data_global _amcsd_formula_title 'O49 W18' loop_ _publ_author_name 'Lamire M' 'Labbe P' 'Goreaud M' 'Raveau B' _journal_name_full 'Revue de Chimie Minerale' _journal_volume 24 _journal_year 1987 _journal_page_first 369 _journal_page_last 381 _publ_section_title ; Refinement et nouvelle analyse de la structure de W18 O49 _cod_database_code 1001678 ; _database_code_amcsd 0015402 _chemical_formula_sum 'W18 O49' _cell_length_a 18.31819 _cell_length_b 3.7828 _cell_length_c 14.0280 _cell_angle_alpha 90 _cell_angle_beta 115.2110 _cell_angle_gamma 90 _cell_volume 879.464 _exptl_crystal_density_diffrn 7.729 _symmetry_space_group_name_H-M 'P 1 2/m 1' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,-y,z' '-x,y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z W1 0.07308 0.50000 0.00189 W2 0.08618 0.50000 0.28606 W3 0.12754 0.50000 0.75940 W4 0.22145 0.50000 0.57287 W5 0.25608 0.50000 0.00971 W6 0.27585 0.50000 0.25143 W7 0.35843 0.50000 0.86371 W8 0.41397 0.50000 0.53803 W9 0.45266 0.50000 0.16795 O1 0.07700 0.00000 0.00400 O2 0.08100 0.00000 0.27700 O3 0.13000 0.00000 0.76800 O4 0.22000 0.00000 0.57900 O5 0.25600 0.00000 0.01100 O6 0.27600 0.00000 0.24600 O7 0.36200 0.00000 0.87500 O8 0.41300 0.00000 0.53800 O9 0.44900 0.00000 0.16500 O10 0.01700 0.50000 0.71100 O11 0.03600 0.50000 0.12100 O12 0.13600 0.50000 0.91000 O13 0.14300 0.50000 0.43100 O14 0.14700 0.50000 0.64100 O15 0.19500 0.50000 0.09700 O16 0.18800 0.50000 0.27800 O17 0.24300 0.50000 0.85900 O18 0.30600 0.50000 0.72500 O19 0.31100 0.50000 0.54400 O20 0.34000 0.50000 0.16500 O21 0.35100 0.50000 0.38500 O22 0.37100 0.50000 0.01600 O23 0.46500 0.50000 0.87900 O24 0.51400 0.50000 0.31000 O25 0.50000 0.50000 0.50000 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 W1 0.00340 0.00220 0.00410 0.00000 0.00250 0.00000 W2 0.00450 0.00140 0.00560 0.00000 0.00340 0.00000 W3 0.00460 0.00850 0.00510 0.00000 0.00350 0.00000 W4 0.00570 0.00280 0.00510 0.00000 0.00340 0.00000 W5 0.00360 0.00160 0.00470 0.00000 0.00250 0.00000 W6 0.00460 0.00760 0.00460 0.00000 0.00290 0.00000 W7 0.00390 0.00290 0.00420 0.00000 0.00260 0.00000 W8 0.00560 0.00280 0.00620 0.00000 0.00370 0.00000 W9 0.00400 0.00320 0.00510 0.00000 0.00250 0.00000