$cell vectors 1.0 7.9799962450766673 0.0000000000000000 0.0000000000000000 0.0000000000000000 10.1899952051793541 0.0000000000000000 0.0000000000000000 0.0000000000000000 6.2099970779355989 4 16 12 Direct 0.2499999999999999 0.1519000000000000 0.0000000000000000 # Ag1 0.7500000000000003 0.6518999999999996 0.5000000000000004 # Ag2 0.7500000000000003 0.8481000000000001 0.0000000000000000 # Ag3 0.2499999999999999 0.3480999999999998 0.5000000000000004 # Ag4 0.2499999999999999 0.9429999999999997 0.3870000000000002 # C1 0.2499999999999999 0.8700000000000001 0.6040000000000003 # C2 0.5940000000000003 0.1550000000000000 0.7040000000000004 # C3 0.7500000000000003 0.4430000000000001 0.8870000000000007 # C4 0.7500000000000003 0.3700000000000003 0.1039999999999999 # C5 0.0939999999999999 0.6550000000000002 0.2039999999999998 # C6 0.7500000000000003 0.0570000000000002 0.3870000000000002 # C7 0.7500000000000003 0.1300000000000000 0.6040000000000003 # C8 0.4059999999999999 0.8450000000000001 0.7040000000000004 # C9 0.2499999999999999 0.5569999999999999 0.8870000000000007 # C10 0.2499999999999999 0.6299999999999998 0.1039999999999999 # C11 0.9060000000000002 0.3449999999999998 0.2039999999999998 # C12 0.9060000000000002 0.1550000000000000 0.7040000000000004 # C13 0.4059999999999999 0.6550000000000002 0.2039999999999998 # C14 0.0939999999999999 0.8450000000000001 0.7040000000000004 # C15 0.5940000000000003 0.3449999999999998 0.2039999999999998 # C16 0.2499999999999999 0.0070000000000003 0.2409999999999999 # N1 0.4639999999999999 0.1860000000000001 0.7710000000000000 # N2 0.7500000000000003 0.5070000000000000 0.7410000000000003 # N3 0.9640000000000003 0.6859999999999999 0.2709999999999996 # N4 0.7500000000000003 0.9929999999999997 0.2409999999999999 # N5 0.5360000000000000 0.8139999999999998 0.7710000000000000 # N6 0.2499999999999999 0.4930000000000000 0.7410000000000003 # N7 0.0359999999999998 0.3140000000000001 0.2709999999999996 # N8 0.0359999999999998 0.1860000000000001 0.7710000000000000 # N9 0.5360000000000000 0.6859999999999999 0.2709999999999996 # N10 0.9640000000000003 0.8139999999999998 0.7710000000000000 # N11 0.4639999999999999 0.3140000000000001 0.2709999999999996 # N12