$cell vectors 1.0 6.3199970261760088 0.0000000000000000 0.0000000000000000 -3.1599985130880044 5.4732779765105271 0.0000000000000000 0.0000000000000000 0.0000000000000000 19.2899909232492348 3 6 30 Direct 0.0000000000000000 0.0000000000000000 0.0000000000000000 # Sr1 0.0000000000000000 0.0000000000000000 0.3333333333333335 # Sr2 0.0000000000000000 0.0000000000000000 0.6666666666666669 # Sr3 0.6919999999999992 0.0649999999999996 0.1619999999999999 # S1 0.6270000000000009 0.6920000000000004 0.4953333333333333 # S2 -0.0649999999999997 0.6269999999999999 0.8286666666666666 # S3 0.3080000000000001 -0.0649999999999996 0.1619999999999999 # S4 0.3730000000000002 0.3079999999999997 0.4953333333333333 # S5 0.0650000000000005 0.3730000000000003 0.8286666666666666 # S6 0.7469999999999997 0.0040000000000000 0.0970000000000000 # O1 0.7519999999999999 -0.0150000000000004 0.2230000000000001 # O2 0.8080000000000002 0.3190000000000001 0.1659999999999999 # O3 0.1879999999999999 0.4480000000000004 0.0379999999999999 # O4 0.4489999999999999 0.1989999999999997 0.9519999999999997 # O5 0.7430000000000004 0.7470000000000002 0.4303333333333333 # O6 0.7670000000000000 0.7520000000000000 0.5563333333333333 # O7 0.4890000000000000 0.8079999999999996 0.4993333333333334 # O8 0.7400000000000000 0.1880000000000003 0.3713333333333333 # O9 0.2500000000000002 0.4490000000000002 0.2853333333333333 # O10 -0.0039999999999991 0.7430000000000003 0.7636666666666668 # O11 0.0150000000000009 0.7670000000000006 0.8896666666666667 # O12 -0.3189999999999995 0.4890000000000007 0.8326666666666664 # O13 0.5520000000000007 0.7400000000000000 0.7046666666666669 # O14 0.8010000000000004 0.2500000000000006 0.6186666666666668 # O15 0.2529999999999997 -0.0040000000000000 0.0970000000000000 # O16 0.2480000000000001 0.0150000000000004 0.2230000000000001 # O17 0.1920000000000001 -0.3190000000000001 0.1659999999999999 # O18 0.8120000000000007 0.5520000000000006 0.0379999999999999 # O19 0.5510000000000004 0.8010000000000005 0.9519999999999997 # O20 0.2569999999999997 0.2529999999999998 0.4303333333333333 # O21 0.2330000000000001 0.2480000000000000 0.5563333333333333 # O22 0.5110000000000000 0.1920000000000003 0.4993333333333334 # O23 0.2600000000000008 0.8120000000000008 0.3713333333333333 # O24 0.7499999999999999 0.5509999999999999 0.2853333333333333 # O25 0.0040000000000000 0.2569999999999998 0.7636666666666668 # O26 -0.0149999999999996 0.2330000000000005 0.8896666666666667 # O27 0.3190000000000007 0.5110000000000003 0.8326666666666664 # O28 0.4480000000000003 0.2600000000000002 0.7046666666666669 # O29 0.1990000000000001 0.7500000000000006 0.6186666666666668 # O30