$cell vectors 1.0 6.0803971389178173 0.0000000000000000 0.0000000000000000 0.0000000000000000 6.0803971389178173 0.0000000000000000 0.0000000000000000 0.0000000000000000 8.3987960480137716 4 4 4 16 Direct 0.2253999999999998 0.0000000000000000 0.2500000000000003 # Li1 0.0000000000000000 0.2253999999999998 0.0000000000000000 # Li2 0.7745999999999994 0.0000000000000000 0.7499999999999997 # Li3 0.0000000000000000 0.7746000000000003 0.5000000000000000 # Li4 0.2619000000000000 0.2619000000000000 0.6249999999999999 # Zn1 0.7381000000000002 0.2619000000000000 0.3750000000000002 # Zn2 0.7381000000000002 0.7381000000000002 0.1249999999999999 # Zn3 0.2619000000000000 0.7381000000000002 0.8750000000000002 # Zn4 0.4999999999999996 0.2156000000000000 0.0000000000000000 # Nb1 0.7844000000000001 0.4999999999999996 0.7499999999999997 # Nb2 0.4999999999999996 0.7844000000000001 0.5000000000000000 # Nb3 0.2156000000000000 0.4999999999999996 0.2500000000000003 # Nb4 0.2637000000000000 0.0186000000000001 0.9951000000000004 # O1 0.2678999999999998 0.4793999999999994 0.0172000000000001 # O2 0.9813999999999999 0.2637000000000000 0.7451000000000001 # O3 0.5205999999999996 0.2678999999999998 0.7672000000000005 # O4 0.7363000000000000 0.9813999999999999 0.4950999999999998 # O5 0.7321000000000001 0.5205999999999996 0.5172000000000002 # O6 0.0186000000000001 0.7363000000000000 0.2451000000000001 # O7 0.4794000000000004 0.7321000000000001 0.2671999999999999 # O8 0.2637000000000000 0.9813999999999999 0.5049000000000002 # O9 0.2678999999999998 0.5205999999999996 0.4828000000000000 # O10 0.7363000000000000 0.0186000000000001 0.0049000000000003 # O11 0.7321000000000001 0.4794000000000004 0.9827999999999999 # O12 0.0186000000000001 0.2637000000000000 0.2549000000000000 # O13 0.4793999999999994 0.2678999999999998 0.2328000000000003 # O14 0.9813999999999999 0.7363000000000000 0.7548999999999999 # O15 0.5205999999999996 0.7321000000000001 0.7328000000000003 # O16