#------------------------------------------------------------------------------
#$Date: 2016-04-03 06:34:30 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181255 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/33/2233312.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_2233312_Fobs
loop_
_publ_author_name
'Oshchapovsky, Igor'
'Zelinska, Oksana'
'Rozdzynska-Kielbik, Beata'
'Pavlyuk, Volodymyr'
_publ_section_title
;
 Redetermination of LaZn~5~ based on single crystal X-ray diffraction data
;
_journal_coeditor_code           WM2565
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i1
_journal_volume                  68
_journal_year                    2012
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   5.4654
_cell_length_b                   5.4654
_cell_length_c                   4.2574
_exptl_crystal_F_000             206.91
_reflns_d_resolution_high        0.7688
_cod_data_source_file            wm2565Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' lazn5 in P-3m1                New: P6/mmm'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            154.00
_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, x, z'
'-y, x-y, z'
'-x, -y, z'
'-x+y, -x, z'
'y, -x+y, z'
'-y, -x, -z'
'x-y, -y, -z'
'x, x-y, -z'
'y, x, -z'
'-x+y, y, -z'
'-x, -x+y, -z'
'-x, -y, -z'
'-x+y, -x, -z'
'y, -x+y, -z'
'x, y, -z'
'x-y, x, -z'
'-y, x-y, -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
0 1 0 19.02 24.91 2.43 o
-1 2 0 4705.35 4500.90 113.75 o
0 2 0 7867.92 8385.38 221.66 o
-1 3 0 4.50 4.63 2.47 o
0 3 0 2956.26 3123.99 79.78 o
-2 4 0 12741.35 12616.11 301.23 o
-1 4 0 1.66 3.15 2.82 o
0 4 0 3211.57 3338.54 103.47 o
-2 5 0 7.17 4.03 3.71 o
-1 5 0 1353.29 1340.08 39.95 o
0 5 0 19.46 9.96 9.76 o
-3 6 0 909.67 905.06 44.91 o
-2 6 0 1675.91 1660.32 49.32 o
-1 6 0 3.56 5.97 7.50 o
0 6 0 3199.97 2970.51 142.97 o
-3 7 0 17.26 39.58 14.80 o
0 0 1 512.25 568.54 21.47 o
0 1 1 2183.21 2138.47 37.37 o
-1 2 1 12402.74 12665.94 219.36 o
0 2 1 2176.35 2161.18 37.68 o
-1 3 1 1293.08 1304.19 20.07 o
0 3 1 7240.53 7323.65 123.97 o
-2 4 1 231.81 252.91 9.82 o
-1 4 1 977.17 986.68 17.84 o
0 4 1 672.06 639.25 18.28 o
-2 5 1 622.09 647.62 14.36 o
-1 5 1 3491.11 3386.56 62.97 o
0 5 1 443.43 447.03 19.10 o
-3 6 1 2685.52 2772.69 76.78 o
-2 6 1 240.11 256.84 10.46 o
-1 6 1 462.83 480.74 19.61 o
0 6 1 112.70 88.87 15.88 o
0 0 2 23715.16 23419.78 982.72 o
0 1 2 10.96 10.90 2.79 o
-1 2 2 3121.29 3006.99 53.84 o
0 2 2 5353.91 5308.23 105.17 o
-1 3 2 1.00 -0.15 1.99 o
0 3 2 2194.91 2118.66 43.41 o
-2 4 2 9516.71 9398.19 224.74 o
-1 4 2 0.14 -0.60 2.94 o
0 4 2 2502.32 2427.76 98.66 o
-2 5 2 9.34 6.36 4.00 o
-1 5 2 1089.08 1143.64 27.81 o
0 5 2 19.61 18.39 8.10 o
-3 6 2 747.64 785.66 31.78 o
-2 6 2 1371.34 1348.95 42.76 o
-1 6 2 4.21 -1.37 7.10 o
0 0 3 240.51 252.21 19.35 o
0 1 3 1049.53 1061.88 19.79 o
-1 2 3 6193.69 6126.66 122.84 o
0 2 3 985.02 993.08 26.30 o
-1 3 3 769.03 750.51 15.90 o
0 3 3 4128.87 3979.90 118.63 o
-2 4 3 166.91 152.66 12.46 o
-1 4 3 631.33 634.81 18.39 o
0 4 3 348.98 377.07 21.82 o
-2 5 3 423.75 419.33 16.33 o
-1 5 3 2258.85 2234.89 64.16 o
0 5 3 311.60 280.27 18.66 o
0 0 4 9120.35 8458.49 545.42 o
0 1 4 0.16 4.10 5.38 o
-1 2 4 1398.78 1443.88 41.31 o
0 2 4 2393.22 2414.38 79.97 o
-1 3 4 2.14 3.99 3.83 o
0 3 4 1100.48 1114.55 44.27 o
-2 4 4 4686.22 4539.04 156.82 o
-1 4 4 2.23 21.57 7.73 o
0 4 4 1337.85 1399.03 64.92 o
0 0 5 127.67 131.79 48.31 o
0 1 5 456.02 476.42 36.67 o
-1 2 5 2430.24 2554.53 114.75 o
0 2 5 290.74 302.42 25.69 o
-1 3 5 362.27 414.05 43.93 o