$cell vectors 1.0 4.4809978915023265 0.0000000000000000 0.0000000000000000 0.0000000000000000 7.6719963900035326 0.0000000000000000 0.0000000000000000 0.0000000000000000 14.3289932576069656 4 4 12 Direct 0.8010999999999997 0.7210000000000001 0.7454000000000000 # Cu1 0.1989000000000003 0.2789999999999998 0.7454000000000000 # Cu2 0.1988999999999991 0.2210000000000002 0.2454000000000000 # Cu3 0.8010999999999997 0.7789999999999998 0.2454000000000000 # Cu4 0.5000000000000000 0.0000000000000000 0.1901000000000000 # Br1 0.5000000000000000 0.0000000000000000 0.8357999999999998 # Br2 0.5000000000000000 0.5000000000000000 0.6900999999999997 # Br3 0.5000000000000000 0.5000000000000000 0.3357999999999998 # Br4 0.1392999999999992 0.2304999999999997 0.0091000000000000 # Se1 0.9152999999999997 0.1370999999999996 0.3854000000000001 # Se2 0.8697999999999994 0.3522999999999998 0.1348999999999999 # Se3 0.8606999999999996 0.7695000000000003 0.0091000000000000 # Se4 0.0847000000000004 0.8629000000000004 0.3854000000000001 # Se5 0.1301999999999994 0.6477000000000003 0.1348999999999999 # Se6 0.8606999999999996 0.7305000000000003 0.5090999999999999 # Se7 0.0847000000000004 0.6371000000000003 0.8853999999999999 # Se8 0.1302000000000006 0.8523000000000004 0.6348999999999999 # Se9 0.1393000000000004 0.2695000000000002 0.5090999999999999 # Se10 0.9152999999999997 0.3629000000000003 0.8853999999999999 # Se11 0.8697999999999994 0.1477000000000002 0.6348999999999999 # Se12