#------------------------------------------------------------------------------
#$Date: 2022-03-18 04:53:20 +0200 (Fri, 18 Mar 2022) $
#$Revision: 273773 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/89/2108945.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_2108945
_cell_angle_alpha                93.744(26)
_cell_angle_beta                 92.189(21)
_cell_angle_gamma                100.918(19)
_cell_length_a                   3.7718(11)
_cell_length_b                   6.4792(18)
_cell_length_c                   15.7740(49)
_cod_data_source_file            ra5106DCQsup3.hkl
_cod_data_source_block           DCQ
_shelx_f_squared_multiplier      1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-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 0 1 1.32 1.32 7.14 o
0 0 2 0.28 0.29 1.07 o
0 1 0 6.74 6.85 21.97 o
0 -1 1 0.65 0.65 1.58 o
0 1 1 5.24 5.28 16.34 o
0 0 3 0.52 0.52 1.65 o
0 -1 2 0.23 0.23 0.22 o
0 1 2 5.76 5.71 11.26 o
0 -1 3 0.08 0.08 0.11 o
0 0 4 1.70 1.71 5.12 o
0 1 3 10.70 10.75 16.41 o
1 0 0 2.83 2.86 1.83 o
1 0 -1 13.99 14.00 28.76 o
1 0 1 7.60 7.55 12.50 o
1 -1 0 0.30 0.29 0.39 o
0 -1 4 3.96 3.96 8.46 o
1 -1 -1 0.05 0.05 0.17 o
1 0 -2 28.71 28.71 107.40 o
1 -1 1 1.79 1.79 6.58 o
1 0 2 3.82 3.86 14.02 o
0 1 4 1.73 1.75 1.87 o
1 -1 -2 74.47 74.62 317.74 o
1 -1 2 0.01 0.01 0.01 o
0 2 0 7.18 7.05 19.11 o
0 -2 1 6.18 6.02 28.24 o
0 0 5 0.00 0.00 0.01 o
1 0 -3 1.75 1.78 9.02 o
0 2 1 0.32 0.32 1.41 o
0 -2 2 0.37 0.37 1.16 o
1 1 0 3.69 3.69 9.30 o
1 0 3 0.80 0.80 1.87 o
1 1 -1 0.01 0.01 0.01 o
1 -1 -3 0.39 0.38 0.39 o
0 -1 5 0.64 0.64 1.47 o
1 -1 3 0.01 0.01 0.01 o
0 2 2 0.57 0.58 0.77 o
1 1 1 0.01 0.01 0.01 o
1 1 -2 3.97 4.01 5.75 o
0 -2 3 0.89 0.89 0.78 o
1 0 -4 0.02 0.02 0.02 o
0 1 5 2.89 2.90 2.84 o
1 1 2 0.04 0.04 0.04 o
1 -2 0 0.73 0.73 0.57 o
1 1 -3 3.90 3.92 4.93 o
1 -2 1 0.15 0.15 0.14 o
0 2 3 0.80 0.81 0.82 o
1 0 4 2.27 2.28 2.74 o
1 -2 -1 0.18 0.18 0.18 o
1 -1 -4 0.02 0.02 0.03 o
0 0 6 0.02 0.02 0.03 o
1 -1 4 0.51 0.52 0.33 o