#------------------------------------------------------------------------------ #$Date: 2013-03-29 12:50:04 +0200 (Fri, 29 Mar 2013) $ #$Revision: 77877 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/78/9007843.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9007843 loop_ _publ_author_name 'Greenberg, B. L.' 'Loiacono, G. M.' _publ_section_title ; Structure of Li4Ge5O12-a new compound in the Li2O-GeO2 system ; _journal_name_full 'Acta Crystallographica, Section C' _journal_page_first 2021 _journal_page_last 2026 _journal_volume 46 _journal_year 1990 _chemical_formula_structural Li4Ge5O12 _chemical_formula_sum 'Ge5 Li4 O12' _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 72.95 _cell_angle_beta 77.74 _cell_angle_gamma 78.81 _cell_length_a 5.120 _cell_length_b 9.143 _cell_length_c 9.586 _cell_volume 415.042 _exptl_crystal_density_diffrn 4.663 _[local]_cod_chemical_formula_sum_orig 'Ge5 O12 Li4' _cod_database_code 9007843 _amcsd_database_code AMCSD#0009932 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Ge1 0.18900 0.25390 0.93530 0.01300 Ge2 0.19070 0.09980 0.68220 0.01300 Ge3 0.40920 0.42060 0.64520 0.01300 Ge4 0.26140 0.09690 0.26830 0.01300 Ge5 0.11790 0.59430 0.85110 0.01300 O1 0.26740 0.56650 0.48430 0.01700 O2 0.31910 0.26310 0.56890 0.01700 O3 0.44310 0.57910 0.73040 0.01800 O4 0.05430 0.43090 0.77570 0.01500 O5 -0.05110 0.73950 0.69940 0.01600 O6 0.51200 0.27040 0.81020 0.01700 O7 0.23080 0.42320 0.01260 0.01600 O8 0.14750 0.73220 0.95090 0.01500 O9 0.43720 -0.06180 0.66130 0.01500 O10 0.10250 0.10150 0.86640 0.01600 O11 0.34580 0.10080 0.08160 0.01700 O12 -0.09260 0.06390 0.62860 0.01600 Li1 0.64860 0.42340 0.88950 0.02400 Li2 0.14280 0.40710 0.40360 0.02700 Li3 -0.27480 0.09680 0.97650 0.02200 Li4 0.31070 0.77080 0.55570 0.03000