No title 1.00000000000000 30.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 20.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.0000000000000000 C Si O N H 6 10 8 6 42 Direct 0.2179872299999985 0.5263256599999977 0.3307316499999970 0.2699528799999982 0.3961623300000028 0.2818711700000023 0.1397545100000031 0.4551231499999986 0.2319807299999965 0.6422095799999994 0.6394786099999976 0.4819742999999974 0.5456170599999979 0.5817821400000014 0.4830666800000003 0.5922670499999967 0.7765656799999974 0.4818211300000002 0.2719283699999977 0.4893605500000007 0.2888809700000010 0.1712810900000008 0.5348508399999972 0.2497619700000016 0.3633715300000020 0.5385379299999968 0.3649473400000005 0.4525661899999989 0.4741064399999999 0.3657503499999990 0.3777318799999989 0.4214443999999986 0.4893820699999978 0.6027172100000016 0.5756374300000004 0.4340390600000035 0.6398415600000007 0.7261143799999985 0.4371056700000011 0.6330295599999971 0.4230210200000002 0.4304189500000035 0.5681366000000025 0.3216297600000004 0.3600266600000026 0.5630399499999967 0.3675333699999968 0.5550608699999984 0.2845522599999981 0.5225745300000000 0.1911416800000012 0.3118721700000009 0.5096278600000019 0.3599004100000016 0.1957846700000019 0.5606436400000021 0.1554579100000026 0.1359358500000027 0.5960191699999982 0.2765903800000018 0.6004513800000026 0.5839164499999967 0.3243926299999984 0.6224024400000019 0.5008783099999974 0.4583097200000026 0.6355212799999990 0.7153825600000019 0.3266548499999971 0.6874885300000031 0.7674715200000009 0.4527827499999972 0.3981176400000024 0.4756309599999966 0.4065827499999983 0.3486187299999983 0.4592783000000011 0.5747884700000014 0.4745381700000024 0.5538407700000008 0.3719364000000027 0.5876932299999993 0.3708244600000015 0.4485336799999970 0.5982332399999990 0.3862830699999975 0.6419891700000022 0.6031878699999993 0.2589330699999977 0.3227658599999970 0.2063685099999972 0.4977330500000008 0.3892392099999995 0.2258008700000005 0.5771645100000029 0.3549342000000024 0.2589695100000000 0.5425606200000033 0.1604005200000032 0.2647971600000005 0.3732289000000009 0.3477593900000002 0.3016787299999990 0.3771906500000028 0.2550733300000019 0.2431767799999989 0.3790664100000001 0.2371582199999978 0.1132321700000034 0.4612840500000033 0.1819323300000022 0.1242216400000018 0.4373579900000024 0.2941514199999986 0.1621621600000012 0.4153245600000020 0.2083544500000016 0.1773071300000026 0.5837555499999993 0.1122168300000013 0.1075587899999988 0.5836413500000006 0.3026987399999967 0.3797701000000018 0.5585265799999988 0.2750127099999986 0.3622402700000009 0.5974240500000008 0.4260384700000017 0.4765761900000030 0.4216770600000004 0.4183665199999993 0.4546661700000030 0.4567808899999974 0.2689315000000008 0.3462464699999970 0.3722748400000029 0.4491236599999979 0.4171991300000002 0.3872101500000014 0.5286995900000022 0.3169956500000026 0.4757379899999989 0.5638550099999975 0.3646428600000036 0.4896425499999992 0.6188213000000005 0.4973965599999985 0.5687546099999992 0.3258745999999988 0.4803547300000020 0.5759642399999976 0.4318987999999990 0.6380698999999979 0.6410185399999975 0.5550496099999975 0.6762703099999996 0.6206531899999987 0.4695138200000031 0.6127506199999999 0.6262787799999998 0.3025901299999987 0.5457978000000026 0.5718068099999982 0.5552136499999989 0.5235363199999981 0.5448363799999996 0.4512902299999979 0.5311962700000024 0.6317559000000017 0.4722500999999966 0.5915211700000000 0.8270047299999987 0.4524493300000003 0.5943318400000024 0.7820904399999975 0.5547517299999996 0.5602053900000001 0.7523981499999977 0.4666205500000018 0.6435731799999971 0.7527573699999976 0.2887017199999988 0.6878174300000026 0.8025217900000001 0.4973989900000007 0.6445755700000007 0.4179545200000021 0.3336878400000032 0.6722065200000031 0.4026348800000008 0.4852028500000003 0.5263672099999965 0.2895932300000013 0.3929176099999978 0.5599807700000028 0.3644785199999987 0.2804498100000004 0.5258509299999972 0.4169235999999970 0.5612193999999988 0.5458171499999978 0.2981318000000002 0.5667460399999982 0.6048193600000005 0.4348744500000024 0.6569525900000031 0.6252469900000008 0.3571742000000029 0.6550790100000015 0.6278076600000020 0.2699821300000025 0.2785189700000004 0.6127441699999991 0.2211545199999989 0.3640171400000014 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00