$cell vectors 1.0 5.1847975603350243 0.0000000000000000 0.0000000000000000 0.0000000000000000 6.0979971306362835 0.0000000000000000 0.0000000000000000 0.0000000000000000 5.1915975571353430 4 4 Direct 0.2500000000000000 1.0000000000000000 0.2425000000000002 # Tl1 0.2500000000000000 0.4876999999999997 0.7348000000000000 # Tl2 0.7500000000000000 1.0000000000000000 0.7574999999999997 # Tl3 0.7500000000000000 0.4876999999999997 0.2651999999999998 # Tl4 0.2500000000000000 0.5199999999999995 1.2000000000000000 # F1 0.2500000000000000 0.8599999999999999 0.6700000000000002 # F2 0.7500000000000000 0.5199999999999995 -0.2000000000000002 # F3 0.7500000000000000 0.8599999999999999 0.3299999999999997 # F4