Ba S3 V Ghedira M, Chenavas J, Sayetat F, Marezio M, Massenet O, Mercier J Acta Crystallographica B37 (1981) 1491-1496 Structural aspects of the hexagonal to orthorhombic transition in stoichiometric Ba V S3 _cod_database_code 1008062 _database_code_amcsd 0016004 6.7283 6.7283 5.6263 90 90 120 P6_3/mmc atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Ba1 1/3 2/3 .75 .01006 .01006 .01320 .00503 0 0 V1 0 0 0 .0266 .0266 .0113 .0133 0 0 S1 .16531 .33062 .25 .0105 .0077 .0138 .0038 0 0