$cell vectors 1.0 7.6289964102368302 0.0000000000000000 0.0000000000000000 0.0000000000000000 7.6289964102368302 0.0000000000000000 0.0000000000000000 0.0000000000000053 29.4969861204293764 16 16 64 4 12 Direct 0.8853999999999995 0.9355999999999999 0.2253000000000001 # Rb1 0.7726999999999997 0.5188999999999999 0.1197000000000001 # Rb2 0.3801000000000002 0.6350000000000001 0.2382000000000001 # Rb3 0.4709000000000002 0.0250999999999998 0.1098999999999999 # Rb4 0.0644000000000001 0.8853999999999996 0.9753000000000002 # Rb5 0.4811000000000001 0.7726999999999999 0.8697000000000004 # Rb6 0.3649999999999999 0.3800999999999995 0.9882000000000001 # Rb7 0.9749000000000003 0.4708999999999995 0.8599000000000002 # Rb8 0.1146000000000005 0.0643999999999996 0.7253000000000002 # Rb9 0.2273000000000004 0.4810999999999997 0.6197000000000000 # Rb10 0.6199000000000000 0.3650000000000000 0.7382000000000002 # Rb11 0.5291000000000000 0.9748999999999999 0.6099000000000001 # Rb12 0.9356000000000000 0.1146000000000002 0.4753000000000000 # Rb13 0.5189000000000000 0.2273000000000001 0.3697000000000000 # Rb14 0.6350000000000002 0.6198999999999997 0.4882000000000000 # Rb15 0.0250999999999999 0.5290999999999998 0.3599000000000001 # Rb16 0.4097000000000001 0.1228999999999997 0.2372000000000001 # S1 0.8751000000000001 0.4618999999999998 0.2386999999999999 # S2 0.3028999999999999 0.5377000000000000 0.1102000000000001 # S3 0.9637000000000002 0.0045000000000000 0.1066999999999999 # S4 0.8771000000000003 0.4096999999999995 0.9872000000000002 # S5 0.5381000000000001 0.8750999999999994 0.9887000000000001 # S6 0.4623000000000002 0.3028999999999999 0.8602000000000002 # S7 0.9955000000000001 0.9636999999999997 0.8567000000000002 # S8 0.5903000000000000 0.8770999999999998 0.7372000000000002 # S9 0.1249000000000001 0.5380999999999996 0.7387000000000001 # S10 0.6971000000000002 0.4622999999999997 0.6102000000000002 # S11 0.0363000000000000 0.9954999999999996 0.6067000000000000 # S12 0.1228999999999999 0.5902999999999997 0.4872000000000001 # S13 0.4619000000000000 0.1248999999999997 0.4887000000000001 # S14 0.5377000000000001 0.6970999999999999 0.3602000000000000 # S15 0.0045000000000001 0.0362999999999997 0.3567000000000001 # S16 0.3434000000000000 0.2546999999999995 0.2063000000000000 # O1 0.2547999999999999 0.0265000000000000 0.2509000000000001 # O2 0.5092999999999999 0.2070999999999999 0.2734000000000001 # O3 0.5111000000000003 -0.0070000000000001 0.2131000000000002 # O4 1.0232999999999997 0.5592999999999996 0.2561000000000000 # O5 0.7436999999999997 0.5726000000000003 0.2179000000000000 # O6 0.7898999999999998 0.3779999999999995 0.2813000000000001 # O7 0.9232000000000000 0.3178999999999998 0.2085000000000001 # O8 0.8330000000000000 -0.1065999999999998 0.1279000000000000 # O9 1.0867999999999998 0.0721000000000001 0.1408000000000000 # O10 1.0685999999999998 -0.0858000000000003 0.0709000000000001 # O11 0.8693000000000000 0.1574000000000000 0.0850000000000000 # O12 0.1556000000000003 0.4885999999999998 0.1373000000000001 # O13 0.4022999999999999 0.3929999999999997 0.0925000000000001 # O14 0.2313000000000001 0.6263000000000000 0.0669000000000001 # O15 0.4114999999999999 0.6649000000000002 0.1330000000000000 # O16 0.7453000000000004 0.3433999999999994 0.9563000000000001 # O17 0.9735000000000000 0.2547999999999999 1.0009000000000001 # O18 0.7929000000000002 0.5093000000000000 1.0234000000000001 # O19 1.0070000000000001 0.5110999999999997 0.9631000000000003 # O20 0.4407000000000003 1.0232999999999997 1.0061000000000002 # O21 0.4274000000000004 0.7436999999999998 0.9679000000000000 # O22 0.6220000000000004 0.7898999999999998 1.0313000000000001 # O23 0.6821000000000003 0.9231999999999994 0.9585000000000001 # O24 1.1066000000000000 0.8329999999999994 0.8779000000000002 # O25 0.9278999999999999 1.0867999999999998 0.8908000000000000 # O26 1.0857999999999997 1.0685999999999998 0.8209000000000001 # O27 0.8426000000000000 0.8692999999999994 0.8350000000000001 # O28 0.5114000000000003 0.1555999999999997 0.8873000000000002 # O29 0.6070000000000002 0.4023000000000000 0.8425000000000004 # O30 0.3737000000000001 0.2312999999999995 0.8169000000000002 # O31 0.3351000000000000 0.4114999999999999 0.8830000000000003 # O32 0.6566000000000003 0.7453000000000000 0.7063000000000001 # O33 0.7452000000000003 0.9734999999999995 0.7509000000000001 # O34 0.4907000000000002 0.7928999999999996 0.7734000000000002 # O35 0.4888999999999998 1.0069999999999997 0.7131000000000002 # O36 -0.0232999999999994 0.4406999999999998 0.7561000000000002 # O37 0.2563000000000004 0.4273999999999999 0.7179000000000000 # O38 0.2101000000000004 0.6219999999999999 0.7813000000000002 # O39 0.0768000000000001 0.6820999999999998 0.7085000000000000 # O40 0.1670000000000002 1.1065999999999996 0.6279000000000001 # O41 -0.0867999999999996 0.9278999999999995 0.6408000000000000 # O42 -0.0685999999999995 1.0857999999999992 0.5709000000000002 # O43 0.1307000000000002 0.8425999999999996 0.5850000000000002 # O44 0.8443999999999998 0.5113999999999999 0.6373000000000002 # O45 0.5977000000000002 0.6069999999999998 0.5925000000000001 # O46 0.7687000000000000 0.3736999999999997 0.5669000000000002 # O47 0.5885000000000004 0.3350999999999996 0.6330000000000000 # O48 0.2547000000000004 0.6566000000000000 0.4563000000000001 # O49 0.0265000000000001 0.7452000000000000 0.5009000000000001 # O50 0.2071000000000001 0.4906999999999999 0.5234000000000000 # O51 -0.0070000000000000 0.4888999999999994 0.4631000000000001 # O52 0.5592999999999998 -0.0232999999999998 0.5061000000000001 # O53 0.5726000000000004 0.2563000000000000 0.4679000000000001 # O54 0.3779999999999997 0.2101000000000000 0.5313000000000000 # O55 0.3179000000000000 0.0767999999999997 0.4585000000000000 # O56 -0.1065999999999998 0.1669999999999999 0.3779000000000001 # O57 0.0721000000000002 -0.0867999999999999 0.3908000000000001 # O58 -0.0858000000000002 -0.0685999999999998 0.3209000000000000 # O59 0.1574000000000001 0.1307000000000000 0.3350000000000001 # O60 0.4885999999999999 0.8443999999999996 0.3873000000000000 # O61 0.3929999999999998 0.5977000000000000 0.3425000000000001 # O62 0.6263000000000000 0.7686999999999998 0.3169000000000000 # O63 0.6649000000000003 0.5885000000000001 0.3830000000000001 # O64 0.1285000000000003 0.2769000000000000 0.1728000000000000 # Li1 0.7231000000000000 0.1284999999999996 0.9228000000000003 # Li2 0.8715000000000001 0.7230999999999995 0.6728000000000003 # Li3 0.2769000000000001 0.8714999999999997 0.4228000000000002 # Li4 0.2288000000000002 0.0782000000000001 0.2884000000000001 # H1 0.6831999999999999 0.3165999999999997 0.2726000000000001 # H2 0.1515999999999999 0.7204999999999999 0.0748000000000001 # H3 0.9217999999999998 0.2288000000000001 0.0384000000000000 # H4 0.6834000000000002 0.6831999999999998 1.0226000000000000 # H5 0.2795000000000003 0.1516000000000000 0.8248000000000000 # H6 0.7711999999999999 0.9217999999999998 0.7884000000000002 # H7 0.3168000000000003 0.6833999999999997 0.7726000000000000 # H8 0.8484000000000003 0.2794999999999999 0.5747999999999999 # H9 0.0782000000000003 0.7711999999999996 0.5384000000000001 # H10 0.3165999999999999 0.3167999999999999 0.5226000000000001 # H11 0.7204999999999999 0.8484000000000000 0.3248000000000001 # H12