$cell vectors 1.0 7.8229963189517262 0.0000000000000000 0.0000000000000000 0.0000000000000000 7.8229963189517262 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.0529957401853434 6 4 16 Direct 0.0000000000000000 0.0000000000000000 0.5000000000000003 # Zn1 0.0000000000000000 0.5000000000000000 0.9809000000000005 # Zn2 0.5000000000000000 1.0000000000000000 0.0191000000000003 # Zn3 0.5000000000000000 0.5000000000000000 0.0000000000000000 # Zn4 0.0000000000000000 0.5000000000000000 0.5191000000000000 # Zn5 0.5000000000000000 0.0000000000000000 0.4809000000000000 # Zn6 0.2553000000000000 0.7553000000000000 0.2500000000000002 # P1 0.7553000000000000 0.7447000000000001 0.7500000000000006 # P2 0.7447000000000001 0.2447000000000001 0.2500000000000002 # P3 0.2447000000000001 0.2553000000000000 0.7500000000000006 # P4 0.7660000000000002 0.0323999999999997 0.1259000000000001 # S1 0.7528999999999998 0.4784000000000002 0.1384000000000000 # S2 0.0323999999999997 0.2339999999999998 0.8741000000000007 # S3 0.4784000000000002 0.2471000000000003 0.8616000000000001 # S4 0.2339999999999998 0.9675999999999998 0.1259000000000001 # S5 0.2471000000000003 0.5215999999999998 0.1384000000000000 # S6 0.9676000000000003 0.7660000000000002 0.8741000000000007 # S7 0.5215999999999998 0.7529000000000005 0.8616000000000001 # S8 0.5323999999999998 0.2660000000000003 0.3741000000000003 # S9 0.9783999999999997 0.2528999999999998 0.3616000000000004 # S10 0.4676000000000003 0.7339999999999999 0.3741000000000003 # S11 0.0215999999999998 0.7470999999999997 0.3616000000000004 # S12 0.7339999999999999 0.5324000000000004 0.6259000000000005 # S13 0.7471000000000002 0.9784000000000003 0.6384000000000003 # S14 0.2660000000000003 0.4676000000000003 0.6259000000000005 # S15 0.2528999999999998 0.0215999999999998 0.6384000000000003 # S16