#------------------------------------------------------------------------------
#$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $
#$Revision: 26025 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2207685.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_2207685_Fobs
loop_
_publ_author_name
'Demchenko, G.'
'Ko\'nczyk, J.'
'Demchenko, P.'
'Bodak, O.'
'Marciniak, B.'
_publ_section_title
;
 Trierbium nickel trialuminium digermanide, Er~3~NiAl~3~Ge~2~
;
_journal_coeditor_code           WM6111
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i273
_journal_page_last               i274
_journal_volume                  61
_journal_year                    2005
_space_group_IT_number           189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   6.8360
_cell_length_b                   6.8360
_cell_length_c                   4.1480
_exptl_crystal_F_000             335.00
_reflns_d_resolution_high        0.6647
_[local]_cod_data_source_file    wm6111Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' Er3NiAl3Ge2 in P-62m'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            245.99
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x, y, -z'
'-y, x-y, -z'
'-x+y, -x, -z'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'y, x, z'
'x-y, -y, z'
'-x, -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 2 0 10511.89 9722.75 162.51 o
0 2 0 8651.21 8949.48 288.74 o
1 2 0 8990.71 10016.58 607.62 o
2 2 0 6850.86 6128.95 146.33 o
-1 3 0 8984.61 11400.88 222.19 o
0 3 0 18050.80 19403.92 676.00 o
1 3 0 13940.79 13950.43 391.63 o
2 3 0 3013.73 2735.61 59.62 o
3 3 0 5667.31 5650.05 27.52 o
-2 4 0 6817.01 6252.40 182.36 o
-1 4 0 14192.05 14464.00 260.09 o
0 4 0 11.71 54.58 12.55 o
1 4 0 1717.47 2238.47 257.04 o
2 4 0 6558.23 6698.27 236.80 o
3 4 0 1145.15 1171.98 40.20 o
4 4 0 4430.30 4635.50 48.87 o
-2 5 0 2787.38 2651.59 12.36 o
-1 5 0 1545.10 2180.28 253.37 o
0 5 0 13571.93 15492.17 797.01 o
1 5 0 1146.12 1175.22 50.21 o
2 5 0 7837.64 7748.68 122.47 o
3 5 0 735.39 952.73 171.99 o
4 5 0 61.69 82.55 9.45 o
-3 6 0 5669.08 5827.98 146.09 o
-2 6 0 6722.09 6859.18 279.47 o
-1 6 0 1050.64 1075.85 39.06 o
0 6 0 54.02 75.70 12.86 o
1 6 0 3055.14 3083.71 173.99 o
2 6 0 2578.12 2724.36 94.23 o
3 6 0 2528.96 2742.06 23.58 o
4 6 0 564.20 529.14 19.32 o
-3 7 0 1174.31 1199.43 54.60 o
-2 7 0 8185.13 7349.37 42.85 o
-1 7 0 2784.00 2940.04 46.66 o
0 7 0 3177.71 3291.68 131.33 o
1 7 0 1354.38 1243.67 70.57 o
2 7 0 273.63 329.67 43.59 o
-4 8 0 3909.77 3669.03 37.23 o
-3 8 0 778.33 904.46 111.12 o
-2 8 0 2584.58 2653.65 106.74 o
-1 8 0 1309.73 1322.04 51.08 o
0 8 0 507.28 510.26 13.45 o
1 8 0 2766.99 3582.02 232.32 o
-4 9 0 103.54 117.17 7.26 o
-3 9 0 2606.01 2977.86 237.57 o
-2 9 0 271.90 266.31 37.26 o
-1 9 0 2922.83 2916.34 29.49 o
-4 10 0 572.28 508.19 18.41 o
-3 10 0 559.58 602.29 25.77 o
0 0 1 14577.38 14546.29 580.95 o
0 1 1 2.12 45.87 6.00 o
1 1 1 24759.90 25854.55 628.47 o
-1 2 1 25522.52 25566.34 639.45 o
0 2 1 23589.85 22657.27 601.90 o
1 2 1 4325.32 4049.01 137.51 o
2 2 1 1980.69 1844.03 55.19 o
-1 3 1 3693.19 3536.84 107.67 o
0 3 1 1245.93 1371.29 37.83 o
1 3 1 11530.98 11014.11 315.89 o
2 3 1 9517.04 8740.32 164.79 o
3 3 1 3057.12 2919.67 147.25 o
-2 4 1 1878.57 1766.09 34.80 o
-1 4 1 11805.55 12023.19 269.55 o
0 4 1 3.45 28.06 7.17 o
1 4 1 2800.90 2858.78 51.45 o
2 4 1 5267.84 5221.30 106.11 o
3 4 1 1315.12 1304.88 26.66 o
4 4 1 7479.79 7295.45 162.38 o
-2 5 1 9812.26 9402.69 122.10 o
-1 5 1 2851.00 2972.34 79.79 o
0 5 1 14567.81 13822.20 423.93 o
1 5 1 514.72 519.81 14.91 o
2 5 1 2544.51 2516.72 74.61 o
3 5 1 1788.87 1733.72 70.21 o
4 5 1 111.54 144.16 10.42 o
-3 6 1 3006.50 2837.70 85.53 o
-2 6 1 4877.97 5112.73 126.75 o
-1 6 1 598.50 625.91 16.37 o
0 6 1 1552.98 1551.73 50.64 o
1 6 1 2758.28 2769.25 66.32 o
2 6 1 1265.88 1287.44 34.39 o
3 6 1 3120.34 3087.51 145.30 o
4 6 1 378.08 310.83 16.14 o
-3 7 1 1427.68 1443.24 37.47 o
-2 7 1 2383.64 2347.57 33.01 o
-1 7 1 3063.87 3128.29 45.53 o
0 7 1 5881.12 6083.89 73.26 o
1 7 1 904.46 979.61 40.45 o
2 7 1 1280.94 1235.03 75.16 o
-4 8 1 7768.57 7592.85 56.45 o
-3 8 1 1750.54 1746.23 51.61 o
-2 8 1 1098.14 1131.01 27.95 o
-1 8 1 937.54 902.30 62.45 o
0 8 1 607.91 643.35 34.48 o
1 8 1 2392.83 2179.68 232.92 o
-4 9 1 94.19 106.52 13.37 o
-3 9 1 3114.12 3119.45 50.94 o
-2 9 1 1267.25 1282.15 31.89 o
-1 9 1 2349.41 2627.28 167.58 o
-5 10 1 1688.42 1676.20 29.75 o
-4 10 1 342.99 339.00 16.73 o
0 0 2 60510.15 61749.06 2382.54 o
0 1 2 753.40 675.22 8.34 o
1 1 2 6639.03 6547.59 81.69 o
-1 2 2 6914.95 6804.20 164.44 o
0 2 2 5650.54 5359.32 87.08 o
1 2 2 6221.66 6516.85 179.59 o
2 2 2 4752.90 4776.72 57.63 o
-1 3 2 6230.78 6423.89 160.75 o
0 3 2 12298.33 12279.79 97.72 o
1 3 2 10076.09 10306.57 102.13 o
2 3 2 2234.29 2258.66 40.66 o
3 3 2 4373.61 4284.58 77.22 o
-2 4 2 4750.52 4555.12 66.02 o
-1 4 2 10265.07 10214.83 86.90 o
0 4 2 8.97 22.55 2.62 o
1 4 2 1221.41 1657.30 127.09 o
2 4 2 5093.82 5634.60 115.39 o
3 4 2 908.03 886.45 40.04 o
4 4 2 3581.64 3654.36 470.32 o
-2 5 2 2047.38 2190.84 31.74 o
-1 5 2 1087.06 1551.00 167.07 o
0 5 2 10399.32 10661.29 214.85 o
1 5 2 905.36 975.46 25.63 o
2 5 2 6097.29 5823.34 99.15 o
3 5 2 594.47 648.43 45.48 o
4 5 2 49.87 50.36 5.12 o
-3 6 2 4348.96 4164.48 56.91 o
-2 6 2 5233.77 5489.45 79.08 o
-1 6 2 824.79 939.64 20.80 o
0 6 2 30.82 34.54 3.41 o
1 6 2 2459.80 2439.08 145.82 o
2 6 2 2092.35 2048.35 55.96 o
3 6 2 2083.99 2068.79 84.66 o
-3 7 2 932.51 900.54 20.19 o
-2 7 2 6388.64 6244.06 120.93 o
-1 7 2 2230.97 2366.40 50.24 o
0 7 2 2573.83 2823.24 40.33 o
1 7 2 1084.94 1058.29 63.20 o
2 7 2 226.38 267.76 23.88 o
-4 8 2 3158.87 2845.28 340.01 o
-3 8 2 631.07 670.72 40.31 o
-2 8 2 2096.76 2020.82 41.34 o
-1 8 2 1052.94 988.26 54.41 o
0 8 2 418.17 389.40 12.20 o
-4 9 2 85.99 64.24 7.14 o
-3 9 2 2141.07 2179.90 90.49 o
-2 9 2 224.39 156.42 27.54 o
0 0 3 6712.10 5958.49 325.49 o
0 1 3 13.20 52.50 5.85 o
1 1 3 11986.83 12297.12 389.71 o
-1 2 3 12465.53 11792.57 210.45 o
0 2 3 11207.23 11272.78 137.96 o
1 2 3 2144.88 2203.82 28.64 o
2 2 3 1090.59 1117.92 16.87 o
-1 3 3 1766.46 1840.48 28.31 o
0 3 3 656.72 683.58 9.61 o
1 3 3 6535.40 6630.81 71.16 o
2 3 3 5349.87 5331.23 63.39 o
3 3 3 1867.62 2001.73 53.01 o
-2 4 3 1019.74 1070.44 47.15 o
-1 4 3 6663.26 6427.17 124.74 o
0 4 3 1.50 14.49 1.95 o
1 4 3 1642.47 1676.25 30.62 o
2 4 3 3296.23 3295.73 46.88 o
3 4 3 807.07 821.14 23.48 o
4 4 3 4909.18 4178.73 225.45 o
-2 5 3 5558.72 5451.44 64.40 o
-1 5 3 1674.97 1666.10 20.27 o
0 5 3 8648.58 8778.20 241.19 o
1 5 3 326.88 321.28 12.97 o
2 5 3 1688.79 1676.41 37.80 o
3 5 3 1143.05 977.54 99.11 o
4 5 3 72.54 36.27 8.94 o
-3 6 3 1842.97 1894.02 239.17 o
-2 6 3 3051.34 3188.74 105.92 o
-1 6 3 379.63 368.93 11.40 o
0 6 3 966.47 1032.27 44.35 o
1 6 3 1808.56 1807.09 108.71 o
2 6 3 841.37 827.35 23.29 o
-3 7 3 876.32 851.70 13.07 o
-2 7 3 1574.03 1462.58 35.66 o
-1 7 3 2015.93 1888.64 130.38 o
0 7 3 3815.96 3772.92 155.27 o
1 7 3 600.74 557.20 36.37 o
-4 8 3 5105.88 4274.66 289.26 o
-3 8 3 1113.34 974.80 49.26 o
-2 8 3 728.64 700.19 29.34 o
0 0 4 22803.14 23799.27 1115.35 o
0 1 4 320.90 345.10 11.67 o
1 1 4 2779.53 2910.64 70.28 o
-1 2 4 2837.84 2925.21 71.20 o
0 2 4 2294.41 2281.97 46.26 o
1 2 4 2758.61 2822.39 37.24 o
2 2 4 1992.16 2027.63 101.32 o
-1 3 4 2773.36 2573.93 87.54 o
0 3 4 5063.49 4981.18 126.46 o
1 3 4 4729.12 4887.41 82.02 o
2 3 4 1100.30 1097.57 27.27 o
3 3 4 2239.58 2267.28 174.79 o
-2 4 4 2030.62 1956.39 20.52 o
-1 4 4 4832.27 4361.17 190.34 o
0 4 4 4.67 23.56 3.44 o
1 4 4 505.00 595.06 26.24 o
2 4 4 2636.34 2751.42 65.45 o
3 4 4 485.47 453.35 21.60 o
-2 5 4 989.63 974.69 24.38 o
-1 5 4 437.87 465.59 44.36 o
0 5 4 5290.19 5400.96 69.88 o
1 5 4 478.96 482.95 24.65 o
2 5 4 3112.75 3513.60 70.01 o
-3 6 4 2188.24 2060.65 32.78 o
-2 6 4 2719.51 2471.11 153.18 o
-1 6 4 430.25 443.02 24.51 o
0 6 4 5.56 20.88 4.48 o
1 6 4 1352.98 1421.82 92.53 o
-3 7 4 502.28 432.19 36.18 o
-2 7 4 3291.18 3436.59 140.50 o
-1 7 4 1212.13 1327.48 29.01 o
0 0 5 2515.44 2487.23 33.58 o
0 1 5 21.59 23.10 4.55 o
1 1 5 4430.80 4438.43 189.13 o
-1 2 5 4687.98 4649.45 71.06 o
0 2 5 3989.76 3698.36 185.62 o
1 2 5 788.96 853.94 12.77 o
2 2 5 452.10 518.55 41.29 o
-1 3 5 630.35 674.44 34.22 o
0 3 5 291.52 314.89 7.61 o
1 3 5 2762.27 2816.27 119.66 o
2 3 5 2130.59 2279.67 38.14 o
3 3 5 805.89 852.16 33.82 o
-2 4 5 404.87 388.70 28.78 o
-1 4 5 2787.64 2585.79 92.27 o
0 4 5 4.92 12.56 4.15 o
1 4 5 668.55 671.58 39.38 o
2 4 5 1486.96 1432.00 43.02 o
-2 5 5 2241.14 2127.91 59.61 o
-1 5 5 681.39 652.03 24.33 o
0 5 5 3661.87 3368.98 45.49 o
-2 6 5 1374.74 1235.92 32.76 o
0 0 6 7306.41 7548.76 63.76 o
0 1 6 111.29 94.33 6.92 o
1 1 6 1025.52 1169.17 28.83 o
0 2 6 812.86 826.77 28.83 o