Dear,
I'm trying to use Burai 1.3 and quantum Vitas to create Quantum Espresso input from a crystal CIF file. However, when I opened the file (attached), I couldn't recognize the molecules, only atoms randomly scattered in the cell unity. On the other hand, it was normal in VESTA.
Is there a problem working with this CIF file without rearranging the atoms? If yes, how can I do that?
Thank you for your help and time!