#------------------------------------------------------------------------------
#$Date: 2024-04-25 04:59:45 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291350 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/31/24/2312475.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_2312475
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   11.5036
_cell_length_b                   11.5036
_cell_length_c                   11.5036
_exptl_crystal_F_000             752.40
_reflns_d_resolution_high        0.7488
_cod_data_source_file            yp3234Isup2.hkl
_cod_data_source_block           I
_shelx_title                     ' Mg2Ni3Ge_0m_a.res in Fm-3m'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            1567.45
_shelx_f_squared_multiplier      1.000
loop_
_space_group_symop_operation_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
1 1 1 78006.12 80274.64 733.58 o
0 0 2 146586.00 147391.62 1563.04 o
0 2 2 2445.15 4899.58 181.71 o
2 2 2 197057.86 197037.48 1673.79 o
1 1 3 2908.61 3503.18 159.75 o
1 3 3 2656.25 3095.88 142.17 o
3 3 3 620254.06 621200.62 5153.68 o
0 0 4 16951.99 20353.89 575.15 o
0 2 4 3048.12 3897.89 162.30 o
2 2 4 82365.77 83392.38 550.95 o
0 4 4 2456884.25 2401205.00 15116.34 o
2 4 4 12975.83 14093.84 256.38 o
4 4 4 4264.64 4418.29 319.24 o
1 1 5 171061.86 173994.84 1078.38 o
1 3 5 222464.52 221879.73 890.69 o
3 3 5 162338.70 160408.50 965.19 o
1 5 5 21574.07 21818.57 317.39 o
3 5 5 3406.02 3929.67 223.21 o
5 5 5 222332.44 223681.84 2413.78 o
0 0 6 297083.97 299540.94 3452.38 o
0 2 6 161664.73 160160.66 1041.67 o
2 2 6 461376.91 453434.22 2357.43 o
0 4 6 11652.20 12356.05 277.13 o
2 4 6 1746.27 2059.94 132.79 o
4 4 6 1108.59 663.16 185.14 o
0 6 6 288066.69 283475.84 2327.34 o
2 6 6 58973.59 57446.12 575.36 o
4 6 6 74531.30 73500.95 697.88 o
6 6 6 823076.44 820592.31 7211.70 o
1 1 7 39056.26 39953.06 538.89 o
1 3 7 25707.09 27683.49 295.28 o
3 3 7 9671.03 10878.15 298.17 o
1 5 7 23049.66 24150.21 294.94 o
3 5 7 115801.62 116000.53 637.09 o
5 5 7 11667.80 12542.36 372.75 o
1 7 7 32388.70 31672.88 508.80 o
3 7 7 43740.30 46099.60 594.99 o
5 7 7 358.91 188.71 269.74 o
7 7 7 31397.50 33145.95 1231.33 o
0 0 8 699402.12 701671.44 7121.80 o
0 2 8 8726.99 10131.94 313.30 o
2 2 8 84636.07 85185.50 735.37 o
0 4 8 54725.25 54982.54 595.37 o
2 4 8 55367.39 56212.43 435.74 o
4 4 8 738959.31 737661.69 3719.85 o
0 6 8 162460.64 163804.59 1177.23 o
2 6 8 37.42 233.95 152.50 o
4 6 8 17789.09 18596.20 326.46 o
6 6 8 75625.90 73055.65 863.38 o
0 8 8 825485.06 828991.25 6406.17 o
2 8 8 39336.82 40116.83 653.51 o
4 8 8 439.64 333.72 307.02 o
6 8 8 2665.71 2112.69 393.05 o
8 8 8 228364.25 224227.69 3418.88 o
1 1 9 135252.80 135021.61 1014.50 o
1 3 9 120753.16 121189.99 669.46 o
3 3 9 517775.47 519853.97 2846.04 o
1 5 9 20580.94 21534.48 319.21 o
3 5 9 21.10 -96.69 158.42 o
5 5 9 102056.55 100921.32 1052.06 o
1 7 9 73434.34 73904.00 611.62 o
3 7 9 23309.01 24476.10 393.50 o
5 7 9 314.79 448.19 211.06 o
7 7 9 51078.73 51039.71 870.83 o
1 9 9 2434.29 2428.65 362.88 o
3 9 9 41809.05 40726.39 814.15 o
5 9 9 168588.69 165934.72 1570.04 o
7 9 9 1470.05 923.51 454.49 o
0 0 10 7193.39 7897.29 734.82 o
0 2 10 7402.16 7922.06 327.07 o
2 2 10 147546.70 147502.03 1123.87 o
0 4 10 1464.60 1483.22 280.27 o
2 4 10 8344.16 8482.02 265.48 o
4 4 10 17281.05 18403.69 478.65 o
0 6 10 23270.41 24529.65 533.57 o
2 6 10 243301.52 240704.08 1179.15 o
4 6 10 10007.04 9638.12 291.06 o
6 6 10 85664.03 84922.11 1093.71 o
0 8 10 39220.44 39047.43 712.76 o
2 8 10 10431.35 10222.45 325.31 o
4 8 10 31421.98 31264.64 503.26 o
6 8 10 41.95 -307.91 307.91 o
8 8 10 92.92 -487.19 487.19 o
0 10 10 20014.05 19598.19 1016.82 o
2 10 10 118732.70 117613.55 1339.48 o
4 10 10 1725.03 1172.91 446.00 o
6 10 10 158578.02 154756.91 7410.84 o
1 1 11 9299.56 10009.24 397.30 o
1 3 11 65947.91 67099.50 575.63 o
3 3 11 24516.12 25640.31 514.31 o
1 5 11 343.95 144.10 209.28 o
3 5 11 11755.26 12098.11 315.71 o
5 5 11 27892.52 28546.93 594.45 o
1 7 11 29.81 -145.84 246.50 o
3 7 11 50449.87 48573.16 574.31 o
5 7 11 1888.98 1411.36 292.95 o
7 7 11 2455.72 905.29 470.10 o
1 9 11 1828.42 1644.85 324.29 o
3 9 11 4999.24 4121.97 382.99 o
5 9 11 28354.36 28638.19 595.25 o
0 0 12 241857.88 249386.62 3640.86 o
0 2 12 90429.15 91983.60 940.27 o
2 2 12 3809.65 4075.72 363.89 o
0 4 12 303519.28 305990.47 2018.90 o
2 4 12 2.46 -174.92 208.65 o
4 4 12 21534.78 22508.17 618.26 o
0 6 12 121853.56 119694.61 1262.25 o
2 6 12 69377.06 69469.09 637.12 o
4 6 12 69398.35 69042.74 695.40 o
6 6 12 44225.36 42651.65 894.02 o
0 8 12 12028.05 11981.22 629.79 o
2 8 12 2900.05 2393.18 301.88 o
4 8 12 346021.75 347836.44 1933.03 o
1 1 13 22878.55 24314.54 592.73 o
1 3 13 82180.75 83759.92 692.82 o
3 3 13 11199.59 10942.04 426.95 o
1 5 13 31987.51 31930.48 497.60 o
3 5 13 1255.69 546.60 303.29 o
5 5 13 48157.54 48072.69 906.26 o
1 7 13 1682.87 1781.87 318.34 o
3 7 13 55868.70 53466.09 697.72 o
0 0 14 103952.50 109107.57 2463.71 o
0 2 14 4479.96 3858.62 386.46 o
2 2 14 58341.12 61387.26 1056.14 o
0 4 14 67264.03 67159.61 1004.52 o
2 4 14 5535.31 5215.84 341.40 o
4 4 14 33062.10 31741.41 794.68 o
0 6 14 19044.37 19376.92 706.73 o
2 6 14 157000.91 165066.73 6294.59 o
1 1 15 9370.14 9659.92 544.20 o
1 3 15 14621.63 13866.51 490.09 o