#------------------------------------------------------------------------------
#$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $
#$Revision: 26025 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2014926.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_2014926_Fobs
loop_
_publ_author_name
'Poudeu Poudeu, Pierre F.'
'Ruck, Michael'
_publ_section_title
;
 Ag~3.5~Bi~7.5~S~13~, a new member (<i>N</i>=8) of the homologous
 series [Bi~2~S~3~]~2~&#x00B7;[AgBiS~2~]~(<i>N~{-</i>1)/2}
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              i41
_journal_page_last               i43
_journal_volume                  61
_journal_year                    2005
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 92.900
_cell_angle_gamma                90.000
_cell_length_a                   13.3237
_cell_length_b                   4.0455
_cell_length_c                   21.4836
_exptl_crystal_F_000             1990.00
_reflns_d_resolution_high        0.8113
_[local]_cod_data_source_file    sq1196Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     '  Ag7Bi15S26  in C2/m'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            988.80
_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'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
'-x, -y, -z'
'x, -y, z'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, 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 9093.42 8366.48 725.36 o
4 0 0 52083.02 51575.27 846.89 o
6 0 0 2936.85 3010.73 436.20 o
8 0 0 53309.02 55820.39 643.12 o
10 0 0 7875.08 9005.22 417.76 o
12 0 0 3625.83 3318.77 366.03 o
14 0 0 24148.44 26933.67 667.50 o
16 0 0 412.29 540.18 1055.91 o
1 1 0 36134.35 33507.55 1024.04 o
5 1 0 166.83 829.56 315.31 o
7 1 0 320121.31 320817.59 4275.02 o
9 1 0 393.49 369.99 253.68 o
11 1 0 867.64 1021.63 252.56 o
13 1 0 0.54 -108.91 354.10 o
15 1 0 1831.85 954.61 387.66 o
2 2 0 6080.07 6538.77 591.95 o
4 2 0 28197.03 29036.68 542.42 o
6 2 0 1751.88 1362.01 300.60 o
8 2 0 30138.01 31093.03 725.26 o
10 2 0 4619.12 4514.69 293.49 o
12 2 0 1890.51 2972.68 453.41 o
14 2 0 15542.09 11969.79 626.69 o
3 3 0 61697.79 58155.46 1814.53 o
5 3 0 433.11 432.87 361.40 o
7 3 0 109713.46 107650.41 1390.54 o
9 3 0 250.63 287.27 379.14 o
11 3 0 394.32 862.73 461.31 o
13 3 0 1.47 1728.41 826.04 o
4 4 0 5240.74 5899.36 2144.99 o
6 4 0 590.44 171.39 887.88 o
8 4 0 7047.47 5978.30 928.34 o
-16 0 1 189.24 -546.34 546.34 o
-14 0 1 30254.04 35272.30 690.46 o
-12 0 1 9817.54 9660.78 405.38 o
-10 0 1 4841.56 5063.85 379.66 o
-8 0 1 77559.38 75443.82 728.61 o
-6 0 1 603.69 1226.71 427.31 o
-4 0 1 653798.81 652349.31 9192.65 o
-2 0 1 6046.65 6917.38 767.58 o
2 0 1 3717.01 2996.79 839.25 o
4 0 1 13167.27 14820.49 624.08 o
6 0 1 11703.34 12217.03 465.18 o
8 0 1 26566.26 28857.69 520.81 o
10 0 1 8413.48 9098.81 403.57 o
12 0 1 9743.44 7905.15 413.56 o
16 0 1 2102.78 3024.93 557.06 o
-15 1 1 3603.15 4210.96 654.13 o
-13 1 1 3892.12 4419.38 382.26 o
-11 1 1 507958.50 492483.41 5065.70 o
-9 1 1 2122.82 2982.36 385.11 o
-7 1 1 34185.98 34587.52 410.42 o
-5 1 1 63.91 167.78 296.24 o
-3 1 1 100499.96 105585.41 916.17 o
-1 1 1 18391.30 17643.84 957.27 o
1 1 1 5345.65 4934.51 695.81 o
3 1 1 233362.47 238813.80 1383.75 o
5 1 1 3643.13 4444.43 349.07 o
7 1 1 132703.84 125503.72 883.89 o
9 1 1 1211.94 1238.64 275.88 o
11 1 1 98.57 -249.61 249.61 o
13 1 1 5935.16 7636.62 444.23 o
15 1 1 551.62 554.66 441.62 o
-14 2 1 20177.11 19955.59 492.59 o
-12 2 1 6070.09 5845.70 415.28 o
-10 2 1 2733.59 2648.41 285.69 o
-8 2 1 46055.31 46413.61 540.95 o
-6 2 1 808.58 1290.38 313.08 o
-4 2 1 350562.44 362269.84 5330.80 o
-2 2 1 4032.40 4606.55 504.75 o
0 2 1 1749.63 1714.92 724.00 o
2 2 1 1705.65 1782.74 420.75 o
4 2 1 6030.82 6319.43 331.37 o
6 2 1 7349.86 7717.39 342.53 o
8 2 1 13812.33 14379.16 336.00 o
10 2 1 5628.01 5518.13 423.54 o
12 2 1 6040.94 6847.42 458.15 o
14 2 1 108971.66 116309.87 1299.49 o
-13 3 1 2010.31 1423.23 697.25 o
-11 3 1 210519.41 242852.13 4416.80 o
-9 3 1 1214.52 1458.75 353.46 o
-7 3 1 10774.94 9886.77 402.32 o
-5 3 1 40.20 41.09 428.01 o
-3 3 1 28032.73 28797.19 765.87 o
-1 3 1 4812.44 4800.51 790.56 o
3 3 1 64785.29 63484.23 1353.15 o
5 3 1 947.74 1180.69 366.29 o
7 3 1 50827.39 44926.14 1325.52 o
9 3 1 595.82 387.99 442.94 o
11 3 1 14.84 1189.71 478.38 o
13 3 1 2936.72 3731.39 776.56 o
-8 4 1 12514.53 10884.42 880.92 o
-6 4 1 607.86 -105.24 1277.11 o
-4 4 1 75203.12 93551.12 3210.92 o
4 4 1 534.72 505.76 2215.89 o
6 4 1 2072.25 2353.62 959.08 o
8 4 1 2593.61 2198.05 691.27 o
-16 0 2 169.12 987.23 566.64 o
-14 0 2 8336.71 8456.09 584.42 o
-12 0 2 2674.44 2582.90 568.49 o
-10 0 2 834.04 605.76 362.78 o
-8 0 2 111019.84 106193.80 832.14 o
-6 0 2 3155.52 2966.94 420.94 o
-4 0 2 201612.09 195414.64 1477.06 o
-2 0 2 1283.28 2443.59 681.57 o
4 0 2 6690.21 6920.70 591.69 o
6 0 2 105769.17 104968.70 907.04 o
8 0 2 55798.48 55038.10 649.09 o
12 0 2 12979.57 12574.39 437.69 o
14 0 2 5797.44 7711.57 571.30 o
16 0 2 483.77 1464.20 546.29 o
-15 1 2 54680.80 58260.98 2359.58 o
-13 1 2 3554.93 3682.09 383.59 o
-11 1 2 596.99 552.84 245.43 o
-9 1 2 1657.17 1616.28 267.89 o
-7 1 2 1095.00 796.34 265.78 o
-3 1 2 43495.29 44466.72 674.93 o
-1 1 2 7192.57 6981.40 882.61 o
1 1 2 27388.65 26564.07 981.86 o
5 1 2 20238.25 20138.63 404.80 o
7 1 2 1033.09 1449.73 280.68 o
9 1 2 470.68 369.05 268.94 o
11 1 2 694.04 698.63 241.11 o
13 1 2 11889.82 13271.23 451.63 o
15 1 2 2006.36 2293.69 389.90 o
-14 2 2 5340.26 5116.62 434.89 o
-12 2 2 1742.13 2861.81 401.15 o
-10 2 2 932.76 402.19 254.96 o
-8 2 2 62525.87 62024.39 996.50 o
-6 2 2 1440.10 1134.16 321.22 o
-4 2 2 117162.74 117729.70 975.70 o
-2 2 2 536.23 1175.35 596.86 o
0 2 2 137.43 505.02 826.62 o
2 2 2 29253.93 28663.95 861.16 o
4 2 2 2724.53 3048.37 345.13 o
6 2 2 64037.55 63998.66 710.68 o
8 2 2 33702.65 31798.85 439.33 o
10 2 2 134126.86 126672.40 1090.68 o
12 2 2 7813.62 9369.04 456.19 o
14 2 2 3688.52 4059.35 662.19 o
-13 3 2 1867.73 2387.20 396.50 o
-11 3 2 304.00 169.41 477.58 o
-9 3 2 505.77 843.58 429.63 o
-7 3 2 90.67 116.55 397.61 o
-5 3 2 9276.30 9730.04 517.23 o
-3 3 2 9437.60 9535.25 534.25 o
-1 3 2 3758.20 4352.26 620.22 o
3 3 2 436624.63 427639.09 6285.84 o
5 3 2 6580.89 6335.13 438.15 o
7 3 2 764.48 1433.87 325.44 o
9 3 2 489.78 1081.63 448.79 o
11 3 2 237.83 610.56 468.81 o
-8 4 2 14789.66 13350.33 913.68 o
-6 4 2 269.71 323.06 657.19 o
-4 4 2 29079.07 38812.45 2451.91 o
4 4 2 147.57 413.56 2188.74 o
6 4 2 18354.33 18163.45 1064.23 o
8 4 2 9416.58 9736.45 854.16 o
-16 0 3 3355.99 2918.14 554.95 o
-14 0 3 1928.12 1508.54 554.76 o
-12 0 3 353.87 369.18 334.60 o
-10 0 3 7411.98 7848.94 400.71 o
-8 0 3 727289.50 723397.44 4847.14 o
-6 0 3 20569.66 19525.29 560.94 o
-4 0 3 1261.78 1242.13 536.05 o
-2 0 3 1758.20 1933.03 715.78 o
0 0 3 9712.32 9292.44 2453.12 o
2 0 3 44658.34 42909.82 1239.44 o
4 0 3 37359.41 34628.24 779.67 o
6 0 3 174317.33 176189.69 1471.21 o
8 0 3 49645.06 49179.56 632.13 o
10 0 3 39099.29 38723.25 564.07 o
12 0 3 8704.99 9441.72 633.62 o
14 0 3 906.29 1149.60 614.04 o
16 0 3 9318.67 6741.92 1381.74 o
-15 1 3 12951.10 12842.31 1770.82 o
-13 1 3 979.05 509.16 383.63 o
-11 1 3 1958.19 1658.25 260.43 o
-9 1 3 16298.89 17506.48 339.92 o
-3 1 3 128502.63 133271.50 1210.78 o
-1 1 3 671745.69 683587.25 3836.13 o
1 1 3 55464.65 54937.32 2240.20 o
3 1 3 47525.99 44119.96 652.03 o
5 1 3 32904.67 30729.81 474.96 o
7 1 3 331.24 522.06 277.17 o
9 1 3 13240.13 14221.43 408.54 o
11 1 3 2443.29 2000.79 260.07 o
13 1 3 1041.02 1913.46 395.36 o
15 1 3 17.57 -243.42 392.44 o
-14 2 3 1067.31 783.93 470.51 o
-12 2 3 267.92 607.70 406.79 o
-10 2 3 4177.40 3489.39 265.94 o
-6 2 3 11423.12 11395.81 353.34 o
-4 2 3 1298.93 1730.38 377.37 o
-2 2 3 1860.99 1606.12 505.74 o
0 2 3 3578.59 2876.27 735.50 o
2 2 3 24426.35 25811.35 1313.05 o
4 2 3 20672.56 20295.62 445.03 o
6 2 3 99407.67 98612.26 1291.55 o
8 2 3 28054.53 27085.80 620.66 o
10 2 3 22769.05 20452.29 377.64 o
12 2 3 4725.44 5646.24 422.85 o
14 2 3 690.93 576.83 404.31 o
-11 3 3 1317.12 1480.79 518.39 o
-9 3 3 6936.60 7656.54 460.05 o
-7 3 3 810.71 654.88 343.44 o
-5 3 3 39420.09 40234.59 982.39 o
-3 3 3 41201.52 41630.90 821.28 o
-1 3 3 220399.63 234826.03 5639.77 o
1 3 3 15975.78 16939.78 979.97 o
3 3 3 11664.75 10182.91 530.26 o
5 3 3 8309.17 7690.30 450.88 o
7 3 3 190.30 235.16 302.23 o
9 3 3 4490.86 5840.31 480.40 o
11 3 3 1174.11 1427.69 458.09 o
-8 4 3 121310.73 112903.70 1588.35 o
-6 4 3 2934.93 2398.18 693.15 o
-4 4 3 614.30 449.59 800.69 o
-2 4 3 1270.32 1557.16 2102.72 o
4 4 3 4695.65 5586.81 2405.47 o
6 4 3 24931.84 25390.88 1154.21 o
8 4 3 6608.24 6267.58 731.01 o
-16 0 4 10483.55 6459.58 956.95 o
-14 0 4 18706.24 19750.20 747.03 o
-12 0 4 122511.25 125849.59 1717.79 o
-10 0 4 18640.10 20124.39 472.73 o
-8 0 4 16268.67 15421.50 481.97 o
-6 0 4 50176.67 51715.82 1007.89 o
-4 0 4 5408.41 7544.29 614.79 o
-2 0 4 41315.21 44151.92 1147.77 o
0 0 4 27234.20 29487.47 2395.27 o
2 0 4 7613.24 6302.06 810.10 o
4 0 4 6947.14 6033.41 617.23 o
6 0 4 977716.38 991188.25 2710.60 o
8 0 4 25821.01 25489.86 933.50 o
10 0 4 722.67 753.16 354.91 o
12 0 4 22569.76 20565.54 1053.35 o
14 0 4 66.77 -264.02 546.47 o
-15 1 4 197.21 1274.93 399.81 o
-13 1 4 867.46 1106.51 382.81 o
-11 1 4 1518.93 1970.03 266.56 o
-9 1 4 6043.91 5832.95 299.94 o
-7 1 4 44015.91 46861.61 469.34 o
-5 1 4 210186.39 207431.16 978.01 o
-3 1 4 114847.09 113129.78 1294.82 o
-1 1 4 140758.30 125642.28 4378.67 o
1 1 4 67595.24 69783.60 3774.50 o
3 1 4 9181.94 9040.35 493.57 o
5 1 4 155432.25 149479.83 1938.42 o
7 1 4 1752.84 2118.37 288.54 o
9 1 4 109808.34 110823.31 609.37 o
11 1 4 2056.46 2464.90 271.29 o
15 1 4 885.54 798.94 642.96 o
-14 2 4 12393.29 11589.04 482.77 o
-10 2 4 10888.50 10293.16 323.73 o
-8 2 4 8631.48 7741.81 331.88 o
-6 2 4 25054.31 25517.76 669.71 o
-4 2 4 2455.18 3076.59 410.64 o
-2 2 4 19111.01 20262.84 610.79 o
0 2 4 13360.60 11506.84 682.38 o
2 2 4 3835.51 3039.49 487.09 o
4 2 4 2746.25 1995.00 378.34 o
6 2 4 545844.31 550151.75 3792.05 o
8 2 4 14152.24 13381.74 359.52 o
10 2 4 579.60 583.16 246.13 o
12 2 4 14238.06 16596.98 500.57 o
14 2 4 45.88 -427.16 427.16 o
-11 3 4 454.22 -236.87 434.29 o
-9 3 4 3002.62 3524.58 513.94 o
-7 3 4 16160.16 15486.49 461.06 o
-5 3 4 73221.95 66549.94 1055.09 o
-3 3 4 33361.84 34607.78 797.16 o
-1 3 4 43962.34 44099.50 976.83 o
1 3 4 15986.73 16167.27 930.69 o
3 3 4 3015.80 2911.91 497.04 o
5 3 4 52161.38 50131.55 717.95 o
7 3 4 801.19 654.31 329.92 o
11 3 4 1213.67 864.40 491.75 o
-8 4 4 1820.21 1606.56 808.96 o
-6 4 4 4770.68 5911.57 711.05 o
-4 4 4 495.85 1487.92 1000.39 o
-2 4 4 3138.74 4082.77 894.60 o
4 4 4 184.86 466.78 1598.35 o
6 4 4 138116.30 158359.67 6483.30 o
8 4 4 3089.74 2681.03 713.31 o
-16 0 5 21904.60 16870.44 2048.79 o
-14 0 5 12953.32 14589.38 610.72 o
-12 0 5 29384.71 29719.14 515.63 o
-10 0 5 22286.62 22150.24 504.84 o
-8 0 5 7770.38 7748.73 422.62 o
-6 0 5 180158.39 184668.83 1184.49 o
-4 0 5 190.52 1146.37 498.66 o
-2 0 5 264499.28 256047.69 2237.41 o
0 0 5 9676.70 10908.77 1900.44 o
4 0 5 3101.96 3311.59 531.94 o
6 0 5 8101.70 6990.44 454.75 o
8 0 5 13564.88 15156.59 463.33 o
10 0 5 44.93 679.81 357.01 o
12 0 5 2977.41 1678.42 408.77 o
14 0 5 449.71 490.08 551.08 o
-15 1 5 2787.63 2155.93 418.43 o
-13 1 5 2784.66 4668.62 398.54 o
-11 1 5 7248.87 6021.31 283.01 o
-9 1 5 1248.00 1266.69 279.94 o
-7 1 5 5662.77 5426.69 318.15 o
-5 1 5 899323.88 921818.94 2098.19 o
-3 1 5 62590.95 63552.03 751.10 o
-1 1 5 34.56 772.76 729.18 o
1 1 5 99088.60 99583.31 5211.05 o
3 1 5 371.61 282.85 398.31 o
5 1 5 232008.83 226371.72 1157.92 o
7 1 5 29608.90 31320.47 445.35 o
9 1 5 200928.05 206702.36 1531.28 o
11 1 5 5612.41 5984.71 289.35 o
13 1 5 1595.38 3403.78 492.89 o
15 1 5 1472.80 1865.81 398.21 o
-14 2 5 8268.68 6493.01 668.20 o
-12 2 5 18370.17 21868.16 1246.22 o
-10 2 5 11913.01 10456.53 323.82 o
-8 2 5 4773.42 4224.17 327.82 o
-6 2 5 100639.95 101088.91 741.76 o
-4 2 5 116.71 271.36 313.14 o
-2 2 5 135451.75 136209.89 1604.19 o
0 2 5 7181.29 6693.74 633.85 o
2 2 5 510918.56 508549.63 2967.45 o
4 2 5 2333.12 2602.58 398.08 o
6 2 5 4738.25 4557.63 295.74 o
8 2 5 8461.45 8530.21 322.48 o
10 2 5 100.33 -121.33 254.38 o
12 2 5 1691.18 2382.64 422.21 o
14 2 5 380.36 464.44 402.02 o
-11 3 5 3163.61 2912.53 483.97 o
-9 3 5 383.06 109.02 515.32 o
-7 3 5 1367.70 1239.50 342.38 o
-5 3 5 305426.94 307125.13 6341.40 o
-3 3 5 16646.21 16351.91 617.79 o
-1 3 5 11.27 465.89 502.78 o
1 3 5 31994.22 31237.82 1501.22 o
3 3 5 288.43 379.25 421.48 o
5 3 5 80177.91 77078.21 1199.77 o
7 3 5 13674.90 12850.28 380.10 o
11 3 5 2321.06 2786.47 452.82 o
-8 4 5 1533.44 914.16 800.49 o
-6 4 5 24411.97 26114.43 883.76 o
-4 4 5 36.41 -603.11 770.14 o
-2 4 5 30340.49 38309.14 1245.65 o
0 4 5 2856.76 3041.43 1137.87 o
4 4 5 1047.96 1024.23 1052.92 o
6 4 5 1387.04 1634.73 691.45 o
8 4 5 2603.22 2329.24 630.27 o
-16 0 6 73061.40 61994.59 1942.82 o
-14 0 6 4937.57 4780.63 568.98 o
-12 0 6 711.25 301.83 359.13 o
-10 0 6 29701.77 30685.96 534.65 o
-8 0 6 2934.14 3057.20 418.00 o
-6 0 6 189737.98 181043.98 1203.56 o
-4 0 6 68347.35 70565.11 994.93 o
0 0 6 42813.57 43822.79 1994.77 o
4 0 6 26361.22 26730.50 689.37 o
6 0 6 2955.79 3237.18 455.57 o
8 0 6 11128.11 11737.42 678.50 o
10 0 6 2032.66 1882.57 374.29 o
12 0 6 21047.21 21128.77 1987.99 o
14 0 6 3214.19 1926.54 594.30 o
-15 1 6 50.58 257.99 393.09 o
-13 1 6 22595.44 26812.92 852.34 o
-11 1 6 6192.64 6084.54 290.02 o
-9 1 6 307709.41 308238.03 1513.29 o
-7 1 6 1206.80 1450.12 299.14 o
-5 1 6 15864.64 16063.44 429.33 o
-3 1 6 15419.93 14528.64 516.86 o
-1 1 6 2128.12 2859.08 744.12 o
1 1 6 10970.40 9853.52 759.38 o
3 1 6 12665.39 11038.62 453.63 o
5 1 6 78264.71 81047.89 652.76 o
7 1 6 14648.42 13952.31 355.57 o
9 1 6 213054.58 217473.66 3447.98 o
11 1 6 4429.47 4884.56 283.78 o
13 1 6 11722.57 13249.02 467.81 o
15 1 6 11114.86 11220.87 602.01 o
-14 2 6 2966.03 2614.03 479.71 o
-12 2 6 422.42 6.75 400.41 o
-10 2 6 18006.46 15392.21 370.19 o
-8 2 6 1941.18 2380.17 277.60 o
-6 2 6 108295.38 108264.70 729.57 o
-4 2 6 41874.01 43408.21 839.88 o
-2 2 6 325451.34 318376.00 5157.59 o
0 2 6 23821.49 22984.26 1359.07 o
2 2 6 6609.67 5084.25 489.03 o
4 2 6 14138.68 13483.88 477.68 o
6 2 6 1030.34 1271.82 310.82 o
8 2 6 7245.52 7201.42 299.30 o
10 2 6 967.98 926.46 279.11 o
12 2 6 14607.51 15751.30 481.29 o
14 2 6 2199.19 1732.76 446.12 o
-11 3 6 3237.85 3206.80 489.91 o
-7 3 6 839.97 543.39 393.70 o
-5 3 6 6023.10 5511.32 481.79 o
-3 3 6 5394.47 5061.91 513.65 o
-1 3 6 1324.84 1700.97 567.55 o
1 3 6 2834.51 2535.74 619.36 o
3 3 6 6572.52 6545.12 531.09 o
5 3 6 25969.28 24318.82 494.63 o
7 3 6 5881.00 4831.32 346.55 o
11 3 6 1737.40 1251.56 441.16 o
-8 4 6 614.19 495.03 812.63 o
-6 4 6 27724.12 28939.31 901.91 o
-4 4 6 12597.05 17216.81 1074.74 o
0 4 6 5897.85 7563.87 1125.25 o
2 4 6 1800.49 2462.98 1190.37 o
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