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Figure 3
(a) Atomic naming scheme for the antidiarrhetic loperamide hydrochloride (Brüning et al., 2012BB19). H atom labels were omitted for clarity as they carry the name of their parent atoms. (b) Three-dimensional deformation electron density (0.1 e Å−3 isosurface) from fast Fourier transform with MoleCoolQt that helps to validate the assignment of the local atomic coordinate systems on the click of the mouse.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
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