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 0.1227082099999990 0.1310030100000006 0.3862242800000004 F F F 0.3683773599999967 0.1249015599999979 0.3073600199999973 F F F 0.3025062199999979 0.0892359899999988 0.6091219199999998 T T T 0.0950874199999987 0.3984464799999969 0.1498847699999999 F F F 0.0880832599999977 0.3829005799999976 0.4627756699999992 F F F 0.3461266799999976 0.3717884799999993 0.2288379599999999 F F F 0.3415503100000024 0.3490674000000027 0.5370119800000026 T T T 0.1235135200000030 0.6321274700000004 0.3821824099999986 F F F 0.3742701999999980 0.6251974600000025 0.3068705299999976 F F F 0.3138154999999969 0.5967116400000023 0.6131846199999984 T T T 0.1081740799999977 0.8969611600000036 0.1467917800000009 F F F 0.0829453699999974 0.8769326899999967 0.4637724099999971 F F F 0.3542781100000028 0.8726922099999967 0.2287032999999994 F F F 0.3393150200000008 0.8424470200000016 0.5384874100000019 T T T 0.6194534999999988 0.1741384199999985 0.3869382099999967 F F F 0.8641243400000036 0.0998513400000007 0.3084096500000015 F F F 0.8095905999999999 0.1247212000000033 0.6178662200000034 T T T 0.5913240000000002 0.3699487900000022 0.1487468300000003 F F F 0.5946770600000022 0.4256282099999993 0.4611940300000015 F F F 0.8415597099999985 0.3484967699999970 0.2296956599999973 F F F 0.8327125899999999 0.3543161899999987 0.5361978600000015 T T T 0.6268322000000026 0.6797642499999981 0.3853542100000027 F F F 0.8705217899999980 0.6055681200000009 0.3052837099999977 F F F 0.8137725599999968 0.6607589600000026 0.6540426099999976 T T T 0.5986305899999991 0.8704743999999991 0.1478092199999992 F F F 0.5846972499999978 0.9258204200000009 0.4634344999999982 F F F 0.8516572999999994 0.8512483900000021 0.2266440499999973 F F F 0.8345050000000001 0.8567538900000002 0.5455577899999966 T T T 0.9635989399999971 0.3903912299999988 0.6507981900000033 T T T 0.5396416099999968 0.2235329399999983 0.6531568300000004 T T T 0.6117052199999975 0.4943318199999993 0.7212440599999965 T T T 0.0661300399999973 0.0181598200000010 0.1035619100000034 F F F 0.0760446099999967 0.0316785400000015 0.4386982099999983 F F F 0.2960162299999993 0.2436997800000000 0.2686242500000020 F F F 0.3041559199999995 0.1875084200000003 0.5521432199999978 T T T 0.1489599299999966 0.2716190599999990 0.1078110999999993 F F F 0.1507296699999969 0.2795126700000026 0.4151992500000006 F F F 0.4127162500000026 0.4925191900000030 0.2681016700000001 F F F 0.3509494199999992 0.4409889599999985 0.5949559199999968 T T T 0.4597279999999984 0.3118659000000008 0.1843015800000032 F F F 0.4429872199999991 0.3778765100000001 0.4808708699999968 F F F 0.2172612600000008 0.4384498300000033 0.1946165800000017 F F F 0.1926673299999990 0.4056729500000031 0.5142211799999998 T T T 0.2618858000000017 0.0732002700000010 0.3565100000000001 F F F 0.1494768000000022 0.0735383700000014 0.6368588799999984 T T T 0.0085593499999987 0.1476412299999978 0.3363420599999998 F F F 0.8959400999999971 0.2332336999999995 0.6584728400000017 T T T 0.0453344200000032 0.5232784000000024 0.1099251199999998 F F F 0.0654458300000016 0.5300343500000011 0.4314827099999974 F F F 0.3028691100000032 0.7450989700000008 0.2684477900000033 F F F 0.3685718699999967 0.6874443999999968 0.5588945800000005 T T T 0.1603481000000002 0.7655603700000029 0.1068696399999993 F F F 0.1385910899999985 0.7812326600000006 0.4123407800000010 F F F 0.4163006400000029 0.9951904999999996 0.2685153500000013 F F F 0.3730795499999999 0.9441833300000013 0.5919866799999980 T T T 0.4711457200000027 0.8123457800000011 0.1858091799999997 F F F 0.4343869300000023 0.8731842099999980 0.4838535800000017 F F F 0.2280669200000034 0.9379255400000019 0.1923872400000022 F F F 0.1805793400000013 0.8708346000000020 0.5199653600000005 T T T 0.2716296299999996 0.5803130099999976 0.3586374799999987 F F F 0.0232759800000011 0.6452507999999995 0.3272013999999999 F F F 0.9274233800000005 0.5444967600000012 0.6782159799999974 T T T 0.5525191899999982 0.9907584999999983 0.1047306000000034 F F F 0.5700965099999991 0.0832057200000023 0.4417171400000015 F F F 0.8119845599999991 0.1978616700000018 0.2567061399999986 F F F 0.7797351999999975 0.2022965299999981 0.5567812199999977 T T T 0.6450461599999997 0.2397714299999976 0.1084937199999985 F F F 0.6533633600000002 0.3276384999999991 0.4104284000000007 F F F 0.8736313799999991 0.4478356500000018 0.2837754199999978 F F F 0.9157706299999973 0.4308370899999971 0.5861785999999967 T T T 0.9696704899999986 0.3322692799999984 0.1861121999999966 F F F 0.9410099099999982 0.3294427100000021 0.4873425700000027 F F F 0.7108194500000025 0.4082589499999969 0.1947662999999977 F F F 0.7007709499999990 0.4376903799999994 0.5145924099999988 T T T 0.7533563799999996 0.1004511300000033 0.3600460299999995 F F F 0.6645156100000023 0.1056525300000004 0.6531910300000021 T T T 0.5028123600000001 0.1889064100000013 0.3381397699999980 F F F 0.3906192500000003 0.1521966999999975 0.6629146100000014 T T T 0.5487516000000028 0.4919515500000031 0.1059378899999999 F F F 0.5824204199999983 0.5819761599999964 0.4382870399999987 F F F 0.8207092700000018 0.6986403100000018 0.2516471899999999 F F F 0.8235662700000006 0.7199783100000019 0.5874665099999987 T T T 0.6491620500000010 0.7388191100000014 0.1077298700000000 F F F 0.6429950799999986 0.8336740900000024 0.4111495800000000 F F F 0.8841197599999973 0.9475633899999991 0.2817918499999976 F F F 0.8804790800000006 0.9797785700000006 0.5947897699999984 T T T 0.9796582399999991 0.8375714100000025 0.1830848199999977 F F F 0.9312059000000019 0.8315508399999985 0.4862263500000026 F F F 0.7213263499999982 0.9124882400000018 0.1918519800000027 F F F 0.6877734400000008 0.9083858300000003 0.5194232799999980 T T T 0.7707720900000012 0.6249762300000015 0.3599956799999973 F F F 0.6673797199999996 0.5837184800000017 0.6657884199999984 T T T 0.5147376899999969 0.6843968399999980 0.3344351300000028 F F F 0.4018138799999988 0.6158507999999969 0.6715825899999999 T T T 0.5557230499999974 0.3452062799999993 0.6992905199999981 T T T 0.5401219299999980 0.2782672100000028 0.5864231600000025 T T T 0.8372049800000028 0.7860054200000022 0.7000436900000011 T T T 0.1205862400000015 0.3691067700000019 0.6723704600000033 T T T 0.1560142499999984 0.6488761199999971 0.6223036100000030 T T T 0.7414083000000034 0.4529724799999997 0.7640346100000031 T T T 0.5039314899999994 0.5743351799999985 0.7651962400000016 T T T 0.0977083100000016 0.1150164700000005 0.1076703900000027 F F F 0.1942813499999971 0.3007719499999979 0.0729498000000035 F F F 0.0904965100000013 0.6150556300000005 0.1099653500000031 F F F 0.2045953000000011 0.7910820999999970 0.0712684499999980 F F F 0.5869130399999989 0.0868872499999966 0.1084476999999993 F F F 0.6836564999999979 0.2670202600000025 0.0719906699999981 F F F 0.5871833499999966 0.5865895499999993 0.1087197100000026 F F F 0.6891452099999995 0.7647543200000015 0.0713139799999993 F F F 0.6111562399999997 0.2333246399999993 0.5632343700000035 T T T 0.0794241600000021 0.0163326200000000 0.6186614800000001 T T T 0.7735988199999966 0.8626664599999998 0.6976368799999975 T T T 0.1478211499999986 0.2723070500000020 0.6736910899999984 T T T 0.1076505200000000 0.6183161200000029 0.6564966700000028 T T T 0.8147473000000005 0.5200278399999974 0.7665731600000001 T T T 0.5388128000000023 0.5709391999999980 0.8039840200000015 T T T 0.3685096600000008 0.6621937700000018 0.7051773100000034 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