Figure 9
(a) (ab) maximum entropy map calculated with the common (hk00) structure factors phased with only the host substructure. (b) (ab) projection of the refined guest substructure including all the orientations generated by symmetry. H atoms do not reflect their isotropic temperature factor. (c) Calculated electron density using a Gaussian probability density function based on the atomic temperature factors (at a probability level of 50%). |