#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009721.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_9009721 _chemical_name 'Dumontite' loop_ _publ_author_name 'Piret P' 'Piret-Meunier J' _journal_name_full "Bulletin de Mineralogie" _journal_volume 111 _journal_year 1988 _journal_page_first 439 _journal_page_last 442 _publ_section_title ; Nouvelle determination de la structure cristalline de la dumonite Pb2[(UO2)3O2(PO4)2]*5H2O Locality: Shinkolobwe, Shaba, Zaire ; _chemical_formula_sum 'Pb2 U3 P2 O21' _cell_length_a 8.118 _cell_length_b 16.819 _cell_length_c 6.983 _cell_angle_alpha 90 _cell_angle_beta 109.03 _cell_angle_gamma 90 _cell_volume 901.328 _symmetry_space_group_name_H-M 'P 1 21/m 1' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'x,1/2-y,z' '-x,1/2+y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_Uiso_or_equiv Pb -0.05070 0.10520 0.36230 0.01820 U1 0.40060 0.25000 0.70180 0.00810 U2 0.41460 0.14170 0.20680 0.00580 P 0.38380 0.05530 0.69120 0.01090 O1 0.17000 0.25000 0.58800 0.01600 O2 0.63400 0.25000 0.81800 0.01700 O3 0.18200 0.12900 0.14200 0.01000 O4 0.65100 0.15100 0.26800 0.01600 O5 0.41600 0.11500 0.55000 0.01700 O6 0.37900 0.11200 0.86300 0.01700 O7 0.53500 -0.00500 0.77600 0.00900 O8 0.20900 0.01600 0.59900 0.02000 O9 0.38100 0.25000 0.01600 0.00600 O10 0.41000 0.25000 0.38600 0.01600 O11 -0.08600 0.16100 0.71100 0.04900 O12 -0.14200 0.05600 -0.00400 0.03900 O13 -0.08500 0.25000 0.16300 0.01200