$cell vectors 1.0 15.8719925315610091 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.9219925080339237 0.0000000000000000 0.0000000000000000 0.0000000000000000 12.8849939370692823 8 80 16 Direct 0.5000000000000001 0.2500000000000001 0.8740999999999998 # Pd1 0.5000000000000001 0.7499999999999998 0.1255000000000001 # Pd2 0.0000000000000000 0.7499999999999998 0.3741000000000000 # Pd3 0.9999999999999996 0.2500000000000001 0.6254999999999997 # Pd4 0.5000000000000001 0.7500000000000001 0.6258999999999999 # Pd5 0.5000000000000001 0.2500000000000001 0.3745000000000001 # Pd6 0.0000000000000000 0.2499999999999998 0.1259000000000002 # Pd7 0.9999999999999999 0.7500000000000001 0.8744999999999997 # Pd8 0.4404000000000001 0.3931000000000000 0.8712999999999997 # Se1 0.5490000000000002 0.4878999999999999 0.8394999999999998 # Se2 0.6432000000000001 0.3090000000000000 0.8777000000000001 # Se3 0.7383999999999996 0.2014000000000000 0.9086999999999998 # Se4 0.5111999999999999 0.5960999999999999 0.1305000000000002 # Se5 0.8567999999999996 0.4439000000000001 0.5698000000000000 # Se6 0.7640999999999999 0.4321999999999998 0.7126999999999998 # Se7 0.6546000000000000 0.7592000000000001 0.1210999999999998 # Se8 0.6955999999999999 0.8936999999999998 0.1818999999999999 # Se9 0.8177999999999999 0.0136000000000000 0.5387000000000000 # Se10 0.9403999999999999 0.8930999999999999 0.3712999999999999 # Se11 0.0490000000000000 0.9878999999999998 0.3395000000000001 # Se12 0.1432000000000002 0.8089999999999999 0.3776999999999999 # Se13 0.2383999999999999 0.7013999999999999 0.4087000000000002 # Se14 0.0112000000000001 0.0960999999999999 0.6304999999999998 # Se15 0.3568000000000000 0.9438999999999997 0.0697999999999999 # Se16 0.2640999999999998 0.9321999999999997 0.2126999999999997 # Se17 0.1545999999999995 0.2592000000000000 0.6210999999999999 # Se18 0.1955999999999995 0.3936999999999999 0.6818999999999997 # Se19 0.3178000000000000 0.5136000000000001 0.0386999999999997 # Se20 0.5595999999999999 0.1068999999999999 0.8712999999999997 # Se21 0.4510000000000001 0.0121000000000000 0.8394999999999998 # Se22 0.3568000000000000 0.1909999999999999 0.8777000000000001 # Se23 0.2616000000000002 0.2985999999999999 0.9086999999999998 # Se24 0.4888000000000000 0.9038999999999998 0.1305000000000002 # Se25 0.1431999999999999 0.0561000000000001 0.5698000000000000 # Se26 0.2359000000000000 0.0678000000000002 0.7126999999999998 # Se27 0.3454000000000000 0.7407999999999998 0.1210999999999998 # Se28 0.3043999999999999 0.6063000000000000 0.1818999999999999 # Se29 0.1821999999999998 0.4863999999999999 0.5387000000000000 # Se30 0.0596000000000000 0.6068999999999998 0.3712999999999999 # Se31 0.9509999999999998 0.5120999999999999 0.3395000000000001 # Se32 0.8567999999999999 0.6909999999999997 0.3776999999999999 # Se33 0.7615999999999999 0.7985999999999998 0.4087000000000002 # Se34 0.9887999999999998 0.4039000000000000 0.6304999999999998 # Se35 0.6432000000000001 0.5560999999999999 0.0697999999999999 # Se36 0.7359000000000001 0.5678000000000001 0.2126999999999997 # Se37 0.8454000000000000 0.2408000000000002 0.6210999999999999 # Se38 0.8044000000000001 0.1063000000000000 0.6818999999999997 # Se39 0.6822000000000003 0.9863999999999999 0.0386999999999997 # Se40 0.4404000000000001 0.6068999999999998 0.6286999999999999 # Se41 0.5490000000000002 0.5120999999999999 0.6604999999999999 # Se42 0.6432000000000001 0.6910000000000001 0.6222999999999995 # Se43 0.7383999999999996 0.7985999999999998 0.5912999999999997 # Se44 0.5111999999999999 0.4039000000000000 0.3695000000000000 # Se45 0.8567999999999996 0.5560999999999999 0.9302000000000000 # Se46 0.7640999999999999 0.5678000000000001 0.7872999999999998 # Se47 0.6546000000000000 0.2408000000000002 0.3788999999999999 # Se48 0.6955999999999999 0.1063000000000000 0.3180999999999999 # Se49 0.8178000000000002 0.9863999999999999 0.9612999999999996 # Se50 0.9403999999999999 0.1068999999999999 0.1287000000000002 # Se51 0.0490000000000000 0.0121000000000000 0.1604999999999996 # Se52 0.1431999999999999 0.1909999999999999 0.1222999999999999 # Se53 0.2383999999999999 0.2985999999999999 0.0913000000000000 # Se54 0.0112000000000001 0.9038999999999998 0.8694999999999998 # Se55 0.3568000000000000 0.0561000000000001 0.4301999999999999 # Se56 0.2640999999999998 0.0678000000000002 0.2873000000000001 # Se57 0.1545999999999995 0.7408000000000001 0.8789000000000000 # Se58 0.1955999999999995 0.6063000000000000 0.8181000000000000 # Se59 0.3178000000000000 0.4863999999999999 0.4612999999999999 # Se60 0.0596000000000000 0.3931000000000000 0.1287000000000002 # Se61 0.9509999999999998 0.4878999999999999 0.1604999999999996 # Se62 0.8567999999999999 0.3090000000000000 0.1222999999999999 # Se63 0.7615999999999999 0.2014000000000000 0.0913000000000000 # Se64 0.9887999999999998 0.5960999999999999 0.8694999999999998 # Se65 0.6432000000000001 0.4439000000000001 0.4301999999999999 # Se66 0.7359000000000001 0.4321999999999998 0.2873000000000001 # Se67 0.8454000000000000 0.7592000000000001 0.8789000000000000 # Se68 0.8044000000000001 0.8936999999999998 0.8181000000000000 # Se69 0.6821999999999999 0.0136000000000000 0.4612999999999999 # Se70 0.5595999999999999 0.8930999999999999 0.6286999999999999 # Se71 0.4510000000000001 0.9878999999999998 0.6604999999999999 # Se72 0.3568000000000002 0.8089999999999999 0.6222999999999995 # Se73 0.2616000000000002 0.7013999999999999 0.5912999999999997 # Se74 0.4888000000000000 0.0960999999999999 0.3695000000000000 # Se75 0.1432000000000002 0.9439000000000001 0.9302000000000000 # Se76 0.2359000000000000 0.9322000000000001 0.7872999999999998 # Se77 0.3454000000000000 0.2592000000000000 0.3788999999999999 # Se78 0.3043999999999999 0.3936999999999999 0.3180999999999999 # Se79 0.1821999999999998 0.5136000000000001 0.9612999999999996 # Se80 0.0944999999999999 0.8480999999999996 0.6303999999999997 # K1 0.4032999999999999 0.6590000000000000 0.8702000000000000 # K2 0.5945000000000000 0.3481000000000001 0.1303999999999999 # K3 0.9032999999999999 0.1590000000000001 0.3702000000000000 # K4 0.9055000000000001 0.6519000000000001 0.6303999999999997 # K5 0.5966999999999999 0.8410000000000001 0.8702000000000000 # K6 0.4054999999999998 0.1519000000000002 0.1303999999999999 # K7 0.0967000000000001 0.3409999999999998 0.3702000000000000 # K8 0.0944999999999999 0.1519000000000002 0.8695999999999996 # K9 0.4032999999999999 0.3409999999999998 0.6297999999999999 # K10 0.5945000000000000 0.6519000000000001 0.3695999999999999 # K11 0.9032999999999999 0.8409999999999997 0.1298000000000001 # K12 0.4054999999999998 0.8480999999999996 0.3695999999999999 # K13 0.0967000000000001 0.6590000000000000 0.1298000000000001 # K14 0.9055000000000001 0.3481000000000001 0.8695999999999996 # K15 0.5966999999999999 0.1590000000000001 0.6297999999999999 # K16