$cell vectors 1.0 4.9039976924631548 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.9039976924631548 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.9039976924631548 4 6 Direct 0.2500000000000000 0.2500000000000000 0.2500000000000000 # Ag1 0.2500000000000000 0.7500000000000000 0.7500000000000000 # Ag2 0.7500000000000000 0.7500000000000000 0.2500000000000000 # Ag3 0.7500000000000000 0.2500000000000000 0.7500000000000000 # Ag4 0.5000000000000000 0.0000000000000000 0.0000000000000000 # O1 0.0000000000000000 0.5000000000000000 0.5000000000000000 # O2 0.5000000000000000 0.0000000000000000 0.5000000000000000 # O3 0.5000000000000000 0.5000000000000000 0.0000000000000000 # O4 0.0000000000000000 0.5000000000000000 0.0000000000000000 # O5 0.0000000000000000 0.0000000000000000 0.5000000000000000 # O6