#------------------------------------------------------------------------------ #$Date: 2014-07-12 07:06:18 +0300 (Sat, 12 Jul 2014) $ #$Revision: 120112 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/20/00/7200012.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_7200012 loop_ _publ_author_name 'Noh, Tae Hwan' 'Choi, Youn Jung' 'Ryu, Yoon Kyong' 'Lee, Young-A' 'Jung, Ok-Sang' _publ_section_title ; 2-Fold interpenetration via ligand-induced alternating perpendicular helical channel motifs. Structure of an acentric diamondoid silver(I) coordination polymer ; _journal_issue 11 _journal_name_full CrystEngComm _journal_page_first 2371 _journal_volume 11 _journal_year 2009 _space_group_IT_number 14 _symmetry_cell_setting monoclinic _symmetry_Int_Tables_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90.000000 _cell_angle_beta 102.139679 _cell_angle_gamma 90.000000 _cell_length_a 7.899789 _cell_length_b 11.114385 _cell_length_c 13.858608 _cell_volume 1189.593 _[local]_cod_data_source_file 23HTP_racemic.cif _[local]_cod_data_source_block 23HTP_R_3 _[local]_cod_cif_authors_sg_H-M 'P 2_1/c' _cod_database_code 7200012 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 x,y,z 2 -x,y+1/2,-z+1/2 3 -x,-y,-z 4 x,-y+1/2,z+1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z C1 C 0.661257 0.200152 0.881028 C2 C 0.753520 0.177890 0.795911 C3 C 0.899314 0.272610 0.812398 N4 N 0.807660 0.374073 0.849075 C5 C 0.655024 0.338116 0.890851 O6 O 0.861930 0.483694 0.848309 C7 C 1.054126 0.230962 0.892111 C8 C 1.133763 0.121458 0.878492 H9 H 1.090510 0.069038 0.811526 C10 C 1.270754 0.079684 0.951056 H11 H 1.331112 -0.006176 0.940846 C12 C 1.332133 0.145746 1.036577 H13 H 1.438353 0.112861 1.093639 C14 C 1.256299 0.256836 1.049282 O15 O 1.322162 0.320789 1.132447 C16 C 1.116742 0.298799 0.976926 H17 H 1.058793 0.385143 0.987974 C18 C 0.959300 0.308767 0.718691 C19 C 0.679227 0.381801 0.997510 C20 C 0.489155 0.390872 0.826970 H21 H 0.530969 0.161570 0.867454 H22 H 0.736816 0.160916 0.949358 H23 H 0.803990 0.086240 0.795713 H24 H 0.665264 0.193914 0.724542 H25 H 1.255427 0.397340 1.135045 H26 H 1.054088 0.381895 0.733676 H27 H 1.021652 0.231815 0.691250 H28 H 0.849269 0.337735 0.661228 H29 H 0.800253 0.347741 1.042858 H30 H 0.680905 0.480265 1.001433 H31 H 0.571211 0.349690 1.028906 H32 H 0.498109 0.488947 0.821746 H33 H 0.462560 0.351732 0.752820 H34 H 0.379421 0.369139 0.860975 _journal_paper_doi 10.1039/b905296h