#------------------------------------------------------------------------------ #$Date: 2015-07-13 05:24:38 +0300 (Mon, 13 Jul 2015) $ #$Revision: 149413 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/77/1527710.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_1527710 loop_ _publ_author_name 'Kvick, A.' 'Joensson, P.G.' 'Liminga, R.' _publ_section_title ; Hydrogen Bond Studies. Neutron Diffraction Study of Hydrazinium Bis(dihydrogenphosphate), N2 H6 (H2 P O4)2 ; _journal_name_full 'Acta Chemica Scandinavica (1-27,1973-42,1988)' _journal_page_first 1087 _journal_page_last 1096 _journal_volume 26 _journal_year 1972 _chemical_formula_sum 'H10 N2 O8 P2' _chemical_name_systematic 'N2 H6 (H2 P O4)2' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 99.678 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 4.4831 _cell_length_b 8.0389 _cell_length_c 10.7014 _cell_volume 380.181 _citation_journal_id_ASTM ACSAA4 _cod_data_source_file Kvick_ACSAA4_1972_965.cif _cod_data_source_block H10N2O8P2 _cod_database_code 1527710 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z 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 _atom_site_occupancy _atom_site_U_iso_or_equiv H4 H+1 0.33419 0.15088 0.51406 1 0.0 O4 O-2 0.26194 0.04436 0.21433 1 0.0 H3 H+1 0.43084 0.07327 0.37525 1 0.0 O3 O-2 -0.27075 0.06801 0.09931 1 0.0 H1 H+1 -0.15353 0.34903 0.29932 1 0.0 N1 N-2 0.49778 0.08209 0.47357 1 0.0 O2 O-2 -0.09985 0.22793 0.29997 1 0.0 H2 H+1 -0.45176 0.05363 0.14077 1 0.0 P1 P+5 0.0028 0.16517 0.17481 1 0.0 H5 H+1 0.71388 0.13384 0.49811 1 0.0 O1 O-2 0.07285 0.30999 0.09601 1 0.0