#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/38/2203842.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_2203842_Fobs
loop_
_publ_author_name
'Yu, Liang-Cai'
'Liang, Hong'
'Zhou, Chun-Shan'
'Chen, Zhen-Feng'
'Zhang, Yong'
_publ_section_title
;
 Enoxacin hydroiodide
;
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              o1051
_journal_page_last               o1053
_journal_volume                  60
_journal_year                    2004
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                82.783
_cell_angle_beta                 79.961
_cell_angle_gamma                85.934
_cell_length_a                   6.9831
_cell_length_b                   10.2355
_cell_length_c                   11.9309
_exptl_crystal_F_000             444.00
_reflns_d_resolution_high        0.7701
_[local]_cod_data_source_file    ya6206Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     '  _031026a'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            135.96
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-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
2 0 0 13054.67 13744.19 367.55 o
3 0 0 5692.85 5952.31 73.92 o
4 0 0 987.15 984.60 30.09 o
5 0 0 1792.99 1844.12 30.32 o
6 0 0 0.50 21.09 7.01 o
7 0 0 321.38 369.18 25.91 o
8 0 0 75.71 102.26 36.65 o
-8 1 0 205.59 268.33 41.40 o
-7 1 0 300.51 314.63 17.25 o
-6 1 0 71.33 69.00 9.00 o
-5 1 0 2968.01 2969.44 33.30 o
-4 1 0 9.34 53.05 11.47 o
-3 1 0 2409.63 2259.66 38.36 o
-2 1 0 5354.11 5350.34 53.70 o
-1 1 0 29.43 39.00 4.90 o
1 1 0 25.66 26.58 3.27 o
2 1 0 6273.11 6289.05 117.35 o
3 1 0 1299.95 1606.42 33.05 o
4 1 0 4754.22 4996.09 50.07 o
5 1 0 399.54 394.69 12.98 o
6 1 0 153.55 173.79 15.32 o
7 1 0 1308.73 1342.94 30.68 o
8 1 0 1.91 92.89 40.96 o
-8 2 0 482.59 642.87 62.64 o
-7 2 0 504.62 476.82 18.92 o
-6 2 0 970.50 951.42 22.10 o
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-4 2 0 153.11 162.54 11.09 o
-3 2 0 6525.89 6372.47 74.29 o
-2 2 0 2.75 41.70 18.60 o
-1 2 0 580.68 649.36 34.08 o
0 2 0 7.82 19.49 5.09 o
1 2 0 78.09 157.09 16.41 o
2 2 0 13947.74 13393.17 178.11 o
3 2 0 1240.36 1295.63 20.92 o
4 2 0 2482.03 2441.75 37.40 o
5 2 0 1543.30 1554.80 26.57 o
6 2 0 1300.08 1302.56 26.20 o
7 2 0 607.14 584.77 19.22 o
8 2 0 0.38 55.18 28.41 o
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-5 3 0 1041.66 1017.08 24.22 o
-4 3 0 549.53 569.14 20.92 o
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0 3 0 7110.61 7470.51 137.39 o
1 3 0 3226.37 3142.83 37.55 o
2 3 0 3675.57 3677.59 50.56 o
3 3 0 2192.27 2466.08 36.04 o
4 3 0 4222.15 4365.58 61.76 o
5 3 0 414.58 431.50 18.11 o
6 3 0 466.82 501.04 16.06 o
7 3 0 232.48 249.85 17.97 o
8 3 0 100.95 111.46 33.71 o
-8 4 0 249.82 280.16 43.12 o
-7 4 0 130.61 108.31 18.70 o
-6 4 0 925.74 950.86 29.77 o
-5 4 0 258.19 235.56 25.28 o
-4 4 0 1033.01 1057.53 23.28 o
-3 4 0 3196.50 3231.81 42.02 o
-2 4 0 0.88 28.00 12.54 o
-1 4 0 9560.33 9301.70 101.86 o
0 4 0 303.85 289.09 11.30 o
1 4 0 1489.35 1347.62 28.11 o
2 4 0 907.63 840.45 23.83 o
3 4 0 2943.67 3179.56 47.70 o
4 4 0 922.38 868.22 37.75 o
5 4 0 43.38 57.86 10.98 o
6 4 0 641.23 698.46 26.25 o
7 4 0 221.89 244.53 18.87 o
8 4 0 307.30 273.32 47.00 o
-8 5 0 387.61 494.32 58.05 o
-7 5 0 52.73 46.31 34.11 o
-6 5 0 876.99 779.63 22.91 o
-5 5 0 2.81 25.42 15.21 o
-4 5 0 1031.76 967.77 47.89 o
-3 5 0 1074.19 1028.44 22.68 o
-2 5 0 782.00 751.98 18.00 o
-1 5 0 4579.21 4541.28 64.14 o
0 5 0 21.82 38.12 7.82 o
1 5 0 7773.20 7718.31 99.01 o
2 5 0 856.29 855.36 34.74 o
3 5 0 2993.05 2939.32 40.38 o
4 5 0 2009.78 1979.25 32.79 o
5 5 0 302.00 263.48 16.41 o
6 5 0 2427.02 2285.44 43.22 o
7 5 0 81.42 54.11 12.79 o
8 5 0 241.21 199.16 44.10 o
-7 6 0 281.19 323.33 30.00 o
-6 6 0 995.31 965.77 35.39 o
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-1 6 0 537.97 514.38 16.26 o
0 6 0 534.79 536.78 33.18 o
1 6 0 3257.36 3294.26 81.35 o
2 6 0 37.37 63.59 17.73 o
3 6 0 1334.80 1314.19 44.60 o
4 6 0 641.54 607.65 22.93 o
5 6 0 561.09 563.97 20.97 o
6 6 0 122.32 146.90 24.61 o
7 6 0 52.86 76.04 18.61 o
8 6 0 104.75 76.52 25.73 o
-7 7 0 212.63 199.14 24.86 o
-6 7 0 351.18 325.60 26.23 o
-5 7 0 180.87 192.29 15.16 o
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-3 7 0 60.25 64.37 10.47 o
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-1 7 0 221.60 231.02 14.44 o
0 7 0 1531.26 1568.10 29.77 o
1 7 0 1646.52 1759.03 36.01 o
2 7 0 1.89 11.46 12.71 o
3 7 0 1799.35 1794.40 33.01 o
4 7 0 94.02 63.51 25.92 o
5 7 0 191.40 216.41 25.88 o
6 7 0 384.21 392.95 19.41 o
7 7 0 41.38 5.91 40.04 o
-6 8 0 97.58 59.56 16.21 o
-5 8 0 367.70 368.64 19.37 o
-4 8 0 869.32 853.19 23.88 o
-3 8 0 39.94 80.61 27.99 o
-2 8 0 2075.14 2258.69 53.23 o
-1 8 0 112.58 109.29 14.21 o
0 8 0 1691.03 1678.71 35.31 o
1 8 0 176.94 184.63 25.13 o
2 8 0 578.00 611.82 25.33 o
3 8 0 521.10 477.37 20.85 o
4 8 0 22.24 53.71 15.68 o
5 8 0 913.55 833.23 50.37 o
6 8 0 138.37 172.67 25.60 o
7 8 0 110.20 119.27 36.09 o
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-5 9 0 700.19 845.70 47.76 o
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-1 9 0 10.56 19.56 10.47 o
0 9 0 2398.78 2335.06 55.93 o
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2 9 0 1881.79 1921.17 42.24 o
3 9 0 882.34 967.31 154.25 o
4 9 0 54.34 58.66 23.62 o
5 9 0 340.42 310.82 29.13 o
6 9 0 4.56 65.66 23.17 o
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-4 10 0 72.95 92.68 35.23 o
-3 10 0 623.84 744.24 35.17 o
-2 10 0 445.29 434.80 29.25 o
-1 10 0 102.82 145.86 16.50 o
0 10 0 1075.78 1008.35 96.31 o
1 10 0 78.25 102.26 31.73 o
2 10 0 898.72 853.85 57.58 o
3 10 0 144.38 135.13 38.53 o
4 10 0 406.29 357.29 57.19 o
5 10 0 267.07 326.36 127.27 o
6 10 0 50.62 30.05 18.04 o
-4 11 0 0.55 60.82 42.33 o
-3 11 0 537.58 625.42 59.32 o
-2 11 0 17.04 28.93 19.75 o
-1 11 0 617.61 606.03 24.68 o
0 11 0 578.09 584.04 59.83 o
1 11 0 47.25 61.74 20.34 o
2 11 0 445.19 463.14 30.97 o
3 11 0 89.33 59.69 17.84 o
4 11 0 410.76 452.37 34.55 o
5 11 0 164.07 138.20 33.81 o
-3 12 0 467.56 410.51 50.26 o
-2 12 0 154.58 167.37 35.39 o
-1 12 0 375.38 405.06 30.25 o
0 12 0 220.30 220.62 48.43 o
1 12 0 64.61 58.65 17.20 o
2 12 0 438.19 430.23 31.56 o
3 12 0 13.50 -3.29 22.12 o
4 12 0 301.38 252.14 29.60 o
-1 13 0 391.62 341.48 51.00 o
0 13 0 63.41 89.04 57.02 o
1 13 0 660.37 636.25 66.20 o
-1 -13 1 142.88 130.47 23.53 o
0 -13 1 317.37 257.00 49.83 o
-3 -12 1 343.29 322.29 74.78 o
-2 -12 1 87.44 124.03 46.27 o
-1 -12 1 262.64 211.05 63.46 o
0 -12 1 264.32 289.57 28.03 o
1 -12 1 175.16 157.58 19.23 o
2 -12 1 543.81 528.58 58.37 o
3 -12 1 0.45 5.55 44.86 o
-5 -11 1 114.73 67.99 20.08 o
-4 -11 1 112.14 81.42 20.85 o
-3 -11 1 336.01 341.01 31.56 o
-2 -11 1 30.24 92.99 29.02 o
-1 -11 1 886.62 826.11 77.71 o
0 -11 1 184.35 180.87 18.81 o
1 -11 1 515.40 524.48 29.25 o
2 -11 1 565.04 569.30 57.67 o
3 -11 1 148.42 143.92 34.14 o
4 -11 1 381.85 339.77 49.07 o
-5 -10 1 45.68 51.88 28.65 o
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-3 -10 1 346.02 289.74 25.67 o
-2 -10 1 80.78 93.63 24.29 o
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0 -10 1 54.42 63.59 15.15 o
1 -10 1 678.90 671.88 23.86 o
2 -10 1 270.31 290.19 31.08 o
3 -10 1 337.49 366.22 23.83 o
4 -10 1 608.29 624.24 57.21 o
5 -10 1 41.25 37.72 38.74 o
-6 -9 1 94.83 121.40 32.24 o
-5 -9 1 66.87 41.60 17.92 o
-4 -9 1 319.14 378.68 30.98 o
-3 -9 1 214.33 224.39 43.66 o
-2 -9 1 1042.17 1068.18 52.65 o
-1 -9 1 610.69 599.64 27.96 o
0 -9 1 159.91 141.63 14.23 o
1 -9 1 1210.31 1222.42 29.74 o
2 -9 1 113.28 123.12 12.63 o
3 -9 1 1023.09 1054.89 28.26 o
4 -9 1 679.75 752.35 31.71 o
5 -9 1 129.79 128.21 29.86 o
6 -9 1 351.28 305.05 39.76 o
-7 -8 1 188.10 205.76 39.01 o
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-5 -8 1 3.61 70.49 26.64 o
-4 -8 1 871.84 821.35 50.11 o
-3 -8 1 101.62 122.66 19.03 o
-2 -8 1 948.73 929.61 47.59 o
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1 -8 1 1666.75 1629.44 28.65 o
2 -8 1 27.03 37.35 27.15 o
3 -8 1 695.25 717.05 31.09 o
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5 -8 1 462.75 499.45 42.48 o
6 -8 1 425.81 444.85 26.67 o
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-6 -7 1 295.00 314.97 32.19 o
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2 -7 1 588.66 583.81 22.18 o
3 -7 1 1491.94 1457.81 30.57 o
4 -7 1 0.84 28.48 12.86 o
5 -7 1 605.58 475.53 51.88 o
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0 -6 1 2249.88 2285.36 54.70 o
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3 -6 1 1810.92 1841.75 56.60 o
4 -6 1 228.05 252.14 13.27 o
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6 -6 1 99.11 132.58 14.62 o
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-8 -5 1 62.61 101.41 45.53 o
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2 -5 1 2255.39 2290.12 30.81 o
3 -5 1 1511.09 1503.91 44.51 o
4 -5 1 324.36 340.78 15.84 o
5 -5 1 1106.31 1127.60 34.13 o
6 -5 1 56.13 69.39 10.79 o
7 -5 1 298.68 336.44 58.34 o
8 -5 1 83.03 98.03 27.43 o
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-3 -4 1 746.11 630.30 18.93 o
-2 -4 1 255.24 197.97 10.81 o
-1 -4 1 5105.22 4999.24 63.10 o
0 -4 1 4342.99 4138.62 61.18 o
1 -4 1 1054.59 1010.61 18.50 o
2 -4 1 3120.41 2943.28 29.17 o
3 -4 1 847.90 835.18 27.56 o
4 -4 1 1934.34 1895.93 40.51 o
5 -4 1 1341.30 1387.05 43.53 o
6 -4 1 120.61 122.43 11.69 o
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8 -4 1 14.89 83.14 33.41 o
-8 -3 1 235.60 293.91 48.26 o
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-5 -3 1 991.05 997.13 36.05 o
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-2 -3 1 6936.00 7143.02 80.10 o
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1 -3 1 6290.95 6557.67 68.26 o
2 -3 1 6184.67 5918.37 82.21 o
3 -3 1 21.11 27.77 9.28 o
4 -3 1 1802.50 1777.34 35.86 o
5 -3 1 947.26 986.16 22.04 o
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8 -3 1 9.47 31.30 35.04 o
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-6 -2 1 746.61 739.68 20.67 o
-5 -2 1 772.96 767.63 18.50 o
-4 -2 1 1237.12 1220.41 39.72 o
-3 -2 1 5391.21 5448.15 101.14 o
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0 -2 1 2147.33 2067.70 46.51 o
2 -2 1 11125.57 10896.02 122.55 o
3 -2 1 1071.79 1122.58 20.02 o
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7 -2 1 270.30 274.64 13.86 o
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-4 0 1 1437.33 1383.88 30.89 o
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-2 0 1 6932.06 7029.87 90.15 o
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2 0 1 2540.00 2572.71 34.74 o
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4 0 1 2146.90 2101.91 47.47 o
5 0 1 13.45 63.38 8.69 o
6 0 1 1908.64 1975.81 52.19 o
7 0 1 18.01 11.15 10.39 o
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-8 1 1 139.54 208.91 48.17 o
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-6 1 1 1288.17 1282.24 30.16 o
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-4 1 1 2157.26 2177.02 50.21 o
-3 1 1 179.27 170.70 11.47 o
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-1 1 1 6048.37 5934.94 62.75 o
2 1 1 156.94 233.98 34.05 o
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3 3 1 5482.84 5292.24 63.71 o
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7 3 1 1047.84 943.08 65.63 o
8 3 1 494.88 481.27 53.01 o
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-7 4 1 67.79 65.98 15.11 o
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-5 4 1 1768.36 1704.75 31.45 o
-4 4 1 1052.41 1061.15 43.25 o
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0 4 1 5376.49 5303.83 66.91 o
1 4 1 396.98 367.56 11.95 o
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3 4 1 1691.94 1637.30 27.44 o
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