[Cod-bugs] Possible bug in COD database.

Andrius Merkys andrius.merkys at gmail.com
Mon Sep 5 11:36:46 EEST 2022


Dear Rodrigo García Cantera,

The structures you have listed as possibly buggy seem genuine to me. The
original paper [1] is indeed on the structure of pyrrhotite (Re9S10),
but its supplement contains two structures of fluorapatite, hence the
formula of Ca5FO12P3.

[1]
https://onlinelibrary.wiley.com/iucr/doi/10.1107/S0108768110011845?sentby=iucr

Best wishes,
Andrius Merkys

-- 
Andrius Merkys
Vilnius University Institute of Biotechnology, Saulėtekio al. 7
LT-10257 Vilnius, Lithuania

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