[Cod-bugs] COD 6000019 and 6000020 lack atomic coordinates

Norwid Behrnd nbehrnd at yahoo.com
Wed Jun 5 11:30:07 EEST 2024


Dear curators of the COD,

I would like to draw your attention to COD records 6000019 and 6000020 revised
in 2016; both .cif files (cf. attached downloads) lack the block about the
atomic coordinates.

http://www.crystallography.net/cod/6000019.html
http://www.crystallography.net/cod/6000020.html

Thankfully the records provided by the database equally link to the primary
publication.  With their DOI (https://doi.org/10.1016/S0925-8388(96)02992-1) in
hand, it was possible to consult the joint CCDC/ISCD «preview» page[1] for a
query based by this identifier; here, the two records (ICSD 83956, ICSD 83957)
provide this information (cf. screen photo).

With best regards,

Norwid Behrnd

[1]
https://www.ccdc.cam.ac.uk/structures/Search?Doi=10.1016%2FS0925-8388(96)02992-1&DatabaseToSearch=Published

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