No title 1.00000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 23.4276799999999987 Si O H 31 70 16 Selective dynamics Direct 0.1291258799999966 0.1273574200000027 0.3857362400000000 F F F 0.3747950300000014 0.1212559700000000 0.3068719799999968 F F F 0.3016403000000025 0.0878436100000002 0.6081958199999988 T T T 0.1015050900000034 0.3948008899999991 0.1493967299999994 F F F 0.0945009300000024 0.3792549899999997 0.4622876299999987 F F F 0.3525443500000023 0.3681428900000014 0.2283499199999994 F F F 0.3460142099999999 0.3439308600000004 0.5358768899999973 T T T 0.1299311900000006 0.6284818800000025 0.3816943699999982 F F F 0.3806878700000027 0.6215518699999976 0.3063824899999972 F F F 0.3320859100000035 0.5885983599999989 0.6182365000000019 T T T 0.1145917500000024 0.8933155699999986 0.1463037400000005 F F F 0.0893630400000021 0.8732870999999989 0.4632843699999967 F F F 0.3606957800000004 0.8690466199999989 0.2282152599999989 F F F 0.3478557400000000 0.8376330899999971 0.5393445999999997 T T T 0.6258711700000035 0.1704928300000006 0.3864501700000034 F F F 0.8705420100000012 0.0962057500000029 0.3079216100000011 F F F 0.8151802399999966 0.1214048100000014 0.6166482300000027 T T T 0.5977416699999978 0.3663031999999973 0.1482587899999999 F F F 0.6010947299999998 0.4219826200000014 0.4607059900000010 F F F 0.8479773800000032 0.3448511799999991 0.2292076199999968 F F F 0.8405022199999976 0.3532937299999972 0.5359098599999967 T T T 0.6332498700000002 0.6761186600000002 0.3848661700000022 F F F 0.8769394600000027 0.6019225300000031 0.3047956699999972 F F F 0.8187179299999983 0.6540830499999970 0.6492392400000000 T T T 0.6050482599999967 0.8668288100000012 0.1473211799999987 F F F 0.5911149200000025 0.9221748300000030 0.4629464599999977 F F F 0.8580749699999970 0.8476027999999971 0.2261560099999969 F F F 0.8435858200000013 0.8556436200000022 0.5443366599999990 T T T 0.9658824699999968 0.3856963300000018 0.6512424800000005 T T T 0.5438695799999991 0.2151659299999977 0.6469233099999983 T T T 0.5667131499999982 0.5143714499999987 0.6920697999999987 T T T 0.0725477100000020 0.0145142300000032 0.1030738700000029 F F F 0.0824622800000014 0.0280329499999965 0.4382101699999978 F F F 0.3024338999999969 0.2400541900000022 0.2681362100000015 F F F 0.2965143899999987 0.1855969900000005 0.5513776800000016 T T T 0.1553776000000013 0.2679734700000012 0.1073230599999988 F F F 0.1571473400000016 0.2758670799999976 0.4147112100000001 F F F 0.4191339200000002 0.4888735999999980 0.2676136299999996 F F F 0.3607447899999983 0.4351159100000004 0.5943561699999975 T T T 0.4661456700000031 0.3082203100000029 0.1838135400000027 F F F 0.4494048899999967 0.3742309200000022 0.4803828300000035 F F F 0.2236789299999984 0.4348042399999983 0.1941285400000012 F F F 0.2002409299999997 0.4075304400000022 0.5129231499999989 T T T 0.2683034699999993 0.0695546800000031 0.3560219599999996 F F F 0.1512620600000005 0.0685137899999972 0.6374451499999978 T T T 0.0149770200000034 0.1439956400000000 0.3358540199999993 F F F 0.8968098699999985 0.2296082299999966 0.6587469600000020 T T T 0.0517520900000008 0.5196328099999974 0.1094370799999993 F F F 0.0718634999999992 0.5263887600000032 0.4309946699999969 F F F 0.3092867800000008 0.7414533800000029 0.2679597500000028 F F F 0.3841250600000023 0.6887656500000006 0.5664223200000009 T T T 0.1667657699999978 0.7619147799999979 0.1063815999999989 F F F 0.1450087600000032 0.7775870700000027 0.4118527400000005 F F F 0.4227183100000005 0.9915449100000018 0.2680273100000008 F F F 0.3773783600000016 0.9455021300000013 0.5908273399999970 T T T 0.4775633900000003 0.8087001900000033 0.1853211399999992 F F F 0.4408045999999999 0.8695386200000002 0.4833655400000012 F F F 0.2344845900000010 0.9342799499999970 0.1918992000000017 F F F 0.1887051100000008 0.8584768699999969 0.5192421499999966 T T T 0.2780472999999972 0.5766674199999997 0.3581494399999983 F F F 0.0296936499999987 0.6416052100000016 0.3267133599999994 F F F 0.9174845200000021 0.5335426799999965 0.6799638700000017 T T T 0.5589368600000029 0.9871129100000005 0.1042425600000030 F F F 0.5765141799999967 0.0795601299999973 0.4412291000000010 F F F 0.8184022299999967 0.1942160799999968 0.2562180999999981 F F F 0.7864299399999979 0.2016185499999992 0.5562546000000026 T T T 0.6514638299999973 0.2361258399999997 0.1080056799999980 F F F 0.6597810299999978 0.3239929100000012 0.4099403600000002 F F F 0.8800490499999967 0.4441900599999968 0.2832873799999973 F F F 0.9273149599999968 0.4271992600000019 0.5856357299999999 T T T 0.9760881600000033 0.3286236900000006 0.1856241600000033 F F F 0.9474275800000029 0.3257971199999972 0.4868545300000022 F F F 0.7172371200000001 0.4046133599999990 0.1942782599999973 F F F 0.7074867999999981 0.4352645700000011 0.5142536899999968 T T T 0.7597740499999972 0.0968055399999983 0.3595579899999990 F F F 0.6679234300000019 0.0974561299999976 0.6497905800000012 T T T 0.5092300299999977 0.1852608200000034 0.3376517299999975 F F F 0.3932015000000035 0.1528061599999972 0.6609546399999999 T T T 0.5551692700000004 0.4883059599999982 0.1054498499999994 F F F 0.5888380900000030 0.5783305699999985 0.4377989999999983 F F F 0.8271269399999994 0.6949947199999968 0.2511591499999994 F F F 0.8460939400000029 0.7177654600000025 0.5846467799999999 T T T 0.6555797199999986 0.7351735200000036 0.1072418299999995 F F F 0.6494127500000033 0.8300284999999974 0.4106615399999995 F F F 0.8905374300000020 0.9439178000000013 0.2813038099999972 F F F 0.8884074899999987 0.9785126800000015 0.5933874700000032 T T T 0.9860759099999967 0.8339258199999975 0.1825967799999972 F F F 0.9376235699999995 0.8279052500000006 0.4857383100000021 F F F 0.7277440200000029 0.9088426499999969 0.1913639400000022 F F F 0.6946700399999983 0.9052311499999988 0.5190113900000028 T T T 0.7771897599999988 0.6213306399999965 0.3595076399999968 F F F 0.6699870200000007 0.5783423600000006 0.6439813000000001 T T T 0.5211553600000016 0.6807512500000001 0.3339470900000023 F F F 0.4188006700000031 0.5864895099999998 0.6789537599999989 T T T 0.5736075200000030 0.3459998800000008 0.6877833300000020 T T T 0.5381203499999998 0.2582609999999974 0.5786127699999994 T T T 0.8261819700000004 0.7743077599999992 0.6979323799999975 T T T 0.1220425500000033 0.3665696300000008 0.6740339099999986 T T T 0.1781274699999997 0.6440938000000003 0.6331527999999977 T T T 0.6077424400000027 0.5561839900000010 0.7576790800000026 T T T 0.3651436899999965 0.6929877500000003 0.8000613399999992 T T T 0.1041259799999992 0.1113708800000026 0.1071823500000022 F F F 0.2006990200000018 0.2971263600000000 0.0724617600000030 F F F 0.0969141799999989 0.6114100400000027 0.1094773100000026 F F F 0.2110129699999987 0.7874365099999991 0.0707804099999976 F F F 0.5933307100000036 0.0832416599999988 0.1079596599999988 F F F 0.6900741700000026 0.2633746699999975 0.0715026299999977 F F F 0.5936010200000013 0.5829439600000015 0.1082316700000021 F F F 0.6955628799999971 0.7611087299999966 0.0708259399999989 F F F 0.6161443599999998 0.2230056100000013 0.5563275800000014 T T T 0.0807428800000025 0.0114318500000010 0.6196282699999998 T T T 0.7669618700000029 0.8540177499999970 0.6943182500000020 T T T 0.1512271400000031 0.2706603099999967 0.6764950999999968 T T T 0.1355799600000012 0.6089904099999970 0.6678378300000034 T T T 0.7019417200000007 0.5413965300000001 0.7697528200000008 T T T 0.4537124100000014 0.6461877699999974 0.8017294799999988 T T T 0.3464037899999965 0.6935582600000032 0.7590868500000028 T T T 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00