$cell vectors 1.0 5.0469976251756830 0.0000000000000000 0.0000000000000000 0.0000000000000000 5.0469976251756830 0.0000000000000000 0.0000000000000000 0.0000000000000000 6.4859969480660746 4 2 2 8 Direct 0.0000000000000000 0.4999999999999996 0.2499999999999996 # Li1 0.4999999999999996 0.0000000000000000 0.7499999999999997 # Li2 0.0000000000000000 0.4999999999999996 0.7499999999999997 # Li3 0.4999999999999996 0.0000000000000000 0.2499999999999996 # Li4 0.0000000000000000 0.0000000000000000 0.5000000000000000 # Ca1 0.4999999999999996 0.4999999999999996 0.0000000000000000 # Ca2 0.0000000000000000 0.0000000000000000 0.0000000000000000 # Si1 0.4999999999999996 0.4999999999999996 0.5000000000000000 # Si2 0.1890000000000000 0.1890000000000000 0.1419999999999998 # O1 0.6889999999999996 0.6889999999999996 0.6419999999999999 # O2 0.1890000000000000 -0.1890000000000000 -0.1419999999999998 # O3 0.6889999999999996 0.3109999999999996 0.3580000000000002 # O4 -0.1890000000000000 -0.1890000000000000 0.1419999999999998 # O5 0.3109999999999996 0.3109999999999996 0.6419999999999999 # O6 -0.1890000000000000 0.1890000000000000 -0.1419999999999998 # O7 0.3109999999999996 0.6889999999999996 0.3580000000000002 # O8