#------------------------------------------------------------------------------
#$Date: 2016-04-06 16:46:13 +0300 (Wed, 06 Apr 2016) $
#$Revision: 181879 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/60/2106022.hkl $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2106022
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   8.1345
_cell_length_b                   8.1345
_cell_length_c                   8.1345
_exptl_crystal_F_000             424.00
_reflns_d_resolution_high        0.5497
_cod_data_source_file            xk5019Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     'E  Pseudokub. K2SiF6'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            98.50
_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, y, -z'
'x, -y, -z'
'z, x, y'
'z, -x, -y'
'-z, -x, y'
'-z, x, -y'
'y, z, x'
'-y, z, -x'
'y, -z, -x'
'-y, -z, x'
'y, x, -z'
'-y, -x, -z'
'y, -x, z'
'-y, x, z'
'x, z, -y'
'-x, z, y'
'-x, -z, -y'
'x, -z, y'
'z, y, -x'
'z, -y, x'
'-z, y, x'
'-z, -y, -x'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, -z+1/2'
'z, x+1/2, y+1/2'
'z, -x+1/2, -y+1/2'
'-z, -x+1/2, y+1/2'
'-z, x+1/2, -y+1/2'
'y, z+1/2, x+1/2'
'-y, z+1/2, -x+1/2'
'y, -z+1/2, -x+1/2'
'-y, -z+1/2, x+1/2'
'y, x+1/2, -z+1/2'
'-y, -x+1/2, -z+1/2'
'y, -x+1/2, z+1/2'
'-y, x+1/2, z+1/2'
'x, z+1/2, -y+1/2'
'-x, z+1/2, y+1/2'
'-x, -z+1/2, -y+1/2'
'x, -z+1/2, y+1/2'
'z, y+1/2, -x+1/2'
'z, -y+1/2, x+1/2'
'-z, y+1/2, x+1/2'
'-z, -y+1/2, -x+1/2'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'-x+1/2, y, -z+1/2'
'x+1/2, -y, -z+1/2'
'z+1/2, x, y+1/2'
'z+1/2, -x, -y+1/2'
'-z+1/2, -x, y+1/2'
'-z+1/2, x, -y+1/2'
'y+1/2, z, x+1/2'
'-y+1/2, z, -x+1/2'
'y+1/2, -z, -x+1/2'
'-y+1/2, -z, x+1/2'
'y+1/2, x, -z+1/2'
'-y+1/2, -x, -z+1/2'
'y+1/2, -x, z+1/2'
'-y+1/2, x, z+1/2'
'x+1/2, z, -y+1/2'
'-x+1/2, z, y+1/2'
'-x+1/2, -z, -y+1/2'
'x+1/2, -z, y+1/2'
'z+1/2, y, -x+1/2'
'z+1/2, -y, x+1/2'
'-z+1/2, y, x+1/2'
'-z+1/2, -y, -x+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'-x+1/2, y+1/2, -z'
'x+1/2, -y+1/2, -z'
'z+1/2, x+1/2, y'
'z+1/2, -x+1/2, -y'
'-z+1/2, -x+1/2, y'
'-z+1/2, x+1/2, -y'
'y+1/2, z+1/2, x'
'-y+1/2, z+1/2, -x'
'y+1/2, -z+1/2, -x'
'-y+1/2, -z+1/2, x'
'y+1/2, x+1/2, -z'
'-y+1/2, -x+1/2, -z'
'y+1/2, -x+1/2, z'
'-y+1/2, x+1/2, z'
'x+1/2, z+1/2, -y'
'-x+1/2, z+1/2, y'
'-x+1/2, -z+1/2, -y'
'x+1/2, -z+1/2, y'
'z+1/2, y+1/2, -x'
'z+1/2, -y+1/2, x'
'-z+1/2, y+1/2, x'
'-z+1/2, -y+1/2, -x'
'-x, -y, -z'
'x, y, -z'
'x, -y, z'
'-x, y, z'
'-z, -x, -y'
'-z, x, y'
'z, x, -y'
'z, -x, y'
'-y, -z, -x'
'y, -z, x'
'-y, z, x'
'y, z, -x'
'-y, -x, z'
'y, x, z'
'-y, x, -z'
'y, -x, -z'
'-x, -z, y'
'x, -z, -y'
'x, z, y'
'-x, z, -y'
'-z, -y, x'
'-z, y, -x'
'z, -y, -x'
'z, y, x'
'-x, -y+1/2, -z+1/2'
'x, y+1/2, -z+1/2'
'x, -y+1/2, z+1/2'
'-x, y+1/2, z+1/2'
'-z, -x+1/2, -y+1/2'
'-z, x+1/2, y+1/2'
'z, x+1/2, -y+1/2'
'z, -x+1/2, y+1/2'
'-y, -z+1/2, -x+1/2'
'y, -z+1/2, x+1/2'
'-y, z+1/2, x+1/2'
'y, z+1/2, -x+1/2'
'-y, -x+1/2, z+1/2'
'y, x+1/2, z+1/2'
'-y, x+1/2, -z+1/2'
'y, -x+1/2, -z+1/2'
'-x, -z+1/2, y+1/2'
'x, -z+1/2, -y+1/2'
'x, z+1/2, y+1/2'
'-x, z+1/2, -y+1/2'
'-z, -y+1/2, x+1/2'
'-z, y+1/2, -x+1/2'
'z, -y+1/2, -x+1/2'
'z, y+1/2, x+1/2'
'-x+1/2, -y, -z+1/2'
'x+1/2, y, -z+1/2'
'x+1/2, -y, z+1/2'
'-x+1/2, y, z+1/2'
'-z+1/2, -x, -y+1/2'
'-z+1/2, x, y+1/2'
'z+1/2, x, -y+1/2'
'z+1/2, -x, y+1/2'
'-y+1/2, -z, -x+1/2'
'y+1/2, -z, x+1/2'
'-y+1/2, z, x+1/2'
'y+1/2, z, -x+1/2'
'-y+1/2, -x, z+1/2'
'y+1/2, x, z+1/2'
'-y+1/2, x, -z+1/2'
'y+1/2, -x, -z+1/2'
'-x+1/2, -z, y+1/2'
'x+1/2, -z, -y+1/2'
'x+1/2, z, y+1/2'
'-x+1/2, z, -y+1/2'
'-z+1/2, -y, x+1/2'
'-z+1/2, y, -x+1/2'
'z+1/2, -y, -x+1/2'
'z+1/2, y, x+1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, y+1/2, -z'
'x+1/2, -y+1/2, z'
'-x+1/2, y+1/2, z'
'-z+1/2, -x+1/2, -y'
'-z+1/2, x+1/2, y'
'z+1/2, x+1/2, -y'
'z+1/2, -x+1/2, y'
'-y+1/2, -z+1/2, -x'
'y+1/2, -z+1/2, x'
'-y+1/2, z+1/2, x'
'y+1/2, z+1/2, -x'
'-y+1/2, -x+1/2, z'
'y+1/2, x+1/2, z'
'-y+1/2, x+1/2, -z'
'y+1/2, -x+1/2, -z'
'-x+1/2, -z+1/2, y'
'x+1/2, -z+1/2, -y'
'x+1/2, z+1/2, y'
'-x+1/2, z+1/2, -y'
'-z+1/2, -y+1/2, x'
'-z+1/2, y+1/2, -x'
'z+1/2, -y+1/2, -x'
'z+1/2, y+1/2, x'
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
0 0 2 147.31 164.38 1.64 o
1 1 3 672.85 654.52 1.70 o
1 3 3 206.06 250.40 0.85 o
3 3 3 1428.28 1491.51 6.44 o
0 2 4 799.27 793.02 1.93 o
2 2 4 4321.72 4195.93 8.49 o
2 4 4 1008.83 1039.39 2.47 o
4 4 4 9702.98 9433.64 33.88 o
1 1 5 5822.96 5844.10 12.09 o
1 3 5 1626.95 1635.19 2.65 o
3 3 5 248.76 237.40 0.97 o
1 5 5 3758.24 3678.73 8.54 o
3 5 5 1555.60 1572.51 4.08 o
5 5 5 2433.02 2323.59 10.19 o
0 0 6 140.91 166.01 2.12 o
0 2 6 7222.14 7154.65 15.09 o
2 2 6 3762.48 3704.16 7.73 o
0 4 6 6.16 7.51 0.26 o
2 4 6 3806.70 3781.10 6.05 o
4 4 6 92.09 95.35 0.73 o
0 6 6 4442.96 4363.83 15.32 o
2 6 6 712.98 729.30 2.67 o
4 6 6 2650.91 2610.25 7.05 o
6 6 6 173.65 190.05 2.33 o
1 1 7 104.26 116.75 0.72 o
1 3 7 12.50 14.67 0.37 o
3 3 7 178.07 166.88 0.95 o
1 5 7 324.09 330.78 1.06 o
3 5 7 61.23 56.24 0.48 o
5 5 7 374.72 391.26 1.93 o
1 7 7 1.64 3.64 0.41 o
3 7 7 40.64 38.41 0.84 o
5 7 7 17.36 12.06 0.49 o
7 7 7 13.20 8.35 0.91 o
0 0 8 5494.22 5530.55 28.43 o
0 2 8 860.19 848.11 2.86 o
2 2 8 820.41 844.73 2.81 o
0 4 8 3197.41 3234.25 8.67 o
2 4 8 779.02 762.86 1.94 o
4 4 8 1953.98 1968.68 6.04 o
0 6 8 194.31 198.00 1.35 o
2 6 8 904.27 901.55 2.51 o
4 6 8 210.09 206.16 1.08 o
6 6 8 710.21 697.95 3.30 o
0 8 8 828.78 838.84 5.25 o
2 8 8 448.67 432.64 2.49 o
4 8 8 543.33 545.34 2.95 o
6 8 8 153.52 148.01 1.65 o
8 8 8 170.49 183.63 3.84 o
1 1 9 801.68 812.79 3.11 o
1 3 9 319.65 335.76 1.20 o
3 3 9 94.22 94.92 0.96 o
1 5 9 651.43 653.01 1.95 o
3 5 9 320.58 342.57 1.39 o
5 5 9 496.93 464.49 2.65 o
1 7 9 92.36 96.18 0.81 o
3 7 9 27.86 24.61 0.50 o
5 7 9 101.38 115.89 0.96 o
7 7 9 9.21 5.62 0.56 o
1 9 9 165.28 167.40 1.82 o
3 9 9 88.94 102.30 1.35 o
5 9 9 133.24 124.76 1.65 o
7 9 9 32.50 42.15 1.31 o
0 0 10 51.82 52.11 1.53 o
0 2 10 2483.60 2461.06 7.45 o
2 2 10 228.57 230.47 1.52 o
0 4 10 4.17 5.52 0.39 o
2 4 10 1572.33 1573.93 3.94 o
4 4 10 1.99 1.85 0.36 o
0 6 10 1514.23 1482.96 5.34 o
2 6 10 61.60 65.43 0.74 o
4 6 10 990.84 973.06 3.22 o
6 6 10 15.33 18.21 0.74 o
0 8 10 16.18 16.10 0.75 o
2 8 10 458.26 456.58 2.12 o
4 8 10 21.50 22.59 0.59 o
6 8 10 306.07 304.40 2.06 o
0 10 10 519.49 514.21 5.39 o
2 10 10 4.99 5.11 0.61 o
4 10 10 353.79 362.15 4.39 o
1 1 11 126.69 130.13 1.45 o
1 3 11 40.03 39.38 0.58 o
3 3 11 5.51 10.21 0.62 o
1 5 11 133.53 133.47 1.00 o
3 5 11 59.49 54.70 0.74 o
5 5 11 120.33 128.23 1.70 o
1 7 11 12.97 11.56 0.47 o
3 7 11 1.73 2.79 0.36 o
5 7 11 20.87 14.13 0.53 o
7 7 11 0.66 1.41 1.25 o
1 9 11 41.41 42.99 0.83 o
3 9 11 20.68 17.27 0.65 o
0 0 12 681.36 668.69 6.89 o
0 2 12 272.53 265.78 2.09 o
2 2 12 176.54 171.08 1.66 o
0 4 12 451.34 459.69 2.71 o
2 4 12 226.81 229.74 1.42 o
4 4 12 302.36 305.31 2.44 o
0 6 12 94.25 96.91 1.53 o
2 6 12 161.97 156.94 1.28 o
4 6 12 81.43 83.64 1.02 o
6 6 12 125.81 127.04 2.16 o
0 8 12 144.47 147.70 2.11 o
2 8 12 114.56 116.19 1.26 o
1 1 13 29.90 29.67 0.87 o
1 3 13 8.99 11.05 0.43 o
3 3 13 0.93 0.72 0.45 o
1 5 13 35.34 34.67 0.76 o
3 5 13 15.69 18.11 0.60 o
5 5 13 34.55 32.43 2.33 o
1 7 13 3.38 4.13 1.03 o
0 0 14 1.36 2.16 1.05 o
0 2 14 405.79 407.80 2.79 o
2 2 14 22.49 22.70 0.89 o
0 4 14 0.10 -0.05 0.53 o
2 4 14 276.70 284.16 2.09 o