#------------------------------------------------------------------------------ #$Date: 2011-09-28 15:24:46 +0100 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: svn://www.crystallography.net/cod/cif/2/30/00/2300034.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_2300034 _journal_name_full 'Journal of Applied Crystallography' _journal_year 2003 _journal_volume 36 _journal_page_first 1361 _journal_page_last 1367 _chemical_formula_sum "Fe2 O7 P2" _chemical_formula_weight 285.64 _symmetry_cell_setting triclinic _symmetry_space_group_name_H-M "C -1" loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 +x,+y,+z -1 -x,-y,-z 101 +x+1/2,+y+1/2,+z -101 -x+1/2,-y+1/2,-z _cell_length_a 6.643(3) _cell_length_b 8.447(5) _cell_length_c 4.495(3) _cell_angle_alpha 90.43(4) _cell_angle_beta 103.80(4) _cell_angle_gamma 92.49(6) _cell_volume 244.66275 _cell_formula_units_Z 2 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_thermal_displace_type _atom_site_occupancy _atom_site_type_symbol FE1 0.0096 0.3101 0.483 0.015 Uiso 1.0 FE P2 0.7884 -0.0006 0.0899 0.015 Uiso 1.0 P O3 0.0 0.0 0.0 0.015 Uiso 1.0 O O4 0.3748 0.0047 0.2148 0.015 Uiso 1.0 O O5 0.7892 0.1487 0.2741 0.015 Uiso 1.0 O O6 0.2745 0.3527 0.2782 0.015 Uiso 1.0 O _cod_database_code 2300034