Hydrate - tetrahydrofuran Jones C Y, Marshall S L, Chakoumakos B C, Rawn C J, Ishii Y Journal of Physical Chemistry B107 (2003) 6026-6031 Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: cell T = 7 K, positions T = 5 K, guest molecule Note: occupancies of C11 and H14 switched to reproduce reported formula _database_code_amcsd 0013160 17.103 17.103 17.103 90 90 90 *Fd3m .125 .125 .125 atom x y z occ C11 .4315 .375 .4036 1/12 C12 .3681 .375 .4379 1/12 H13 .4814 .4348 .4289 1/12 H14 .4814 .3210 .4289 1/6 H15 .3633 .3686 .4949 1/12 H16 .3681 .4393 .4379 1/12 O10 .4198 .375 .3302 1/12