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| Éó¸åÈ˵ÄÕâ¸öÒâ¼ûÔõô»Ø´ðѽ¡°The two structures have been correctly refined, however I have a doubt about the position of the H atoms of the water molecules. When trying to locate them on a difference Fourier, it appears that the electron density in the vicinity of the O atom is diffused and many residus could be attributed to H atoms. Moreover the ellipsoids of the O atom are rather large suggesting either a partially occupied site or a disordered molecule. These points should be clarified¡±.ºÜ׿±£¬Ð»Ð»ÁË£¡ |
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