No title 1.00000000000000 7.6631000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 25.3262000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 10.8372600000000006 Si O H N F 42 16 15 1 6 Direct 0.8496327800000003 0.3079133299999981 0.0625913299999965 0.8502270199999984 0.3852373400000033 0.4444038700000021 0.0995603000000003 0.3076235999999994 0.1926286500000032 0.0998391700000028 0.3835819999999970 0.3179190099999971 0.8605675900000023 0.5426326999999986 0.4394875300000010 0.1042688699999985 0.5379326199999994 0.3050137199999980 0.8486950899999997 0.4589089500000014 0.0661391699999996 0.8459040799999968 0.2299599700000030 0.4422743499999982 0.0997726599999993 0.4587343199999978 0.1929074399999990 0.0956517500000018 0.2291818699999979 0.3136468699999995 0.3523159399999969 0.6590869999999995 0.5171646000000010 0.8501017899999965 0.3081788200000020 0.5651757199999992 0.8497761100000005 0.3845250700000022 0.9386962700000012 0.0999681199999998 0.3095855099999980 0.6946035599999973 0.1007401700000017 0.3882856999999973 0.8127487699999989 0.8521486300000021 0.5376625600000011 0.9511527200000032 0.1033728900000028 0.5433706199999975 0.8207479000000006 0.8511942499999989 0.4642967300000009 0.5605906799999971 0.8459874400000018 0.2292673899999969 0.9425901600000017 0.1013613900000010 0.4668938299999965 0.6905767100000020 0.0962190099999987 0.2304627500000009 0.8149446600000019 0.3495280799999989 0.3079452699999976 0.0626655000000014 0.3500128200000034 0.3854300699999982 0.4441465800000017 0.5995864499999968 0.3080893799999984 0.1925427700000029 0.6003900999999985 0.3839942500000006 0.3183689099999967 0.3532651299999969 0.5412160099999994 0.4347483399999987 0.6085430700000032 0.5414599300000020 0.3107896699999984 0.3534263800000019 0.4587976099999977 0.0686180800000002 0.3455516200000019 0.2297734100000000 0.4421176099999968 0.6028305099999969 0.4606963000000022 0.1983029900000020 0.5958024299999991 0.2296561599999976 0.3138744800000026 0.3491472899999977 0.3081608800000026 0.5645347299999983 0.3508294900000024 0.3847530500000005 0.9396666399999987 0.5993243599999971 0.3087131799999980 0.6935675599999982 0.5999750200000022 0.3868227700000020 0.8123097900000005 0.3537198200000020 0.5370616100000021 0.9534694099999967 0.6007112500000034 0.5416210400000026 0.8189686400000014 0.3514255199999994 0.4643476899999968 0.5603226599999971 0.3462235100000015 0.2292640699999993 0.9427364599999990 0.6010733099999968 0.4650887000000026 0.6909350500000002 0.5959958799999967 0.2299750900000035 0.8145969300000004 0.5880082600000023 0.6630280500000012 0.7455430300000003 0.3377679900000032 0.5919717100000028 0.5245628300000007 0.1129354300000003 0.5895173999999983 0.2083537800000030 0.3348889299999982 0.1782190899999989 0.5403898499999968 0.0845954799999973 0.1774471000000020 0.2159216599999993 0.3640518799999981 0.5893129700000017 0.0469126099999997 0.1099784299999982 0.6044975399999970 0.7801103199999986 0.3348619499999970 0.1777618300000015 0.0410704299999978 0.0849617399999971 0.1799354099999988 0.7138886500000012 0.8752503799999971 0.5908180599999966 0.5394273799999993 0.6170007699999971 0.5913298600000019 0.2097484199999968 0.8346319999999992 0.1784970300000026 0.5407679500000029 0.5850109000000003 0.1780205100000032 0.2158461799999998 0.8612893399999990 0.5900540900000024 0.0443487300000029 0.5941425299999992 0.5972138099999995 0.7443552399999973 0.8348730299999971 0.1777566700000008 0.0408948700000025 0.5848195800000013 0.1791649399999997 0.7143254100000007 0.0124985200000012 0.5942810399999985 0.1490331700000027 0.9337798299999989 0.1752836499999972 0.6010099699999998 0.1835958300000016 0.1738779699999995 0.1558003999999968 0.2635978499999965 0.5941862800000024 0.1067791999999983 0.1115438900000001 0.6258320199999972 0.7021998199999970 0.9338907300000017 0.1740610900000021 0.1009719999999987 0.1845238300000034 0.1760334000000014 0.6541797400000036 0.9496939200000014 0.6224533700000023 0.5308605499999999 0.5147194700000028 0.5956372200000004 0.1518342000000032 0.4339577100000014 0.1747387200000006 0.6005638600000012 0.6840144700000010 0.1744002599999988 0.1557313599999972 0.7622059500000020 0.5947016800000000 0.1057338299999984 0.4338594399999991 0.1742222999999967 0.1012150899999966 0.6841407300000029 0.1755725900000016 0.6543045599999999 0.4369274499999989 0.7530704899999989 0.6540563399999968 0.4424632799999983 0.6889980799999975 0.6460193599999968 0.7839838100000023 0.6809277999999992 0.7189786499999968 0.2664089800000013 0.6831237299999984 0.3928063999999978 0.5464670900000002 0.6790514899999991 0.8852693700000032 0.1409089100000003 0.6616572699999992 0.5853294699999978 0.4368308499999998 0.7919237500000023 0.6594240599999992 0.5522944399999972 0.6596648599999995 0.4523961900000018 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00