2 103.86 123.15 88.36 o
-4 1 2 47.97 11.50 66.61 o
-3 1 2 597.37 669.75 58.08 o
-2 1 2 182.60 213.03 31.59 o
-1 1 2 324.46 321.77 22.87 o
1 1 2 3371.21 3283.25 218.92 o
2 1 2 6950.97 6478.35 284.54 o
3 1 2 1533.76 1347.73 165.97 o
4 1 2 1.21 238.34 152.87 o
-5 2 2 171.74 115.79 104.45 o
-4 2 2 163.14 187.21 66.25 o
-3 2 2 463.98 404.51 33.38 o
-2 2 2 1115.51 1138.69 76.63 o
-1 2 2 14400.87 15267.17 262.76 o
0 2 2 7928.57 7933.26 100.86 o
1 2 2 247.24 232.34 23.32 o
2 2 2 1001.47 1074.64 101.63 o
3 2 2 745.37 887.03 124.92 o
4 2 2 909.92 818.94 210.75 o
-5 3 2 15.53 -58.85 276.92 o
-4 3 2 1451.26 1673.57 360.58 o
-3 3 2 730.16 738.00 63.62 o
-2 3 2 2214.56 2010.89 187.01 o
-1 3 2 2061.78 1957.85 70.76 o
0 3 2 17888.76 17527.13 171.50 o
1 3 2 744.76 688.62 45.60 o
2 3 2 1182.78 1286.97 104.32 o
3 3 2 295.80 139.06 106.75 o
4 3 2 76.48 -3.73 88.10 o
-4 4 2 0.37 -10.37 55.34 o
-3 4 2 1.18 171.41 58.71 o
-2 4 2 92.38 53.64 17.88 o
-1 4 2 1561.69 1220.56 82.99 o
0 4 2 726.55 703.65 40.91 o
1 4 2 9831.18 8625.58 175.76 o
2 4 2 412.13 445.17 53.44 o
3 4 2 1703.32 1684.37 290.81 o
4 4 2 152.18 51.97 196.16 o
-4 5 2 145.49 -13.91 87.37 o
-3 5 2 3761.65 3864.53 294.76 o
-2 5 2 466.71 404.78 59.80 o
-1 5 2 5154.91 5862.46 300.27 o
1 5 2 2349.13 1838.65 83.41 o
2 5 2 2196.48 2160.38 116.91 o
3 5 2 147.07 207.72 93.24 o
4 5 2 6.90 -86.23 140.86 o
-1 6 2 3938.07 4503.15 1052.98 o
0 6 2 2849.85 3807.89 274.64 o
1 6 2 3590.36 2940.14 182.53 o
2 6 2 121.77 105.32 35.19 o
3 6 2 22.34 -28.60 106.94 o
4 6 2 220.42 95.92 228.65 o
0 7 2 820.21 411.98 329.73 o
1 7 2 1927.97 2464.82 222.97 o
2 7 2 23.83 24.34 47.41 o
3 7 2 1759.00 1933.56 269.00 o
4 7 2 9.51 86.60 150.59 o
2 8 2 409.07 556.83 134.49 o
3 8 2 31.62 368.12 337.58 o
3 9 2 94.09 -2049.16 2049.16 o
-5 0 3 0.60 94.29 77.47 o
-3 0 3 53.55 59.68 35.20 o
-5 1 3 170.86 190.73 130.29 o
-4 1 3 1058.34 929.62 124.34 o
-3 1 3 642.62 811.27 72.81 o
-2 1 3 44.18 60.30 13.21 o
-1 1 3 11639.63 11973.29 277.28 o
1 1 3 581.34 654.35 171.71 o
2 1 3 485.05 640.28 111.76 o
3 1 3 4.76 -45.69 50.59 o
-5 2 3 101.69 180.96 199.88 o
-4 2 3 12.05 61.49 57.46 o
-3 2 3 3973.28 3832.89 136.95 o
-2 2 3 1318.93 1458.58 102.43 o
-1 2 3 191.92 138.39 17.61 o
0 2 3 9711.08 9689.02 206.62 o
1 2 3 2373.58 2350.95 208.48 o
2 2 3 885.12 825.68 106.34 o
3 2 3 115.51 39.44 76.57 o
4 2 3 639.16 378.67 312.82 o
-5 3 3 19.45 -53.50 305.52 o
-4 3 3 39.07 31.05 65.57 o
-3 3 3 983.54 732.76 116.46 o
-2 3 3 736.01 729.90 77.84 o
-1 3 3 1037.47 988.40 58.75 o
0 3 3 133.17 115.97 16.65 o
1 3 3 13891.17 13551.19 264.60 o
2 3 3 2176.96 2101.93 158.11 o
3 3 3 555.75 734.20 184.65 o
4 3 3 51.71 24.07 89.72 o
-4 4 3 66.88 123.11 66.87 o
-3 4 3 503.98 513.59 74.40 o
-2 4 3 8776.31 8468.87 311.98 o
-1 4 3 426.75 504.87 62.10 o
0 4 3 636.88 461.12 47.12 o
1 4 3 1377.07 1550.36 95.70 o
2 4 3 148.19 195.49 54.38 o
3 4 3 68.05 267.56 109.42 o
4 4 3 101.29 21.29 135.57 o
-4 5 3 11.32 177.88 103.11 o
-3 5 3 425.85 509.66 88.60 o
-2 5 3 3304.11 3106.41 165.28 o
-1 5 3 1293.93 1144.52 80.02 o
0 5 3 1419.33 1523.38 76.02 o
1 5 3 1325.27 1188.09 91.45 o
2 5 3 4118.19 4226.91 214.77 o
3 5 3 18.75 -48.18 128.65 o
4 5 3 131.28 499.84 192.96 o
-4 6 3 10.03 189.69 285.95 o
-3 6 3 603.39 617.02 147.71 o
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0 6 3 7219.38 6909.84 491.46 o
1 6 3 9.21 0.01 40.15 o
2 6 3 423.13 399.78 92.47 o
3 6 3 380.51 531.62 177.20 o
4 6 3 157.48 217.88 219.46 o
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-1 7 3 250.06 292.96 60.90 o
0 7 3 4003.40 4514.06 204.30 o
1 7 3 568.04 590.88 84.90 o
2 7 3 91.26 57.68 51.41 o
3 7 3 0.02 2.57 100.47 o
-1 8 3 1915.56 2459.64 312.26 o
1 8 3 271.72 489.18 89.30 o
2 8 3 576.02 632.49 115.12 o
3 8 3 681.42 973.37 235.04 o
2 9 3 1354.10 1863.27 257.53 o
3 9 3 0.35 141.34 230.04 o
2 10 3 388.11 931.40 600.50 o
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-1 2 4 357.04 305.09 59.32 o
0 2 4 3389.81 3339.43 164.98 o
1 2 4 116.14 178.52 66.75 o
2 2 4 3862.61 4451.63 274.49 o
3 2 4 100.92 641.35 306.37 o
-4 3 4 636.35 828.02 168.35 o
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-1 3 4 1185.15 955.94 79.51 o
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2 3 4 243.27 140.50 78.16 o
3 3 4 231.43 235.64 190.46 o
4 3 4 30.23 -167.98 167.98 o
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3 9 4 63.90 -69.97 240.54 o
0 10 4 531.14 150.19 319.90 o
1 10 4 32.01 38.01 250.07 o
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2 3 5 397.50 385.00 111.43 o
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