I have a problem to build the correct structure of graphene.
I use these parameter
space group of graphene is 191
lattice constant is a=b=2.46A , c=6.71 A
The position of the two atom basis are
C1 (0.000 0.00 0.00)
C2 (0.00 0.577350269 0.00)
but i cannot get the right structure of graphene
Every time it give me this error chosen position is within the specified tolerance (1.0 A) of a symmetry copy of itself.
Best regards
Omar