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 0.8483395800000011 0.3070725800000034 0.0630080199999981 0.8488194899999968 0.3851423699999970 0.4447426899999982 0.0983121900000015 0.3070072300000035 0.1930279299999995 0.0985835800000032 0.3831621799999994 0.3179051299999998 0.8557865900000010 0.5411732199999975 0.4367337799999973 0.1037696699999984 0.5374916100000036 0.3074437000000003 0.8496958799999987 0.4587002000000027 0.0645239700000033 0.8450234399999985 0.2292887899999982 0.4422015099999967 0.0995927299999977 0.4584513300000026 0.1931324099999969 0.0948821899999999 0.2285416699999985 0.3139022100000020 0.3368898299999969 0.6583249099999975 0.5229394799999980 0.8487474699999993 0.3076648699999964 0.5645017200000026 0.8490907099999987 0.3835813199999976 0.9389940300000035 0.0988041700000011 0.3081610999999995 0.6938000299999985 0.0994694299999992 0.3864179500000020 0.8122906899999975 0.8498294199999989 0.5376886299999981 0.9485721200000015 0.1011958799999988 0.5416472300000024 0.8233813000000012 0.8500769899999980 0.4640231099999994 0.5626349500000032 0.8449840800000032 0.2284730499999981 0.9427351200000018 0.0992055600000015 0.4653609200000020 0.6934308900000019 0.0950824900000029 0.2293371199999967 0.8148538800000011 0.3483141099999969 0.3070565599999995 0.0630173200000002 0.3487020600000008 0.3853617500000013 0.4446458800000030 0.5983044700000022 0.3070237000000020 0.1929418200000015 0.5989179299999989 0.3831752399999999 0.3179058899999987 0.3542308199999979 0.5398967799999994 0.4339664700000014 0.6058079800000016 0.5383214000000009 0.3083867699999985 0.3502075600000012 0.4582156299999980 0.0662572800000021 0.3450024400000018 0.2291116500000001 0.4420351999999994 0.6007378299999999 0.4588396299999999 0.1940811099999991 0.5950545099999971 0.2286258099999969 0.3139272700000006 0.3485272100000003 0.3076528699999983 0.5641814100000033 0.3493605700000018 0.3836124099999978 0.9394182099999995 0.5985048900000010 0.3079152899999968 0.6935554599999989 0.5990167300000024 0.3858917700000006 0.8122457799999978 0.3489842299999992 0.5367049600000016 0.9514265500000008 0.5966586199999995 0.5399827700000017 0.8233924700000017 0.3490698499999993 0.4641523000000021 0.5628288200000000 0.3450296199999983 0.2284417700000034 0.9428018799999975 0.5994727200000014 0.4644362900000019 0.6924822399999968 0.5949935000000011 0.2292253299999985 0.8147740100000007 0.6028410600000029 0.6601102500000025 0.7400733300000013 0.3540212199999999 0.5931511200000017 0.5205311699999982 0.1114297100000030 0.5895880099999999 0.2116421200000005 0.3339806700000025 0.1778923299999988 0.5412016100000017 0.0836669999999984 0.1768985900000004 0.2159399000000022 0.3624610899999965 0.5886497600000027 0.0469361399999997 0.1274502999999996 0.5988190599999967 0.7526688800000016 0.3337911400000024 0.1769353099999975 0.0411121599999973 0.0839915500000004 0.1785499799999997 0.7144938499999967 0.8539669500000002 0.5938280399999982 0.5263600099999977 0.6143470499999992 0.5897836400000003 0.2111578800000018 0.8338089300000036 0.1781208700000008 0.5414774799999975 0.5839679700000033 0.1770232100000015 0.2158783499999970 0.8616336600000025 0.5895380999999986 0.0448651399999989 0.5951943099999966 0.5950134699999978 0.7434524999999965 0.8339030899999997 0.1769719699999968 0.0410475300000002 0.5838907899999981 0.1783482900000024 0.7146996099999967 0.0116821900000019 0.5934839800000020 0.1513141399999967 0.9331078900000023 0.1746955600000035 0.6015643400000030 0.1827019400000012 0.1732752500000032 0.1558635000000024 0.2623950400000012 0.5938149500000023 0.1062372700000012 0.0304698200000004 0.6225957799999975 0.7345235299999970 0.9328961399999969 0.1733747700000023 0.1011853400000007 0.1834281000000004 0.1749237900000011 0.6545757399999985 0.9407000200000013 0.6222023899999982 0.5197966200000010 0.5131222899999983 0.5939628100000007 0.1521244400000015 0.4331785299999993 0.1743966200000031 0.6013251999999980 0.6829342699999970 0.1734174999999993 0.1557396299999994 0.7618263700000014 0.5941824699999998 0.1050752499999987 0.4328180600000024 0.1733535199999992 0.1012083399999995 0.6832530699999992 0.1748358400000001 0.6546808800000008 0.4366066700000033 0.7457016500000009 0.6542458799999977 0.4669398300000012 0.6850067100000032 0.6314435500000002 0.8043748099999988 0.6746618800000022 0.7205669700000001 0.3610451500000025 0.6791494799999995 0.3858408199999985 0.5571467700000028 0.6801824100000005 0.8759845299999967 0.1310079100000010 0.6684983900000034 0.5497439600000007 0.4152192299999982 0.7836898600000026 0.6776013100000000 0.5937630600000006 0.7454514100000011 0.5110450299999982 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00