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Gadolinium borate fluoride oxide Gd 4 (BO 2 )O 5 F crystallises in space group  Pmmn  (no. 59,  a  = 1574.6(4),  b  = 381.42(7),  c  = 660.88(11) pm, 565 refl., 28 parameters,  R  1  = 0.039,  wR  2  = 0.128, twin refinement) and comprises linear BO 2  −  anions between closely packed [GdO] layers formed by OGd 4  tetrahedra and terminated by oxygen and fluorine atoms. The crystal structure’s relationship with the NiAs type is illustrated. The Raman spectrum recorded on a single crystal of Gd 4 (BO 2 )O 5 F comprises a single peak at 1364 cm −1  assigned to the only Raman-active vibrational mode  ν  s  of the linear triatomic O–B–O units besides very weak peaks at 805 and 2083 cm −1  (presumably the respective  δ  and  ν  as  modes).

Gd 4 (BO 2 )O 5 F – a gadolinium borate fluoride oxide comprising a linear BO 2 moiety