$cell vectors 1.0 17.3439918389235253 0.0000000000000000 0.0000000000000000 0.0000000000000000 17.3439918389235253 0.0000000000000000 0.0000000000000000 0.0000000000000000 17.3439918389235253 48 128 Direct 0.0000000000000000 0.0000000000000000 0.0000000000000000 # Si1 0.1722999999999999 0.1723000000000002 0.1722999999999999 # Si2 0.2499999999999999 0.2499999999999999 0.2499999999999999 # Si3 0.0000000000000000 0.5000000000000001 0.4999999999999997 # Si4 0.1723000000000002 0.6723000000000000 0.6723000000000000 # Si5 0.2500000000000002 0.7500000000000000 0.7500000000000000 # Si6 0.4999999999999997 0.0000000000000000 0.4999999999999997 # Si7 0.6723000000000000 0.1723000000000002 0.6723000000000000 # Si8 0.4999999999999997 0.4999999999999997 0.0000000000000000 # Si9 0.6723000000000000 0.6723000000000000 0.1722999999999999 # Si10 0.7500000000000000 0.7500000000000000 0.2499999999999999 # Si11 0.0000000000000000 0.0000000000000000 0.4999999999999997 # Si12 0.1723000000000002 0.8277000000000001 0.3277000000000000 # Si13 0.2499999999999999 0.7500000000000000 0.2499999999999999 # Si14 0.0000000000000000 0.4999999999999997 0.0000000000000000 # Si15 0.1723000000000002 0.3277000000000000 0.8277000000000001 # Si16 0.2499999999999999 0.2500000000000002 0.7500000000000000 # Si17 0.4999999999999997 0.0000000000000000 0.0000000000000000 # Si18 0.6723000000000000 0.8277000000000001 0.8277000000000001 # Si19 0.7500000000000000 0.7500000000000000 0.7500000000000000 # Si20 0.4999999999999997 0.5000000000000001 0.4999999999999997 # Si21 0.6723000000000000 0.3277000000000000 0.3277000000000000 # Si22 0.7500000000000000 0.2499999999999999 0.2499999999999999 # Si23 0.8277000000000001 0.8277000000000001 0.1722999999999999 # Si24 0.3277000000000000 0.8277000000000001 0.6723000000000000 # Si25 0.3277000000000000 0.3277000000000000 0.1722999999999999 # Si26 0.8277000000000001 0.1723000000000002 0.3277000000000000 # Si27 0.8277000000000001 0.6723000000000000 0.8277000000000001 # Si28 0.3277000000000000 0.1723000000000002 0.8277000000000001 # Si29 0.3277000000000000 0.6723000000000000 0.3277000000000000 # Si30 0.1723000000000002 0.8277000000000001 0.8277000000000001 # Si31 0.1723000000000002 0.3277000000000000 0.3277000000000000 # Si32 0.6723000000000000 0.8277000000000001 0.3277000000000000 # Si33 0.6723000000000000 0.3277000000000000 0.8277000000000001 # Si34 0.8277000000000001 0.8277000000000001 0.6723000000000000 # Si35 0.8277000000000001 0.3277000000000000 0.1722999999999999 # Si36 0.3277000000000000 0.8277000000000001 0.1722999999999999 # Si37 0.3277000000000000 0.3277000000000000 0.6723000000000000 # Si38 0.8277000000000001 0.1723000000000002 0.8277000000000001 # Si39 0.8277000000000001 0.6723000000000000 0.3277000000000000 # Si40 0.3277000000000000 0.1723000000000002 0.3277000000000000 # Si41 0.3277000000000000 0.6723000000000000 0.8277000000000001 # Si42 0.8277000000000001 0.3277000000000000 0.6723000000000000 # Si43 0.7500000000000000 0.2500000000000002 0.7500000000000000 # Si44 0.1723000000000002 0.1723000000000002 0.6723000000000000 # Si45 0.1723000000000002 0.6723000000000000 0.1722999999999999 # Si46 0.6723000000000000 0.1723000000000002 0.1722999999999999 # Si47 0.6723000000000000 0.6723000000000000 0.6723000000000000 # Si48 -0.0650000000000001 -0.0650000000000001 -0.0650000000000001 # Cl1 0.2321999999999999 0.1344000000000001 0.0818000000000000 # Cl2 -0.0649999999999998 0.4350000000000001 0.4350000000000001 # Cl3 0.2322000000000002 0.6344000000000000 0.5817999999999999 # Cl4 0.4350000000000001 -0.0649999999999998 0.4350000000000001 # Cl5 0.7322000000000000 0.1344000000000001 0.5817999999999999 # Cl6 0.4350000000000001 0.4350000000000001 -0.0650000000000001 # Cl7 0.7322000000000000 0.6344000000000000 0.0818000000000000 # Cl8 -0.0649999999999998 0.0650000000000001 0.5649999999999999 # Cl9 0.1344000000000001 0.7678000000000001 0.4181999999999999 # Cl10 -0.0649999999999998 0.5649999999999999 0.0650000000000001 # Cl11 0.1344000000000001 0.2678000000000003 0.9182000000000000 # Cl12 0.4350000000000001 0.0650000000000001 0.0650000000000001 # Cl13 0.6344000000000000 0.7678000000000001 0.9182000000000000 # Cl14 0.4350000000000001 0.5649999999999999 0.5649999999999999 # Cl15 0.6344000000000000 0.2678000000000003 0.4181999999999999 # Cl16 0.0650000000000001 0.0649999999999998 -0.0650000000000001 # Cl17 0.7678000000000001 0.8655999999999999 0.0818000000000000 # Cl18 0.0650000000000001 0.5649999999999999 0.4350000000000001 # Cl19 0.7678000000000001 0.3656000000000000 0.5817999999999999 # Cl20 0.5649999999999999 0.0650000000000001 0.4350000000000001 # Cl21 0.2678000000000003 0.8656000000000003 0.5817999999999999 # Cl22 0.5649999999999999 0.5649999999999999 -0.0650000000000001 # Cl23 0.2677999999999999 0.3656000000000000 0.0818000000000000 # Cl24 0.0650000000000001 -0.0649999999999998 0.5649999999999999 # Cl25 0.8655999999999999 0.2321999999999999 0.4181999999999999 # Cl26 0.0650000000000001 0.4350000000000001 0.0650000000000001 # Cl27 0.8656000000000003 0.7322000000000000 0.9182000000000000 # Cl28 0.5649999999999999 -0.0649999999999998 0.0650000000000001 # Cl29 0.3656000000000000 0.2322000000000002 0.9182000000000000 # Cl30 0.5649999999999999 0.4350000000000001 0.5649999999999999 # Cl31 0.3656000000000000 0.7322000000000000 0.4181999999999999 # Cl32 0.7678000000000001 0.0818000000000000 0.3656000000000000 # Cl33 0.7678000000000001 0.5818000000000001 0.8655999999999999 # Cl34 0.2678000000000003 0.0818000000000000 0.8655999999999999 # Cl35 0.2678000000000003 0.5817999999999999 0.3656000000000000 # Cl36 -0.0650000000000001 0.0650000000000001 0.0650000000000001 # Cl37 0.2322000000000002 0.8656000000000003 0.9182000000000000 # Cl38 -0.0649999999999998 0.5649999999999999 0.5649999999999999 # Cl39 0.2321999999999999 0.3656000000000000 0.4181999999999999 # Cl40 0.4350000000000001 0.0650000000000001 0.5649999999999999 # Cl41 0.7322000000000000 0.8655999999999999 0.4181999999999999 # Cl42 0.4350000000000001 0.5649999999999999 0.0650000000000001 # Cl43 0.7322000000000000 0.3656000000000000 0.9182000000000000 # Cl44 0.0650000000000001 0.0650000000000001 0.4350000000000001 # Cl45 0.7678000000000001 0.9182000000000000 0.6344000000000000 # Cl46 0.0650000000000001 0.5649999999999999 -0.0650000000000001 # Cl47 0.7678000000000001 0.4181999999999999 0.1344000000000001 # Cl48 0.5649999999999999 0.0649999999999998 -0.0650000000000001 # Cl49 0.2678000000000003 0.9182000000000000 0.1344000000000001 # Cl50 0.5649999999999999 0.5649999999999999 0.4350000000000001 # Cl51 0.2678000000000003 0.4181999999999999 0.6344000000000000 # Cl52 0.9182000000000000 0.8656000000000003 0.7322000000000000 # Cl53 0.9182000000000000 0.3656000000000000 0.2321999999999999 # Cl54 0.4181999999999999 0.8655999999999999 0.2321999999999999 # Cl55 0.4181999999999999 0.3656000000000000 0.7322000000000000 # Cl56 0.0650000000000001 -0.0649999999999998 0.0650000000000001 # Cl57 0.7678000000000001 0.1344000000000001 0.9182000000000000 # Cl58 0.0650000000000001 0.4350000000000001 0.5649999999999999 # Cl59 0.7678000000000001 0.6344000000000000 0.4181999999999999 # Cl60 0.5649999999999999 -0.0649999999999998 0.5649999999999999 # Cl61 0.2678000000000003 0.1344000000000001 0.4181999999999999 # Cl62 0.5649999999999999 0.4350000000000001 0.0650000000000001 # Cl63 0.2678000000000003 0.6344000000000000 0.9182000000000000 # Cl64 0.0818000000000000 0.8655999999999999 0.2677999999999999 # Cl65 0.0818000000000000 0.3656000000000000 0.7678000000000001 # Cl66 0.5818000000000001 0.8656000000000003 0.7678000000000001 # Cl67 0.5817999999999999 0.3656000000000000 0.2677999999999999 # Cl68 0.0818000000000000 0.2321999999999999 0.1344000000000001 # Cl69 0.0818000000000000 0.7322000000000000 0.6344000000000000 # Cl70 0.5817999999999999 0.2321999999999999 0.6344000000000000 # Cl71 0.5817999999999999 0.7322000000000000 0.1344000000000001 # Cl72 0.1344000000000001 0.0818000000000000 0.2321999999999999 # Cl73 0.1344000000000001 0.5818000000000001 0.7322000000000000 # Cl74 0.6344000000000000 0.0818000000000000 0.7322000000000000 # Cl75 0.6344000000000000 0.5817999999999999 0.2321999999999999 # Cl76 0.8656000000000003 0.9182000000000000 0.2321999999999999 # Cl77 0.8655999999999999 0.4182000000000002 0.7322000000000000 # Cl78 0.3656000000000000 0.9182000000000000 0.7322000000000000 # Cl79 0.3656000000000000 0.4181999999999999 0.2321999999999999 # Cl80 0.0818000000000000 0.7678000000000001 0.8655999999999999 # Cl81 0.0818000000000000 0.2678000000000003 0.3656000000000000 # Cl82 0.5817999999999999 0.7678000000000001 0.3656000000000000 # Cl83 0.5818000000000001 0.2678000000000003 0.8655999999999999 # Cl84 0.8655999999999999 0.0818000000000000 0.7678000000000001 # Cl85 0.8655999999999999 0.5817999999999999 0.2677999999999999 # Cl86 0.3656000000000000 0.0818000000000000 0.2677999999999999 # Cl87 0.3656000000000000 0.5818000000000001 0.7678000000000001 # Cl88 0.9182000000000000 0.7678000000000001 0.1344000000000001 # Cl89 0.9182000000000000 0.2678000000000003 0.6344000000000000 # Cl90 0.4182000000000002 0.7678000000000001 0.6344000000000000 # Cl91 0.4181999999999999 0.2677999999999999 0.1344000000000001 # Cl92 0.9182000000000000 0.2322000000000002 0.8655999999999999 # Cl93 0.9182000000000000 0.7322000000000000 0.3656000000000000 # Cl94 0.4181999999999999 0.2321999999999999 0.3656000000000000 # Cl95 0.4182000000000002 0.7322000000000000 0.8655999999999999 # Cl96 0.1344000000000001 0.9182000000000000 0.7678000000000001 # Cl97 0.1344000000000001 0.4181999999999999 0.2677999999999999 # Cl98 0.6344000000000000 0.9182000000000000 0.2677999999999999 # Cl99 0.6344000000000000 0.4182000000000002 0.7678000000000001 # Cl100 0.8655999999999999 0.7678000000000001 0.5817999999999999 # Cl101 0.8655999999999999 0.2677999999999999 0.0818000000000000 # Cl102 0.3656000000000000 0.7678000000000001 0.0818000000000000 # Cl103 0.3656000000000000 0.2678000000000003 0.5817999999999999 # Cl104 -0.0649999999999998 -0.0649999999999998 0.4350000000000001 # Cl105 0.1344000000000001 0.2321999999999999 0.5817999999999999 # Cl106 -0.0649999999999998 0.4350000000000001 -0.0650000000000001 # Cl107 0.1344000000000001 0.7322000000000000 0.0818000000000000 # Cl108 0.4350000000000001 -0.0650000000000001 -0.0650000000000001 # Cl109 0.6344000000000000 0.2321999999999999 0.0818000000000000 # Cl110 0.4350000000000001 0.4350000000000001 0.4350000000000001 # Cl111 0.6344000000000000 0.7322000000000000 0.5817999999999999 # Cl112 0.2321999999999999 0.9182000000000000 0.3656000000000000 # Cl113 0.2322000000000002 0.4182000000000002 0.8655999999999999 # Cl114 0.7322000000000000 0.9182000000000000 0.8655999999999999 # Cl115 0.7322000000000000 0.4181999999999999 0.3656000000000000 # Cl116 0.2321999999999999 0.0818000000000000 0.6344000000000000 # Cl117 0.2321999999999999 0.5817999999999999 0.1344000000000001 # Cl118 0.7322000000000000 0.0818000000000000 0.1344000000000001 # Cl119 0.7322000000000000 0.5818000000000001 0.6344000000000000 # Cl120 0.9182000000000000 0.1344000000000001 0.2677999999999999 # Cl121 0.9182000000000000 0.6344000000000000 0.7678000000000001 # Cl122 0.4181999999999999 0.1344000000000001 0.7678000000000001 # Cl123 0.4181999999999999 0.6344000000000000 0.2677999999999999 # Cl124 0.0818000000000000 0.1344000000000001 0.7322000000000000 # Cl125 0.0818000000000000 0.6344000000000000 0.2321999999999999 # Cl126 0.5817999999999999 0.1344000000000001 0.2321999999999999 # Cl127 0.5817999999999999 0.6344000000000000 0.7322000000000000 # Cl128