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 0.8490750699999978 0.3076383200000024 0.0627582099999984 0.8496347999999969 0.3852164299999998 0.4444813400000029 0.0990034399999971 0.3073638199999991 0.1926716500000012 0.0989648400000007 0.3834770899999995 0.3175670500000010 0.8573834000000033 0.5416837499999971 0.4374924999999976 0.1039910100000014 0.5378275799999983 0.3070676700000021 0.8482127600000027 0.4588419700000017 0.0660759499999983 0.8454416200000026 0.2297189599999996 0.4421245999999996 0.0995836600000004 0.4586423200000027 0.1925126499999976 0.0952505300000013 0.2289767299999994 0.3138367900000034 0.3385434699999976 0.6608199900000002 0.5196303800000024 0.8495331100000030 0.3079649299999971 0.5648835800000001 0.8494292199999975 0.3842970299999990 0.9392112399999988 0.0992977000000010 0.3089319799999970 0.6942762799999969 0.1000301099999987 0.3873202500000019 0.8130271500000035 0.8508016899999973 0.5371124899999984 0.9496950699999971 0.1007353700000024 0.5420835999999980 0.8236913200000018 0.8508953099999985 0.4641931000000028 0.5609427199999999 0.8454600700000015 0.2289820399999982 0.9425856200000027 0.1001371600000027 0.4660280100000023 0.6918185800000032 0.0955967200000032 0.2300449600000007 0.8149425399999970 0.3491041099999990 0.3076273699999987 0.0628353600000011 0.3496090599999988 0.3851749800000022 0.4436579799999976 0.5991459500000005 0.3077772700000025 0.1926683100000020 0.6001863099999980 0.3837082100000018 0.3181224699999987 0.3550203699999983 0.5420722799999993 0.4345069199999969 0.6064845599999984 0.5398318399999980 0.3103144199999974 0.3524417200000016 0.4588283100000012 0.0678214300000022 0.3452471800000012 0.2294836100000026 0.4419431000000031 0.6017745199999993 0.4599178499999965 0.1966080899999980 0.5953997299999969 0.2293562199999997 0.3139249099999972 0.3488443899999965 0.3078101300000000 0.5646764899999965 0.3504012100000011 0.3844651499999969 0.9398281400000030 0.5991262599999985 0.3083696400000022 0.6935772699999987 0.5998637200000019 0.3864245199999985 0.8122292400000006 0.3500316299999966 0.5368108899999982 0.9516667899999973 0.5990579699999969 0.5399117400000009 0.8233297900000025 0.3506438900000006 0.4644964700000003 0.5616946399999989 0.3455679400000022 0.2289698200000032 0.9427100600000031 0.6010751800000023 0.4646289499999980 0.6917857099999978 0.5954540500000007 0.2296904700000013 0.8147431499999982 0.5985750199999984 0.6600431399999991 0.7440276100000034 0.3623765000000034 0.5965745499999997 0.5142044099999978 0.1121975900000010 0.5895893200000017 0.2100872800000033 0.3344759699999997 0.1780295599999988 0.5406480400000007 0.0841461400000014 0.1772268799999992 0.2159751900000018 0.3640901699999972 0.5890804300000028 0.0464750599999988 0.1267589400000020 0.6031264100000016 0.7762967700000019 0.3343242099999983 0.1773968299999993 0.0410431299999985 0.0844957600000029 0.1793618000000023 0.7141330899999971 0.8623220599999968 0.5924667199999973 0.5340094299999976 0.6144497299999969 0.5910712499999988 0.2121484800000033 0.8342362200000011 0.1783435700000027 0.5410217000000017 0.5845534500000014 0.1776567400000033 0.2159156100000033 0.8617403599999989 0.5897551799999974 0.0437725800000024 0.5971007699999973 0.5956391499999967 0.7449259300000008 0.8344342999999981 0.1774129300000027 0.0409118899999967 0.5843428100000025 0.1788065399999965 0.7144989600000002 0.0124594700000031 0.5937254800000034 0.1499181900000011 0.9334252499999991 0.1751495899999966 0.6012527199999980 0.1831495300000014 0.1737511299999994 0.1558255400000021 0.2633681300000035 0.5937583500000017 0.1058181699999992 0.0730041400000019 0.6239612899999969 0.7105340999999967 0.9333920699999965 0.1738910300000001 0.1011062899999970 0.1840057300000026 0.1757002399999976 0.6543061100000003 0.9464537599999971 0.6214957400000003 0.5253814900000009 0.5142302100000009 0.5944216199999985 0.1517394400000001 0.4335456000000022 0.1746871499999969 0.6008960200000004 0.6835006600000000 0.1741176499999995 0.1557310099999967 0.7629339400000035 0.5941085099999981 0.1047109100000014 0.4333372999999980 0.1739808600000003 0.1012142299999965 0.6836807700000023 0.1754114100000024 0.6544326900000002 0.4383490199999969 0.7510055600000030 0.6534410000000008 0.4499295500000002 0.6862840800000001 0.6438404199999965 0.7935747000000006 0.6788873300000020 0.7199394100000021 0.2920833900000019 0.6775207299999977 0.3816401699999972 0.5481162800000021 0.6802301399999990 0.8782864599999982 0.1349072300000032 0.6673338800000010 0.5731237899999968 0.4343326600000026 0.7895091700000023 0.6614360299999973 0.5681625799999992 0.6914013000000025 0.4896447699999982 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00