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 0.8478197600000001 0.3066571800000020 0.0634023699999986 0.8480708600000000 0.3850171899999992 0.4447577999999979 0.0976624099999981 0.3066888700000021 0.1932343399999965 0.0979905100000025 0.3829133699999971 0.3180649399999993 0.8536572800000002 0.5407197899999971 0.4348470899999981 0.1032982799999971 0.5370925000000000 0.3085681199999968 0.8491486499999965 0.4579109100000025 0.0651052699999966 0.8441807199999971 0.2288421000000014 0.4419935299999977 0.0990691399999974 0.4581138699999983 0.1930903200000031 0.0942375899999988 0.2281999400000032 0.3142365599999977 0.3465290299999992 0.6574655000000007 0.5209567500000034 0.8476684099999972 0.3073146199999996 0.5642027999999968 0.8490559199999979 0.3830311600000016 0.9389984900000030 0.0977522900000025 0.3073820299999994 0.6931518900000029 0.0989096300000014 0.3852710000000030 0.8119449200000020 0.8491546699999972 0.5366450000000000 0.9491696500000018 0.0978334699999976 0.5406992899999992 0.8225908200000021 0.8497069900000014 0.4638495299999974 0.5628791600000014 0.8441377799999970 0.2280919100000034 0.9427803999999966 0.0986547600000023 0.4639065699999989 0.6930814700000028 0.0941379900000001 0.2288685099999981 0.8149898200000010 0.3475884300000018 0.3066141899999977 0.0634251899999967 0.3483948499999983 0.3847763300000011 0.4444100099999986 0.5976808100000000 0.3065506299999967 0.1930106200000026 0.5984762699999990 0.3827650599999970 0.3177048399999975 0.3554287899999977 0.5392127699999989 0.4334611499999994 0.6053464299999973 0.5368634299999968 0.3071481200000008 0.3487187500000033 0.4578320299999987 0.0655507800000024 0.3443536199999997 0.2287452500000029 0.4419510700000018 0.5994917399999977 0.4579011200000025 0.1925531899999982 0.5942884099999972 0.2280594599999972 0.3139876799999968 0.3478011300000006 0.3071854000000016 0.5642377900000000 0.3484399700000012 0.3830096599999990 0.9392222900000036 0.5977827000000033 0.3073823300000029 0.6932831499999992 0.5987532199999990 0.3851814100000013 0.8125561299999973 0.3475008899999992 0.5365040200000024 0.9500231099999965 0.5968591900000035 0.5391962899999996 0.8242230800000030 0.3492025099999978 0.4632330199999970 0.5637458100000003 0.3439804499999966 0.2280503599999975 0.9428515299999987 0.5996196700000027 0.4635943600000019 0.6926785499999966 0.5940740799999986 0.2288577799999985 0.8151225900000014 0.6046626700000033 0.6582191800000032 0.7410577200000006 0.3639635600000020 0.5935029799999967 0.5181665499999966 0.1114674800000017 0.5895081199999979 0.2128938000000034 0.3333338300000008 0.1776230899999973 0.5415944399999972 0.0831656200000026 0.1765526300000033 0.2160435099999987 0.3606760199999997 0.5885618499999978 0.0460087499999986 0.1127478399999973 0.5958080500000023 0.7427061899999998 0.3331278400000031 0.1764284500000031 0.0411047999999994 0.0833641500000013 0.1778629300000034 0.7150023499999989 0.8425259500000024 0.5957820699999985 0.5170538100000002 0.6136233900000008 0.5887302800000001 0.2102529699999991 0.8333224200000018 0.1777822600000007 0.5418132599999979 0.5833623799999970 0.1763780799999992 0.2158837200000008 0.8620773000000028 0.5890779100000003 0.0443603399999972 0.5910911799999994 0.5941815500000018 0.7426515300000034 0.8333847199999980 0.1764888399999975 0.0410950500000027 0.5832816100000002 0.1778890799999999 0.7150441200000017 0.0117938200000012 0.5930803999999981 0.1525979700000022 0.9325772500000014 0.1745264600000027 0.6020093599999967 0.1821613600000020 0.1730885500000028 0.1558819799999966 0.2612277699999979 0.5931285599999967 0.1060553200000030 0.0161446600000019 0.6220598999999964 0.7390923999999970 0.9322473300000027 0.1731512699999982 0.1014392800000010 0.1826634700000014 0.1745350500000029 0.6548947499999969 0.9397919500000000 0.6208079000000026 0.5187456900000029 0.5125038400000008 0.5928079099999977 0.1511978300000010 0.4324895900000030 0.1743587699999978 0.6018421799999985 0.6822521400000028 0.1729769499999989 0.1555926699999972 0.7621336600000035 0.5930759499999994 0.1046004999999965 0.4321516999999986 0.1729999300000031 0.1012719799999999 0.6825969100000009 0.1746190300000023 0.6549145800000034 0.4582228900000018 0.7252944999999968 0.6401919400000011 0.4709743800000012 0.6845188699999980 0.6329874099999984 0.8079080199999993 0.6721825999999993 0.7211888499999972 0.3916252200000017 0.6799858199999989 0.3870730100000017 0.5617246400000013 0.6810751100000019 0.8749658099999991 0.1413787199999987 0.6706476499999994 0.5379947899999991 0.4207897400000036 0.7933082500000026 0.6682653100000024 0.5790475900000018 0.7956317499999983 0.5655215800000022 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00