#------------------------------------------------------------------------------
#$Date: 2016-04-06 14:49:50 +0100 (Wed, 06 Apr 2016) $
#$Revision: 181890 $
#$URL: svn://www.crystallography.net/cod/hkl/2/23/90/2239065.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_2239065
_cell_angle_alpha                84.533
_cell_angle_beta                 83.400
_cell_angle_gamma                78.679
_cell_length_a                   5.2602
_cell_length_b                   7.1570
_cell_length_c                   9.0126
_exptl_crystal_F_000             192.00
_reflns_d_resolution_high        0.8407
_cod_data_source_file            kp2461Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' 2768 in P1'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            81.52
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, 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
-1 -3 -10 98.89 127.75 11.91 o
0 -3 -10 149.37 150.64 13.65 o
0 -2 -10 83.93 92.50 10.52 o
1 -2 -10 136.44 142.52 13.75 o
0 -1 -10 158.55 170.49 14.70 o
1 -1 -10 178.14 181.11 15.30 o
0 0 -10 162.46 206.06 16.14 o
1 0 -10 131.24 141.66 13.55 o
0 1 -10 253.93 273.31 18.20 o
1 1 -10 56.62 59.99 8.92 o
-1 2 -10 171.79 171.35 14.85 o
0 2 -10 126.83 116.61 8.26 o
-1 -5 -9 218.40 237.39 17.00 o
-1 -4 -9 208.42 219.70 15.21 o
0 -4 -9 150.68 154.68 13.51 o
1 -4 -9 78.31 82.08 10.56 o
-1 -3 -9 269.80 279.28 16.42 o
0 -3 -9 119.00 137.09 12.11 o
1 -3 -9 120.87 103.88 11.42 o
-1 -2 -9 261.19 295.70 16.87 o
0 -2 -9 162.51 166.86 13.01 o
1 -2 -9 130.40 127.43 12.16 o
2 -2 -9 232.62 269.03 19.34 o
-1 -1 -9 153.27 197.74 13.91 o
0 -1 -9 144.99 143.87 12.22 o
1 -1 -9 436.80 450.53 22.56 o
2 -1 -9 124.20 113.66 12.26 o
-1 0 -9 172.65 188.01 12.22 o
0 0 -9 521.69 605.28 25.65 o
1 0 -9 87.06 87.56 9.92 o
2 0 -9 275.19 260.98 18.26 o
0 1 -9 99.77 112.94 10.77 o
1 1 -9 408.71 437.22 22.70 o
2 1 -9 147.44 124.48 12.41 o
-2 2 -9 101.49 93.67 10.87 o
-1 2 -9 160.26 144.68 12.81 o
0 2 -9 241.18 225.41 15.54 o
1 2 -9 272.44 312.09 19.61 o
2 2 -9 82.41 89.97 10.71 o
-2 3 -9 95.91 96.34 11.51 o
-1 3 -9 165.59 158.09 14.50 o
0 3 -9 85.47 85.46 10.22 o
-2 -6 -8 141.39 164.87 14.20 o
-1 -6 -8 178.16 198.94 16.14 o
-2 -5 -8 488.18 550.28 23.72 o
-1 -5 -8 33.20 35.63 6.34 o
0 -5 -8 200.09 210.17 16.20 o
1 -5 -8 101.88 99.77 11.56 o
-2 -4 -8 356.35 377.14 17.80 o
-1 -4 -8 63.39 72.80 8.33 o
0 -4 -8 258.85 256.37 16.67 o
1 -4 -8 175.76 178.60 14.85 o
2 -4 -8 159.61 160.75 14.85 o
-2 -3 -8 300.24 338.10 15.74 o
-1 -3 -8 106.57 117.28 9.78 o
0 -3 -8 524.70 531.20 22.61 o
1 -3 -8 246.69 242.54 16.57 o
2 -3 -8 115.50 131.37 13.05 o
-1 -2 -8 367.18 395.08 17.66 o
0 -2 -8 481.33 467.78 20.30 o
1 -2 -8 220.73 229.58 15.47 o
2 -2 -8 175.16 185.92 15.20 o
3 -2 -8 66.89 66.59 9.77 o
-1 -1 -8 489.26 584.26 21.81 o
0 -1 -8 378.18 401.55 18.76 o
1 -1 -8 353.69 352.06 18.60 o
2 -1 -8 119.41 115.01 11.57 o
3 -1 -8 124.97 124.88 13.35 o
-1 0 -8 588.71 631.17 21.10 o
0 0 -8 382.47 434.77 19.91 o
1 0 -8 209.00 213.55 14.57 o
2 0 -8 289.76 282.81 18.07 o
3 0 -8 204.57 208.84 17.00 o
-1 1 -8 627.12 531.67 17.20 o
0 1 -8 137.73 146.27 11.32 o
1 1 -8 760.01 723.06 27.03 o
2 1 -8 123.57 140.49 12.41 o
3 1 -8 167.98 165.55 14.75 o
-3 2 -8 173.21 173.27 14.90 o
-2 2 -8 277.94 260.44 17.02 o
-1 2 -8 173.76 156.33 12.42 o
0 2 -8 336.89 323.07 11.92 o
1 2 -8 334.59 323.24 20.43 o
2 2 -8 99.32 87.58 9.97 o
3 2 -8 228.01 206.97 16.36 o
-3 3 -8 86.63 78.87 10.52 o
-2 3 -8 204.44 202.34 15.76 o
-1 3 -8 184.06 198.77 15.11 o
0 3 -8 291.15 290.87 17.97 o
1 3 -8 188.84 169.86 12.62 o
2 3 -8 121.34 122.64 12.36 o
3 3 -8 212.62 175.14 15.41 o
-2 4 -8 127.85 135.75 14.00 o
-1 4 -8 102.64 101.47 11.81 o
0 4 -8 198.73 204.85 15.95 o
1 4 -8 84.61 85.12 9.62 o
0 5 -8 117.64 121.23 13.35 o
-2 -6 -7 220.64 256.83 17.25 o
-1 -6 -7 142.05 139.67 13.11 o
0 -6 -7 141.35 150.43 14.05 o
1 -6 -7 58.62 60.78 9.27 o
-2 -5 -7 172.68 201.18 13.91 o
-1 -5 -7 178.77 200.12 14.51 o
0 -5 -7 298.77 318.75 19.17 o
1 -5 -7 84.20 81.99 10.07 o
2 -5 -7 113.25 103.61 11.86 o
-2 -4 -7 135.57 125.00 9.78 o
-1 -4 -7 656.39 703.15 24.98 o
0 -4 -7 263.27 258.03 16.03 o
1 -4 -7 80.17 90.43 10.02 o
2 -4 -7 230.32 210.14 16.16 o
-2 -3 -7 194.46 218.55 11.69 o
-1 -3 -7 756.91 767.73 23.75 o
0 -3 -7 152.36 147.28 11.23 o
1 -3 -7 336.67 370.09 19.34 o
2 -3 -7 269.92 263.30 17.67 o
3 -3 -7 149.97 128.31 13.06 o
-2 -2 -7 424.46 507.75 16.89 o
-1 -2 -7 527.88 542.10 18.74 o
0 -2 -7 298.31 313.23 15.40 o
1 -2 -7 462.18 485.38 21.35 o
2 -2 -7 324.66 335.79 19.24 o
3 -2 -7 132.80 140.84 13.45 o
-2 -1 -7 284.15 298.60 11.41 o
-1 -1 -7 445.07 545.31 18.86 o
0 -1 -7 338.96 347.62 15.82 o
1 -1 -7 804.95 801.05 26.40 o
2 -1 -7 302.03 291.02 17.59 o
3 -1 -7 170.75 167.33 14.66 o
4 -1 -7 85.06 80.10 10.86 o
-1 0 -7 209.81 224.04 11.40 o
0 0 -7 1464.57 1649.93 35.85 o
1 0 -7 540.28 534.88 21.25 o
2 0 -7 113.94 111.95 10.62 o
3 0 -7 293.06 329.12 20.36 o
4 0 -7 94.67 86.81 11.36 o
-1 1 -7 868.06 790.75 19.38 o
0 1 -7 599.00 618.89 21.38 o
1 1 -7 259.88 272.03 15.24 o
2 1 -7 267.73 250.90 15.73 o
3 1 -7 261.81 239.81 16.87 o
4 1 -7 188.98 210.06 17.39 o
-4 2 -7 121.45 135.44 13.60 o
-3 2 -7 164.86 153.46 13.21 o
-2 2 -7 589.51 534.48 22.99 o
-1 2 -7 34.60 32.07 5.16 o
0 2 -7 1482.78 1376.67 23.23 o
1 2 -7 59.64 56.52 4.75 o
2 2 -7 312.27 318.84 17.89 o
3 2 -7 383.01 382.60 21.14 o
4 2 -7 114.78 126.89 13.40 o
-3 3 -7 195.05 177.61 15.16 o
-2 3 -7 112.89 115.85 11.32 o
-1 3 -7 575.17 559.50 24.19 o
0 3 -7 373.49 401.84 19.61 o
1 3 -7 70.27 65.47 7.44 o
2 3 -7 597.15 566.78 25.03 o
3 3 -7 178.95 161.87 14.11 o
-3 4 -7 86.36 94.29 11.61 o
-2 4 -7 176.36 165.93 14.80 o
-1 4 -7 159.08 173.55 14.55 o
0 4 -7 296.22 282.85 17.83 o
1 4 -7 173.23 153.33 12.27 o
-2 5 -7 93.83 98.12 12.00 o
-1 5 -7 226.55 239.64 18.40 o
0 5 -7 98.93 88.26 10.82 o
1 5 -7 139.43 141.20 13.26 o
-3 -7 -6 117.12 123.07 13.35 o
-2 -7 -6 191.46 208.93 17.39 o
-1 -7 -6 92.51 103.23 8.52 o
0 -7 -6 80.09 76.43 10.42 o
-3 -6 -6 277.80 295.96 19.01 o
-2 -6 -6 246.05 269.78 18.31 o
-1 -6 -6 137.23 132.28 12.31 o
0 -6 -6 211.42 199.01 15.61 o
1 -6 -6 125.13 117.69 12.41 o
-3 -5 -6 352.22 390.42 19.74 o
-2 -5 -6 327.31 352.02 12.92 o
-1 -5 -6 305.13 326.02 17.74 o
0 -5 -6 257.31 269.93 16.92 o
1 -5 -6 259.58 248.03 17.07 o
2 -5 -6 85.73 85.81 10.42 o
-3 -4 -6 577.76 611.08 14.56 o
-2 -4 -6 185.05 203.07 12.03 o
-1 -4 -6 632.02 660.47 23.34 o
0 -4 -6 315.74 335.46 17.45 o
1 -4 -6 308.30 301.54 17.49 o
2 -4 -6 187.77 187.67 14.51 o
3 -4 -6 102.81 92.68 10.77 o
-2 -3 -6 761.61 807.93 21.26 o
-1 -3 -6 538.25 579.35 19.66 o
0 -3 -6 434.91 438.07 18.41 o
1 -3 -6 743.64 752.11 26.17 o
2 -3 -6 94.74 91.41 9.63 o
3 -3 -6 168.77 170.49 14.11 o
-2 -2 -6 642.31 695.67 17.50 o
-1 -2 -6 734.84 685.95 19.27 o
0 -2 -6 964.54 979.38 25.61 o
1 -2 -6 304.92 290.10 15.41 o
2 -2 -6 320.86 331.32 18.00 o
3 -2 -6 229.46 236.22 16.41 o
4 -2 -6 182.06 188.19 15.80 o
-2 -1 -6 1163.21 1321.09 21.68 o
-1 -1 -6 905.16 1003.58 22.76 o
0 -1 -6 844.21 837.43 22.52 o
1 -1 -6 546.20 514.97 19.67 o
2 -1 -6 268.02 287.30 16.44 o
3 -1 -6 479.48 508.86 24.14 o
4 -1 -6 105.29 103.66 11.76 o
-2 0 -6 1075.28 856.92 13.15 o
-1 0 -6 708.18 765.31 19.06 o
0 0 -6 528.48 565.68 18.53 o
1 0 -6 327.53 310.11 14.88 o
2 0 -6 775.34 773.58 26.29 o
3 0 -6 331.29 324.52 19.14 o
4 0 -6 179.95 203.86 16.69 o
-5 1 -6 178.74 175.30 14.60 o
-1 1 -6 828.48 684.86 16.37 o
0 1 -6 426.69 456.82 16.72 o
1 1 -6 641.01 645.16 21.78 o
2 1 -6 802.16 781.47 14.31 o
3 1 -6 252.50 255.39 16.43 o
4 1 -6 158.42 173.58 15.00 o
-4 2 -6 129.74 145.20 13.35 o
-3 2 -6 452.06 424.31 20.88 o
-2 2 -6 614.16 593.02 22.83 o
-1 2 -6 406.04 420.58 18.00 o
0 2 -6 357.93 329.12 16.53 o
1 2 -6 812.39 827.97 16.84 o
2 2 -6 496.45 514.18 21.37 o
3 2 -6 197.65 165.36 13.22 o
4 2 -6 240.23 235.49 17.46 o
-4 3 -6 129.56 133.47 13.50 o
-3 3 -6 375.09 377.73 21.14 o
-2 3 -6 44.62 43.48 6.64 o
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1 3 -6 613.67 657.61 22.23 o
2 3 -6 350.44 333.17 17.91 o
3 3 -6 245.29 211.70 15.22 o
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-1 -6 -5 326.44 304.69 19.04 o
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1 -6 -5 190.57 173.79 14.81 o
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-3 -5 -5 477.92 528.79 22.84 o
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1 -5 -5 280.84 301.49 17.98 o
2 -5 -5 291.28 282.79 18.42 o
3 -5 -5 97.63 99.72 11.71 o
-3 -4 -5 190.19 216.21 12.73 o
-2 -4 -5 907.54 927.46 27.09 o
-1 -4 -5 362.14 381.35 12.18 o
0 -4 -5 417.68 407.85 18.35 o
1 -4 -5 528.50 507.16 21.59 o
2 -4 -5 292.81 283.48 17.04 o
3 -4 -5 76.34 68.74 8.83 o
-5 -3 -5 271.58 311.97 18.11 o
-3 -3 -5 366.15 376.41 9.48 o
-2 -3 -5 1226.47 1293.52 18.99 o
-1 -3 -5 427.06 446.75 16.38 o
0 -3 -5 542.14 553.34 19.84 o
1 -3 -5 647.23 653.70 22.98 o
2 -3 -5 550.78 512.61 21.85 o
3 -3 -5 66.83 63.83 8.23 o
4 -3 -5 185.02 185.42 15.05 o
-5 -2 -5 285.74 336.80 19.56 o
-3 -2 -5 792.24 933.75 14.78 o
-2 -2 -5 973.34 995.90 18.79 o
-1 -2 -5 182.21 166.40 8.71 o
0 -2 -5 1803.87 2044.90 35.12 o
1 -2 -5 719.17 719.93 22.70 o
2 -2 -5 410.32 428.03 19.15 o
3 -2 -5 160.67 171.18 13.17 o
4 -2 -5 221.19 217.13 15.96 o
-5 -1 -5 274.26 300.40 19.26 o
-2 -1 -5 428.50 503.80 11.27 o
-1 -1 -5 1344.74 1458.34 23.80 o
0 -1 -5 1073.16 1029.52 22.65 o
1 -1 -5 693.86 783.69 22.41 o
2 -1 -5 532.20 553.75 21.32 o
3 -1 -5 339.24 366.64 19.40 o
4 -1 -5 264.05 253.55 17.42 o
-2 0 -5 413.43 357.33 7.21 o
-1 0 -5 1016.83 1165.15 20.67 o
0 0 -5 1823.74 1765.17 29.95 o
1 0 -5 655.06 618.94 19.37 o
2 0 -5 712.44 710.69 23.84 o
3 0 -5 251.24 276.55 16.58 o
4 0 -5 325.68 341.95 20.33 o
5 0 -5 113.92 119.74 12.75 o
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-1 1 -5 2217.96 2052.30 26.18 o
0 1 -5 1105.09 1094.61 23.52 o
1 1 -5 373.32 375.18 15.26 o
2 1 -5 549.55 534.06 10.57 o
3 1 -5 584.91 593.99 23.62 o
4 1 -5 343.85 399.73 21.38 o
5 1 -5 106.38 93.33 11.16 o
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3 2 -5 589.98 578.28 23.26 o
4 2 -5 174.83 174.31 14.11 o
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-3 3 -5 462.17 436.46 21.89 o
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0 3 -5 407.47 435.00 18.21 o
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2 3 -5 662.67 706.14 33.94 o
3 3 -5 371.44 338.02 18.16 o
4 3 -5 105.53 107.39 11.07 o
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0 4 -5 366.82 392.98 19.12 o
1 4 -5 807.14 764.34 25.94 o
2 4 -5 391.96 421.28 18.37 o
-3 5 -5 217.50 231.14 18.44 o
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-1 5 -5 111.98 112.82 11.66 o
0 5 -5 682.78 703.95 28.75 o
1 5 -5 281.74 311.44 18.67 o
-2 6 -5 81.04 87.24 11.80 o
-1 6 -5 89.30 89.84 11.61 o
0 6 -5 236.45 248.83 18.95 o
1 6 -5 180.03 209.38 17.04 o
0 7 -5 132.52 185.19 17.97 o
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-1 -7 -4 78.77 78.27 10.32 o
0 -7 -4 174.01 182.93 16.05 o
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-3 -6 -4 376.47 398.89 21.65 o
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-5 -3 -4 557.10 594.59 24.91 o
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5 1 -4 154.90 143.47 13.06 o
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