write COORD MOL
should display transformed coordinates in MOL format in the console, and it
does.
zz = write("MOL")
should write untransformed coordinates in MOL format. That's working.
write COORD
should display untransformed coordinates in XYZ format in the console, but
it does not. It writ
Dear Bob,
Some time ago we addressed the issue of writing transformed
coordinates in MOL format, either using write command or write()
function.
I think it was fixed in some 14.1.x version, but right now I am
finding that
zz = write("coord")
zz = write("coord", "t.mol")
are delivering the ori
