#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/00/92/2009219.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_2009219_Fobs
loop_
_publ_author_name
'Wirth, A.'
'Moers, O.'
'Jones, P. G.'
'Blaschette, A.'
_publ_section_title
;
Polysulfonylamines. CXIV.
trans-Dimethyltetrakis(urea-O)tin(IV)
bis[di(methanesulfonyl)amidate] acetonitrile monosolvate
;
_journal_issue 12
_journal_name_full 'Acta Crystallographica Section C'
_journal_page_first 2033
_journal_page_last 2035
_journal_volume 55
_journal_year 1999
_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 116.371
_cell_angle_gamma 90.000
_cell_length_a 47.6004
_cell_length_b 6.6063
_cell_length_c 22.1354
_exptl_crystal_F_000 3168.00
_reflns_d_resolution_high 0.8409
_[local]_cod_data_source_file bm1351sup2.hkl
_[local]_cod_data_source_block jezabr
#BEGIN Tags that were not found in dictionaries:
_shelx_title ' C:\OM\JEZABR in C2/c'
_shelx_refln_list_code 4
_shelx_f_calc_maximum 730.02
_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
8 0 0 59127.90 59347.93 569.53 o
10 0 0 86899.24 84113.29 754.17 o
12 0 0 468119.63 435423.56 1778.80 o
14 0 0 11647.53 10688.40 413.49 o
16 0 0 40533.50 42366.11 699.56 o
18 0 0 41994.06 45754.67 756.77 o
20 0 0 156034.83 158185.72 1422.52 o
22 0 0 89.85 275.66 340.68 o
24 0 0 142860.13 146985.00 1516.14 o
26 0 0 2720.39 3698.03 442.10 o
28 0 0 22974.20 24328.46 777.57 o
30 0 0 12399.14 13889.72 683.95 o
32 0 0 8932.85 9505.13 650.15 o
34 0 0 25369.06 25883.61 928.41 o
36 0 0 65085.08 62502.43 1341.90 o
38 0 0 118.56 288.66 527.92 o
40 0 0 47020.16 48152.41 1256.08 o
42 0 0 1593.21 1794.40 572.13 o
44 0 0 5720.67 6218.00 746.37 o
46 0 0 1901.97 2049.26 595.53 o
48 0 0 20103.46 19044.08 1055.84 o
50 0 0 10240.87 11159.11 912.80 o
1 1 0 1075.21 1080.55 201.55 o
3 1 0 100421.36 98668.76 676.15 o
5 1 0 175653.27 172931.02 938.81 o
7 1 0 2047.36 2031.06 288.66 o
9 1 0 7811.09 7908.38 390.09 o
11 1 0 7204.13 8423.29 382.29 o
13 1 0 8773.59 9008.42 397.89 o
15 1 0 44935.92 44893.88 725.56 o
17 1 0 9325.39 8368.68 408.29 o
19 1 0 95238.06 96739.12 1128.65 o
21 1 0 6021.82 6150.38 449.90 o
23 1 0 37686.41 38121.96 829.59 o
25 1 0 2201.33 2150.68 429.10 o
27 1 0 17097.72 17704.78 704.76 o
29 1 0 8485.98 8714.56 592.93 o
31 1 0 9689.67 10737.81 681.35 o
33 1 0 2538.14 2699.41 553.92 o
35 1 0 4280.36 4366.38 631.94 o
37 1 0 5490.49 5422.22 668.35 o
39 1 0 11490.76 11291.73 774.97 o
41 1 0 18730.48 19493.98 933.61 o
43 1 0 5702.13 5388.41 741.17 o
45 1 0 6759.84 6454.65 725.56 o
47 1 0 373.34 -306.87 556.52 o
49 1 0 6336.37 6361.03 754.17 o
0 2 0 139098.05 134840.28 1076.64 o
2 2 0 45951.77 46547.85 673.55 o
4 2 0 6586.87 6309.02 366.68 o
6 2 0 614.31 923.21 288.66 o
8 2 0 18630.38 18178.08 491.51 o
10 2 0 134671.80 125782.45 1154.66 o
12 2 0 28045.71 32039.20 657.95 o
14 2 0 138472.02 140587.56 1313.29 o
16 2 0 648.86 1263.88 356.28 o
18 2 0 16187.47 15811.55 577.33 o
20 2 0 456.31 395.29 356.28 o
22 2 0 137146.39 136041.75 1521.34 o
24 2 0 4998.32 5073.74 486.31 o
26 2 0 73924.60 70910.13 1235.28 o
28 2 0 5497.33 5372.81 540.92 o
30 2 0 24378.98 24000.79 886.80 o
32 2 0 2212.05 1929.63 535.72 o
34 2 0 26202.15 26512.95 951.81 o
36 2 0 1.44 -20.80 504.51 o
38 2 0 46670.10 47393.04 1300.29 o
40 2 0 2291.68 3411.97 642.34 o
42 2 0 8421.27 10137.08 785.38 o
44 2 0 7829.63 7877.17 780.18 o
46 2 0 34164.79 33217.26 1269.08 o
48 2 0 10.65 176.84 660.55 o
1 3 0 28001.64 25829.00 657.95 o
3 3 0 124.31 117.03 309.47 o
5 3 0 22134.69 21382.00 595.53 o
7 3 0 113062.01 108948.86 1240.48 o
9 3 0 7682.81 6675.70 478.51 o
11 3 0 27.59 49.41 343.28 o
13 3 0 47030.48 46542.65 899.80 o
15 3 0 782.43 613.74 364.08 o
17 3 0 14985.17 14542.46 598.13 o
19 3 0 56059.80 55818.94 1063.64 o
21 3 0 15606.06 15780.34 670.95 o
23 3 0 2486.89 2132.48 522.72 o
25 3 0 14815.94 14781.72 704.76 o
27 3 0 79880.80 78800.30 1432.92 o
29 3 0 15686.32 17231.47 782.78 o
31 3 0 6126.69 6163.38 689.15 o
33 3 0 4834.36 4514.61 613.74 o
35 3 0 125.25 -111.83 533.12 o
37 3 0 590.66 410.89 611.14 o
39 3 0 8075.91 7292.04 751.57 o
41 3 0 25713.51 24658.74 1115.65 o
43 3 0 4094.58 3575.80 730.76 o
45 3 0 1948.93 2187.09 668.35 o
0 4 0 71491.45 68676.22 1152.06 o
2 4 0 6729.27 7224.42 483.71 o
4 4 0 49802.57 51015.65 1001.22 o
6 4 0 562.34 949.21 353.68 o
8 4 0 15983.85 16277.05 639.74 o
10 4 0 1320.21 1542.15 397.89 o
12 4 0 56324.53 56255.83 1105.25 o
14 4 0 611.28 358.88 455.10 o
16 4 0 18468.20 17442.12 722.96 o
18 4 0 281.83 288.66 475.91 o
20 4 0 14107.66 14773.92 715.16 o
22 4 0 15815.92 14206.99 800.98 o
24 4 0 46745.33 46854.72 1204.07 o
26 4 0 10916.97 10410.14 759.37 o
28 4 0 10262.08 9905.62 748.97 o
30 4 0 652.97 673.55 535.72 o
32 4 0 16232.27 16344.67 902.40 o
34 4 0 644.66 509.71 556.52 o
36 4 0 40990.72 42046.24 1357.50 o
38 4 0 1421.45 1310.69 605.94 o
40 4 0 4353.01 4907.30 715.16 o
42 4 0 211.36 616.34 626.74 o
1 5 0 8516.44 7039.78 639.74 o
3 5 0 43639.31 42959.05 1128.65 o
5 5 0 29590.43 30824.72 993.42 o
7 5 0 877.83 421.29 473.31 o
9 5 0 1923.42 3450.97 556.52 o
11 5 0 3338.64 3555.00 590.33 o
13 5 0 1035.89 1029.83 501.91 o
15 5 0 10794.72 9551.94 715.16 o
17 5 0 61601.88 61274.96 1347.10 o
19 5 0 21982.02 21584.85 910.20 o
21 5 0 2089.29 2811.23 564.33 o
23 5 0 4388.31 3747.44 608.54 o
25 5 0 2704.83 2426.34 587.73 o
27 5 0 1338.08 1084.44 577.33 o
29 5 0 3184.86 3555.00 696.96 o
31 5 0 17994.14 16875.19 1024.63 o
33 5 0 6151.56 6613.29 767.17 o
35 5 0 3576.34 3711.03 626.74 o
37 5 0 17756.10 18713.80 1050.64 o
39 5 0 10964.73 10756.02 967.42 o
0 6 0 6353.96 5947.54 689.15 o
2 6 0 21604.95 21249.37 962.22 o
4 6 0 1379.65 1297.69 585.13 o
6 6 0 12787.35 13658.27 860.79 o
8 6 0 2589.23 2480.96 556.52 o
10 6 0 25255.74 26193.08 1022.03 o
12 6 0 37.39 -18.20 504.51 o
14 6 0 39096.90 42946.04 1282.09 o
16 6 0 211.28 681.35 551.32 o
18 6 0 10616.68 10181.29 813.98 o
20 6 0 1256.47 1219.67 543.52 o
22 6 0 30585.94 31352.64 1222.27 o
24 6 0 659.47 309.47 572.13 o
26 6 0 27910.34 27873.06 1196.27 o
28 6 0 556.99 894.60 603.34 o
30 6 0 5846.33 6267.41 733.36 o
32 6 0 416.73 239.25 621.54 o
1 7 0 839.00 1118.25 611.14 o
3 7 0 7391.81 7117.80 803.58 o
5 7 0 11336.37 12904.10 936.21 o
7 7 0 8168.76 7357.05 860.79 o
9 7 0 10479.21 9900.42 879.00 o
11 7 0 8733.59 7409.06 819.18 o
13 7 0 3147.39 3357.35 712.56 o
15 7 0 5071.51 5123.15 756.77 o
17 7 0 5598.33 6810.93 767.17 o
19 7 0 3118.81 3276.74 681.35 o
21 7 0 1918.98 2213.10 676.15 o
23 7 0 6545.86 6758.92 774.97 o
-51 1 1 6436.41 7307.64 821.78 o
-49 1 1 5336.85 5391.01 733.36 o
-47 1 1 41.17 413.49 634.54 o
-45 1 1 891.33 1625.36 590.33 o
-43 1 1 13177.41 12550.42 808.78 o
-41 1 1 27680.39 26476.54 1032.43 o
-39 1 1 48.25 215.85 538.32 o
-37 1 1 17724.24 18737.21 855.59 o
-35 1 1 22.61 72.82 488.91 o
-33 1 1 9634.36 9174.86 647.55 o
-31 1 1 28764.40 28947.10 879.00 o
-29 1 1 139.42 384.89 416.09 o
-27 1 1 72705.20 74124.45 1196.27 o
-25 1 1 20131.33 20060.90 665.75 o
-23 1 1 39373.09 40706.94 842.59 o
-21 1 1 18375.63 16461.70 569.53 o
-19 1 1 5245.77 6387.03 392.69 o
-17 1 1 68883.11 71882.74 912.80 o
-15 1 1 172041.81 172491.53 1295.09 o
-13 1 1 39198.64 37991.93 631.94 o
-11 1 1 218982.61 205453.94 1245.68 o
-9 1 1 84007.71 82664.76 772.37 o
-7 1 1 7451.15 7229.62 325.07 o
-5 1 1 193785.75 188368.09 959.62 o
-3 1 1 132806.59 129485.67 754.17 o
-1 1 1 165587.30 157282.55 1145.56 o
1 1 1 538.70 240.01 149.58 o
3 1 1 6702.32 6855.14 280.86 o
5 1 1 359537.44 338221.56 1365.31 o
7 1 1 105818.16 108805.84 879.00 o
9 1 1 14622.95 15606.10 452.50 o
11 1 1 8514.96 9278.88 390.09 o
13 1 1 8155.23 7970.79 390.09 o
15 1 1 3882.52 4868.29 382.29 o
17 1 1 64131.95 64712.93 910.20 o
19 1 1 37825.13 40436.48 795.78 o
21 1 1 156.19 122.23 364.08 o
23 1 1 22.58 226.25 358.88 o
25 1 1 60791.75 59158.08 1089.64 o
27 1 1 5600.04 6524.87 559.13 o
29 1 1 8060.68 7494.88 595.53 o
31 1 1 57.83 262.66 475.91 o
33 1 1 332.33 299.07 509.71 o
35 1 1 50486.42 47413.85 1224.88 o
37 1 1 3673.73 3255.93 639.74 o
39 1 1 4661.82 3900.88 634.54 o
41 1 1 6603.51 6725.11 707.36 o
43 1 1 411.92 265.26 592.93 o
45 1 1 35035.66 34897.23 1300.29 o
47 1 1 3998.17 4592.63 798.38 o
49 1 1 6044.22 5258.38 754.17 o
-48 2 1 572.97 826.99 585.13 o
-46 2 1 62.20 377.08 592.93 o
-44 2 1 25.31 -361.48 569.53 o
-42 2 1 3184.04 3630.42 631.94 o
-40 2 1 1883.26 1227.48 587.73 o
-38 2 1 355.08 -475.91 520.12 o
-36 2 1 6864.90 6852.54 655.35 o
-34 2 1 14.53 -403.09 522.72 o
-32 2 1 9867.71 9739.19 678.75 o
-30 2 1 3.13 -13.00 470.71 o
-28 2 1 14304.15 14420.24 696.96 o
-26 2 1 1785.72 2070.06 447.30 o
-24 2 1 2574.73 3534.19 449.90 o
-22 2 1 1988.75 1711.18 400.49 o
-20 2 1 1024.11 1596.76 353.68 o
-18 2 1 11439.71 12602.43 540.92 o
-16 2 1 28264.43 29152.54 670.95 o
-14 2 1 3048.78 2915.25 348.48 o
-12 2 1 3604.07 2777.42 348.48 o
-10 2 1 17733.47 17525.33 507.11 o
-8 2 1 1336.67 910.20 301.67 o
-6 2 1 1398.82 1315.90 301.67 o
-4 2 1 1571.28 1458.93 304.27 o
-2 2 1 227365.92 217668.88 1341.90 o
0 2 1 2667.81 2734.32 233.52 o
2 2 1 2661.60 2387.34 325.07 o
4 2 1 4625.08 5133.55 356.28 o
6 2 1 124.79 75.42 283.46 o
8 2 1 51932.14 50753.00 751.57 o
10 2 1 704.28 314.67 317.27 o
12 2 1 317.72 252.26 317.27 o
14 2 1 1231.20 1895.83 353.68 o
16 2 1 1320.25 2262.51 377.08 o
18 2 1 18818.73 19621.40 621.54 o
20 2 1 16262.50 15764.74 598.13 o
22 2 1 4570.31 3926.88 452.50 o
24 2 1 7864.23 7533.89 559.13 o
26 2 1 4.98 -483.71 483.71 o
28 2 1 12832.79 12542.62 694.36 o
30 2 1 110.10 41.61 507.11 o
32 2 1 5593.89 4644.64 626.74 o
34 2 1 2918.96 2767.02 561.73 o
36 2 1 70.99 208.05 535.72 o
38 2 1 8114.81 8485.71 689.15 o
40 2 1 875.02 1136.46 585.13 o
42 2 1 1182.24 1074.04 634.54 o
44 2 1 5458.28 5344.20 746.37 o
46 2 1 2205.29 2501.76 691.76 o
48 2 1 1768.16 2064.86 709.96 o
-47 3 1 1242.44 1471.93 626.74 o
-45 3 1 871.17 1032.43 657.95 o
-43 3 1 4308.69 4337.77 738.57 o
-41 3 1 19615.34 19207.91 1019.43 o
-39 3 1 3161.16 3731.84 650.15 o
-37 3 1 13439.74 13439.82 803.58 o
-35 3 1 1606.11 1867.22 592.93 o
-33 3 1 4373.41 4241.55 613.74 o
-31 3 1 23179.37 23132.19 933.61 o
-29 3 1 14643.17 13065.33 772.37 o
-27 3 1 19003.15 19826.85 795.78 o
-25 3 1 595.53 1053.24 460.30 o
-23 3 1 15634.25 14716.70 678.75 o
-21 3 1 955.20 728.16 395.29 o
-19 3 1 197.09 98.82 358.88 o
-17 3 1 24763.62 25415.51 717.76 o
-15 3 1 32692.36 33282.27 795.78 o
-13 3 1 11426.61 12110.92 540.92 o
-11 3 1 5413.01 4171.34 413.49 o
-9 3 1 262.40 218.45 338.08 o
-7 3 1 22906.22 23595.10 637.14 o
-5 3 1 35473.24 34618.97 730.76 o
-3 3 1 9440.18 9528.54 475.91 o
-1 3 1 5691.05 5203.77 405.69 o
1 3 1 2225.17 2655.20 366.68 o
3 3 1 510.00 364.08 325.07 o
5 3 1 6655.11 5882.52 421.29 o
7 3 1 121705.76 128211.39 1347.10 o
9 3 1 17584.08 17150.85 598.13 o
11 3 1 8093.42 9070.84 496.71 o
13 3 1 2616.08 2408.14 387.49 o
15 3 1 11683.97 12324.17 556.52 o
17 3 1 11803.85 13247.37 595.53 o
19 3 1 20848.84 19637.01 728.16 o
21 3 1 17570.72 15603.50 715.16 o
23 3 1 14514.11 14864.94 699.56 o
25 3 1 4114.77 4296.16 587.73 o
27 3 1 15198.88 13694.67 756.77 o
29 3 1 582.06 1022.03 551.32 o
31 3 1 27060.74 27948.47 1037.63 o
33 3 1 17662.02 18393.93 892.00 o
35 3 1 11217.80 11325.54 821.78 o
37 3 1 790.20 834.79 579.93 o
39 3 1 3525.82 3565.40 642.34 o
41 3 1 14.55 54.61 572.13 o
43 3 1 5397.92 6582.08 748.97 o
45 3 1 14509.15 13450.22 970.02 o
-44 4 1 524.04 585.13 566.93 o
-42 4 1 12.57 -98.82 600.73 o
-40 4 1 103.62 397.89 572.13 o
-38 4 1 6506.87 6215.40 751.57 o
-36 4 1 14241.08 13374.80 858.19 o
-34 4 1 1030.99 842.59 566.93 o
-32 4 1 21.91 109.22 512.32 o
-30 4 1 769.62 886.80 514.92 o
-28 4 1 3896.54 3341.75 624.14 o
-26 4 1 4991.33 4023.10 626.74 o
-24 4 1 3693.25 3414.57 585.13 o
-22 4 1 5268.22 5060.74 590.33 o
-20 4 1 1036.34 704.76 473.31 o
-18 4 1 1602.23 912.80 478.51 o
-16 4 1 7950.15 8462.30 598.13 o
-14 4 1 58.28 -171.64 408.29 o
-12 4 1 2886.77 2941.26 449.90 o
-10 4 1 190.46 -44.21 382.29 o
-8 4 1 220.53 397.89 377.08 o
-6 4 1 18221.15 17546.14 668.35 o
-4 4 1 12487.15 12698.65 587.73 o
-2 4 1 27809.62 29235.76 782.78 o
0 4 1 2625.32 2318.53 301.16 o
2 4 1 4427.54 4548.42 447.30 o
4 4 1 1639.16 1700.78 410.89 o
6 4 1 16953.83 16625.53 702.16 o
8 4 1 23845.14 23587.29 764.57 o
10 4 1 3071.93 3076.49 455.10 o
12 4 1 4.30 114.43 434.30 o
14 4 1 6748.30 6946.16 585.13 o
16 4 1 1044.51 923.21 452.50 o
18 4 1 147.94 488.91 439.50 o
20 4 1 1212.13 1752.79 488.91 o
22 4 1 953.76 1061.04 564.33 o
24 4 1 822.28 1414.72 556.52 o
26 4 1 3158.52 2881.45 598.13 o
28 4 1 14280.43 13359.20 808.78 o
30 4 1 788.91 491.51 561.73 o
32 4 1 4536.54 4441.80 660.55 o
34 4 1 645.14 603.34 587.73 o
36 4 1 1051.18 970.02 603.34 o
38 4 1 927.87 1352.30 655.35 o
40 4 1 1146.88 670.95 665.75 o
42 4 1 3236.51 2821.63 691.76 o
-39 5 1 8849.50 8891.40 834.79 o
-37 5 1 3242.64 3620.01 751.57 o
-35 5 1 797.23 858.19 598.13 o
-33 5 1 639.15 605.94 629.34 o
-31 5 1 21136.62 20690.24 1016.83 o
-29 5 1 6964.38 7481.88 702.16 o
-27 5 1 5476.69 5188.17 670.95 o
-25 5 1 618.57 1165.06 535.72 o
-23 5 1 2270.10 1794.40 525.32 o
-21 5 1 6646.01 6358.43 665.75 o
-19 5 1 17721.95 17442.12 826.99 o
-17 5 1 722.09 670.95 530.52 o
-15 5 1 4491.23 4007.50 595.53 o
-13 5 1 760.17 704.76 533.12 o
-11 5 1 6907.99 5469.03 650.15 o
-9 5 1 9006.80 8589.73 637.14 o
-7 5 1 21449.37 22492.45 845.19 o
-5 5 1 7023.52 4727.86 577.33 o
-3 5 1 29.95 75.42 478.51 o
-1 5 1 26993.53 27059.08 938.81 o
1 5 1 5279.95 4803.28 551.32 o
3 5 1 2720.69 3391.16 553.92 o
5 5 1 1414.17 1786.60 478.51 o
7 5 1 8857.53 9450.52 691.76 o
9 5 1 18556.39 18237.89 798.38 o
11 5 1 20272.44 21600.45 886.80 o
13 5 1 37.80 -98.82 520.12 o
15 5 1 6477.86 5456.02 670.95 o
17 5 1 1645.24 1081.84 561.73 o
19 5 1 25903.10 24242.64 1003.83 o
21 5 1 18651.97 19426.36 912.80 o
23 5 1 15584.05 17941.43 889.40 o
25 5 1 125.42 -117.03 566.93 o
27 5 1 97.77 -85.82 475.91 o
29 5 1 5016.94 3695.43 668.35 o
31 5 1 28716.60 29979.53 1180.67 o
33 5 1 2476.86 3495.18 702.16 o
35 5 1 5727.23 4147.93 772.37 o
37 5 1 19.67 23.41 598.13 o
-32 6 1 956.22 465.50 652.75 o
-30 6 1 227.68 -78.02 600.73 o
-28 6 1 2621.16 2171.49 691.76 o
-26 6 1 955.19 1040.23 639.74 o
-24 6 1 871.69 -15.60 564.33 o
-22 6 1 1335.99 1035.03 618.94 o
-20 6 1 159.07 -132.63 561.73 o
-18 6 1 2229.44 1448.53 621.54 o
-16 6 1 1.85 -288.66 504.51 o
-14 6 1 2730.62 2525.17 618.94 o
-12 6 1 10795.67 11060.28 782.78 o
-10 6 1 1027.21 1237.88 569.53 o
-8 6 1 346.26 -52.01 512.32 o
-6 6 1 2366.71 1765.80 574.73 o
-4 6 1 16521.31 16555.32 871.20 o
-2 6 1 382.52 460.30 564.33 o
0 6 1 1639.91 1683.79 386.11 o
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