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#$Date: 2022-09-25 20:10:12 +0100 (Sun, 25 Sep 2022) $
#$Revision: 278158 $
#$URL: svn://www.crystallography.net/cod/cif/1/10/03/1100343.cif $
#------------------------------------------------------------------------------
#
# 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_1100343
loop_
_publ_author_name
'Reetz, Manfred T.'
'Niemeyer, Christof M.'
'Harms, Klaus'
_publ_section_title
;
 Heterotopic Host Molecules for Binding Two Different Guests
;
_journal_coden_ASTM              ACIEAY
_journal_issue                   11
_journal_name_full
;
 Angewandte Chemie, International Edition in English
;
_journal_page_first              1474
_journal_page_last               1476
_journal_paper_doi               10.1002/anie.199114741
_journal_volume                  30
_journal_year                    1991
_chemical_formula_sum            'C31 H42 B N O8'
_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_Hall           '-P 2yac'
_space_group_name_H-M_alt        'P 1 2/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.55(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.359(3)
_cell_length_b                   9.994(2)
_cell_length_c                   20.678(4)
_cod_original_sg_symbol_H-M      'P 2/n'
_cod_original_formula_sum        'C31 H42 B1 N1 O8'
_cod_database_code               1100343
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x+1/2,y,-z+1/2
3 -x,-y,-z
4 x+1/2,-y,z+1/2
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?