#------------------------------------------------------------------------------
#$Date: 2016-04-03 00:24:49 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181018 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/98/2209890.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_2209890_Fobs
loop_
_publ_author_name
'Fuma, Yasuhiro'
'Ebihara, Masahiro'
_publ_section_title
;
 Tetra-\m-acetamidato-\k^4^<i>N</i>:<i>O</i>;\k^4^<i>O</i>:<i>N</i>-diaquadirhodium(II,III)
 perrhenate
;
_journal_coeditor_code           HK2084
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1898
_journal_page_last               m1900
_journal_volume                  62
_journal_year                    2006
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 97.664
_cell_angle_gamma                90.000
_cell_length_a                   19.7180
_cell_length_b                   11.5780
_cell_length_c                   8.2521
_exptl_crystal_F_000             1364.00
_reflns_d_resolution_high        0.7704
_cod_data_source_file            hk2084Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' _fuma049'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            526.07
_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+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-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
4 0 0 234902.94 238314.44 8313.00 o
6 0 0 45028.32 46491.24 708.68 o
8 0 0 49817.99 48013.53 685.85 o
10 0 0 42634.82 41745.42 863.19 o
12 0 0 43458.48 44052.51 786.07 o
14 0 0 71908.05 73035.95 1245.13 o
16 0 0 11304.91 11693.76 284.31 o
18 0 0 39442.67 43041.82 912.55 o
20 0 0 259.43 420.55 103.62 o
22 0 0 46334.76 47716.58 1206.58 o
24 0 0 1786.66 1775.76 192.88 o
3 1 0 57709.86 60287.23 675.07 o
5 1 0 151482.27 156000.53 2235.99 o
7 1 0 14612.13 14153.52 175.36 o
9 1 0 107482.52 102456.49 1223.90 o
11 1 0 16031.15 14938.40 199.96 o
13 1 0 73966.93 74244.45 1086.54 o
15 1 0 7639.89 7041.83 150.55 o
17 1 0 38070.37 38246.55 625.48 o
19 1 0 6065.42 5945.62 196.02 o
21 1 0 11540.34 12047.85 280.91 o
23 1 0 6737.56 6848.14 194.48 o
25 1 0 3396.20 3490.41 184.75 o
0 2 0 5460.27 4271.82 314.17 o
2 2 0 158057.81 163641.36 6192.93 o
4 2 0 38730.54 40110.55 956.30 o
6 2 0 36939.72 36191.18 472.58 o
8 2 0 8220.06 7061.56 109.45 o
10 2 0 49095.67 47642.95 762.80 o
12 2 0 33022.37 31557.93 487.51 o
14 2 0 10884.24 10095.83 162.15 o
16 2 0 29784.61 28849.51 467.24 o
18 2 0 5314.40 5083.60 156.51 o
20 2 0 11732.97 11590.04 255.14 o
22 2 0 1172.10 1338.18 152.54 o
24 2 0 10538.60 10485.00 298.49 o
1 3 0 41367.09 48440.27 2200.79 o
3 3 0 37618.52 41956.60 2224.89 o
5 3 0 924.76 1123.94 55.58 o
7 3 0 83924.30 84891.87 1121.20 o
9 3 0 9877.14 10350.55 181.34 o
11 3 0 85687.24 84495.17 1219.89 o
13 3 0 1435.20 1640.82 44.46 o
15 3 0 58306.21 56439.25 785.07 o
17 3 0 198.04 444.87 82.91 o
19 3 0 11663.64 11547.44 325.77 o
21 3 0 1769.72 1850.37 133.95 o
23 3 0 1895.45 2136.70 249.74 o
0 4 0 20549.34 22419.71 2740.36 o
2 4 0 82639.03 84153.34 3473.20 o
4 4 0 20672.56 26791.36 918.17 o
6 4 0 60926.66 59963.90 1502.14 o
8 4 0 277.23 441.48 49.54 o
10 4 0 8194.00 7328.51 178.13 o
12 4 0 7673.32 7187.65 132.67 o
14 4 0 135.00 218.14 57.56 o
16 4 0 14953.64 14304.80 294.78 o
18 4 0 1641.06 1658.90 122.08 o
20 4 0 17948.43 17112.90 553.44 o
22 4 0 1418.08 1363.47 130.78 o
24 4 0 8000.84 8368.40 341.17 o
1 5 0 7912.00 8842.14 419.45 o
3 5 0 1837.37 2212.66 219.05 o
5 5 0 10172.55 10201.76 378.52 o
7 5 0 1366.00 1509.85 114.24 o
9 5 0 842.48 956.79 66.56 o
11 5 0 2557.62 2545.41 86.29 o
13 5 0 1184.79 1260.39 66.17 o
15 5 0 554.53 618.82 57.53 o
17 5 0 1855.50 1989.62 127.24 o
19 5 0 17.56 340.57 215.29 o
21 5 0 394.95 347.99 87.28 o
23 5 0 395.58 637.04 130.38 o
0 6 0 55010.35 49346.54 3518.76 o
2 6 0 44352.85 45399.84 1518.71 o
4 6 0 27194.24 27100.96 1913.48 o
6 6 0 12198.76 12075.53 410.16 o
8 6 0 7515.50 7355.28 353.53 o
10 6 0 751.51 900.99 80.29 o
12 6 0 462.48 563.66 57.88 o
14 6 0 2968.98 2847.15 107.22 o
16 6 0 5193.54 5520.26 191.27 o
18 6 0 7408.54 6989.52 236.60 o
20 6 0 7857.26 7999.58 277.90 o
22 6 0 7202.13 7774.70 261.02 o
1 7 0 23.38 439.12 146.93 o
3 7 0 14837.29 14767.92 553.30 o
5 7 0 15155.57 14134.81 820.04 o
7 7 0 27424.10 27920.10 914.02 o
9 7 0 11408.71 11030.70 317.81 o
11 7 0 14508.79 14531.87 296.39 o
13 7 0 4166.11 4066.03 121.38 o
15 7 0 15130.94 14703.39 285.89 o
17 7 0 3960.27 3879.64 214.24 o
19 7 0 4683.06 4538.90 201.03 o
21 7 0 163.03 491.19 111.44 o
0 8 0 1839.66 1094.54 251.12 o
2 8 0 6722.35 5981.64 369.14 o
4 8 0 128.62 679.32 249.64 o
6 8 0 9546.68 10185.67 846.04 o
8 8 0 683.32 990.31 152.46 o
10 8 0 3128.95 3416.79 143.38 o
12 8 0 1815.26 2092.71 177.96 o
14 8 0 1038.33 1121.90 81.83 o
16 8 0 2730.98 2926.28 137.30 o
18 8 0 238.27 434.86 118.59 o
20 8 0 2219.94 2334.05 158.47 o
1 9 0 13143.72 10766.96 494.23 o
3 9 0 256.05 477.06 161.22 o
5 9 0 34272.87 34917.71 1412.33 o
7 9 0 5294.11 5511.31 337.70 o
9 9 0 25490.47 25075.46 885.40 o
11 9 0 79.03 337.42 106.01 o
13 9 0 15890.07 15599.29 335.48 o
15 9 0 148.60 278.12 66.27 o
17 9 0 12389.82 12456.51 307.84 o
19 9 0 53.44 251.55 106.08 o
0 10 0 58735.73 47910.44 2003.25 o
2 10 0 2371.64 2123.69 253.37 o
4 10 0 54967.03 52433.19 3060.07 o
6 10 0 1861.02 2068.62 291.98 o
8 10 0 25010.48 23930.97 772.59 o
10 10 0 2533.66 2436.06 137.34 o
12 10 0 2587.77 2811.38 144.01 o
14 10 0 14359.17 14081.05 383.70 o
16 10 0 161.38 349.49 117.00 o
18 10 0 16478.89 15270.11 560.90 o
1 11 0 12694.29 10578.25 463.87 o
3 11 0 4313.46 4105.55 342.03 o
5 11 0 11715.10 10639.42 452.26 o
7 11 0 4031.00 3873.87 1212.10 o
9 11 0 12850.65 12186.25 640.93 o
11 11 0 586.46 722.86 89.99 o
13 11 0 13222.42 12843.41 320.17 o
15 11 0 1300.85 1135.88 95.20 o
17 11 0 4822.22 4473.45 204.19 o
0 12 0 563.24 639.00 251.40 o
2 12 0 22819.67 21580.94 892.43 o
4 12 0 725.97 819.27 260.75 o
6 12 0 11398.59 11907.36 919.73 o
8 12 0 2004.59 1928.82 255.31 o
10 12 0 4628.25 4348.49 177.14 o
12 12 0 6223.92 5975.72 218.37 o
14 12 0 1909.19 1810.20 178.78 o
1 13 0 2410.98 2212.30 360.66 o
3 13 0 10687.75 10376.92 479.28 o
5 13 0 51.56 542.98 274.56 o
7 13 0 18451.25 17733.72 680.03 o
9 13 0 2175.58 2468.31 329.52 o
11 13 0 27084.41 25778.84 968.61 o
0 14 0 348.39 374.09 243.42 o
2 14 0 12237.16 10518.89 494.96 o
4 14 0 472.02 711.33 263.10 o
6 14 0 8761.22 8615.33 642.58 o
8 14 0 69.03 341.06 251.53 o
1 15 0 1433.46 1260.70 225.42 o
-25 1 1 2404.12 2660.52 239.64 o
-23 1 1 12312.09 12912.87 527.21 o
-21 1 1 3179.55 3132.21 136.45 o
-19 1 1 12055.44 12234.25 221.92 o
-17 1 1 218.25 374.84 74.12 o
-15 1 1 10665.56 10642.37 210.59 o
-13 1 1 1194.73 1266.49 55.26 o
-11 1 1 5135.65 5468.28 79.84 o
-9 1 1 29959.23 30517.23 369.64 o
-7 1 1 9288.77 8235.56 102.11 o
-5 1 1 143414.86 144440.77 2976.85 o
-3 1 1 33214.70 32148.83 546.81 o
1 1 1 58941.23 54839.45 1348.74 o
3 1 1 51147.59 53174.05 758.37 o
5 1 1 205.80 452.84 37.17 o
7 1 1 23977.05 24806.46 260.05 o
9 1 1 131.90 286.23 32.44 o
11 1 1 7162.91 7506.72 133.93 o
13 1 1 6582.42 6601.51 112.26 o
15 1 1 2669.71 2858.58 108.14 o
17 1 1 14740.03 14995.68 265.04 o
19 1 1 3289.12 3467.66 124.63 o
21 1 1 14703.47 14689.48 294.65 o
23 1 1 3289.77 3529.45 191.70 o
-24 2 1 2531.71 2336.64 182.61 o
-22 2 1 3508.49 3720.28 155.17 o
-20 2 1 1070.10 1345.50 117.93 o
-18 2 1 9924.29 10399.01 237.42 o
-16 2 1 318.79 419.42 52.59 o
-14 2 1 55884.39 56293.32 853.79 o
-12 2 1 8361.71 8322.84 133.96 o
-10 2 1 128710.42 127138.32 1890.30 o
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0 2 1 36185.23 34788.72 746.03 o
2 2 1 18246.80 18068.72 316.21 o
4 2 1 56680.19 56442.83 798.38 o
6 2 1 2269.55 2614.17 54.11 o
8 2 1 70757.12 69358.94 792.83 o
10 2 1 10474.85 10337.26 142.27 o
12 2 1 84386.88 85857.48 1148.60 o
14 2 1 11010.32 10788.62 160.88 o
16 2 1 42602.96 41729.68 620.67 o
18 2 1 63.84 314.52 78.29 o
20 2 1 5632.83 5990.70 190.98 o
22 2 1 1994.27 2232.77 135.34 o
24 2 1 475.78 496.57 172.97 o
-25 3 1 590.17 581.48 104.14 o
-23 3 1 7235.60 7198.58 240.50 o
-21 3 1 1474.20 1679.96 124.58 o
-19 3 1 17241.70 17702.80 349.21 o
-17 3 1 4107.24 4188.31 117.75 o
-15 3 1 6913.55 7102.44 218.06 o
-13 3 1 19326.76 19723.77 293.56 o
-11 3 1 6227.64 6353.23 153.56 o
-9 3 1 33743.27 33858.75 673.73 o
-7 3 1 38392.37 43285.30 934.36 o
-5 3 1 62788.13 67193.15 1249.80 o
-3 3 1 19780.63 21834.03 758.55 o
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5 3 1 10258.36 11077.30 152.69 o
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11 3 1 6198.73 6241.59 136.51 o
13 3 1 16180.49 16071.76 355.29 o
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4 4 1 1625.09 1694.04 123.95 o
6 4 1 113994.55 122132.55 1922.93 o
8 4 1 5760.22 6483.92 184.15 o
10 4 1 60831.78 58123.91 994.85 o
12 4 1 1161.28 1274.63 59.83 o
14 4 1 40478.93 39955.90 582.75 o
16 4 1 979.72 1091.38 117.10 o
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20 4 1 4277.36 4069.23 181.14 o
22 4 1 6501.43 6786.90 332.76 o
24 4 1 4289.13 4540.95 216.21 o
-23 5 1 645.61 617.00 182.36 o
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-11 5 1 20270.75 20485.03 352.91 o
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-7 5 1 101803.27 104053.66 2181.75 o
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-1 5 1 18728.46 17230.78 2640.93 o
3 5 1 625.37 1119.72 408.62 o
5 5 1 113054.59 117024.24 1991.67 o
7 5 1 11654.99 12012.21 229.40 o
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19 5 1 37355.07 37775.13 1021.52 o
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23 5 1 22476.50 22864.16 572.04 o
-22 6 1 5471.56 4907.58 209.41 o
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0 6 1 17992.09 16699.71 656.71 o
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6 6 1 69373.16 66195.56 2771.02 o
8 6 1 7567.09 7952.82 211.69 o
10 6 1 50665.83 53371.23 909.85 o
12 6 1 4137.83 3948.50 124.24 o
14 6 1 24154.93 23308.57 384.26 o
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20 6 1 3236.67 3495.76 209.49 o
22 6 1 6381.37 6058.37 232.81 o
-21 7 1 1053.86 1245.52 194.22 o
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-17 7 1 1579.58 1711.37 177.12 o
-15 7 1 18088.56 18321.96 438.08 o
-13 7 1 3604.68 3608.50 130.19 o
-11 7 1 21593.40 21749.22 427.70 o
-9 7 1 28237.80 28238.95 690.99 o
-7 7 1 3634.96 3619.27 171.49 o
-5 7 1 65948.65 65495.05 4126.54 o
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5 7 1 11005.99 11716.30 587.16 o
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17 7 1 20446.18 19461.82 350.11 o
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21 7 1 12253.36 12263.21 345.37 o
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18 8 1 121.44 237.51 108.17 o
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-11 9 1 1299.65 1552.04 129.87 o
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-7 9 1 169.87 349.81 250.12 o
-5 9 1 40034.07 42135.51 1338.93 o
-3 9 1 113.55 553.36 315.40 o
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1 9 1 303.76 326.67 306.98 o
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5 9 1 112.03 391.16 292.28 o
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-5 11 1 3239.90 3438.94 421.50 o
-3 11 1 21888.53 20375.63 770.05 o
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1 11 1 30561.69 26163.03 1778.16 o
3 11 1 9653.30 9118.99 531.74 o
5 11 1 10419.57 10390.43 487.50 o
7 11 1 400.80 609.52 598.91 o
9 11 1 2943.94 3411.82 192.05 o
11 11 1 361.67 508.94 109.65 o
13 11 1 203.33 226.22 61.92 o
15 11 1 4054.96 3781.62 184.76 o
-14 12 1 5337.33 4522.13 284.31 o
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-10 12 1 5802.10 5363.09 379.93 o
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0 12 1 826.19 788.06 191.75 o
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