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 0.2182748299999986 0.5263052800000025 0.3311820899999987 0.2702570399999971 0.3961269899999991 0.2823916700000026 0.1400546899999995 0.4550723600000026 0.2324635200000031 0.6426916100000000 0.6399482300000017 0.4814270199999982 0.5479319100000026 0.5828661400000001 0.4872767700000011 0.5919841099999985 0.7766104499999997 0.4813602199999991 0.2722118300000034 0.4893247799999969 0.2893981100000005 0.1715955399999984 0.5347900399999972 0.2502085400000027 0.3635941499999973 0.5386055499999998 0.3652909300000005 0.4517547499999992 0.4733293500000002 0.3642043600000022 0.3778786700000012 0.4211869900000025 0.4901910800000024 0.6037454800000006 0.5762565699999982 0.4345260500000023 0.6396123999999972 0.7263172099999977 0.4365137099999998 0.6327741899999992 0.4229177799999988 0.4299376999999964 0.5678886000000034 0.3215740500000024 0.3594944999999967 0.5627033299999979 0.3675070999999974 0.5545299899999989 0.2847881300000026 0.5223021899999978 0.1915062400000025 0.3120909599999990 0.5097237299999975 0.3603019399999994 0.1960824800000012 0.5607441800000004 0.1559643100000017 0.1362285100000022 0.5958637700000011 0.2772334100000009 0.5996116399999991 0.5842215500000023 0.3249078999999995 0.6223557100000008 0.5008545199999972 0.4577767399999999 0.6352205700000013 0.7153719100000018 0.3261111300000010 0.6871796399999965 0.7676690400000012 0.4522162900000026 0.3978653500000036 0.4752295700000033 0.4072259300000027 0.3488320399999978 0.4591640900000016 0.5755107900000027 0.4706383899999977 0.5548817299999982 0.3657393900000017 0.5874072900000016 0.3708841699999965 0.4481386799999996 0.5981000499999993 0.3863382799999968 0.6412506799999989 0.6028033500000021 0.2588322399999967 0.3220274099999969 0.2066741300000032 0.4976838400000005 0.3896674200000021 0.2261447200000006 0.5771337999999986 0.3553557199999986 0.2592901599999990 0.5425123200000002 0.1607975000000010 0.2650951199999980 0.3731117000000026 0.3482104799999988 0.3019737099999986 0.3770801699999993 0.2556303000000000 0.2434833499999982 0.3790418900000034 0.2376887599999975 0.1135398400000014 0.4612696499999984 0.1824171700000008 0.1245157600000013 0.4373466500000021 0.2946558300000035 0.1624551800000020 0.4152548200000012 0.2088661800000011 0.1775635899999983 0.5837402100000020 0.1126980100000026 0.1078423499999985 0.5834844199999978 0.3032697399999975 0.3800091499999994 0.5584585900000008 0.2755220900000026 0.3625899700000019 0.5973274500000016 0.4265229700000006 0.4768603600000034 0.4225868500000018 0.4181717100000029 0.4548129900000006 0.4553564599999973 0.2677772600000026 0.3465442999999979 0.3721625800000012 0.4496539399999975 0.4175246499999972 0.3871666499999975 0.5290580400000024 0.3172427200000030 0.4757044999999991 0.5643060900000023 0.3648962099999977 0.4896405900000005 0.6193477300000012 0.4965807299999980 0.5678823100000017 0.3255658599999975 0.4754516599999974 0.5765617699999979 0.4264452700000021 0.6378298699999974 0.6410033200000029 0.5543132000000028 0.6765986300000009 0.6210718399999990 0.4690840299999977 0.6122674200000020 0.6261290899999992 0.3022398199999969 0.5469260599999970 0.5729380100000014 0.5592297399999993 0.5285390199999966 0.5430534799999975 0.4555686200000011 0.5317779399999978 0.6312406199999998 0.4729798199999991 0.5912310499999975 0.8270353200000002 0.4519359100000031 0.5940265099999991 0.7821721500000010 0.5542960900000011 0.5598992600000017 0.7525194700000029 0.4661662999999976 0.6432615599999991 0.7527619500000000 0.2881714600000009 0.6875193500000023 0.8026429000000022 0.4968985200000020 0.6442601600000017 0.4180654299999986 0.3332587399999980 0.6719537500000001 0.4027722100000020 0.4848095600000022 0.5261385599999997 0.2897098099999980 0.3924749600000013 0.5597003700000016 0.3645107500000009 0.2801564199999973 0.5255916999999997 0.4170041300000022 0.5613380599999971 0.5455328800000032 0.2981125000000020 0.5663637600000015 0.6044783099999975 0.4348511000000030 0.6565385399999997 0.6249905499999997 0.3572306599999990 0.6547110300000014 0.6274989300000016 0.2700494700000036 0.2779273200000034 0.6124080299999974 0.2211016400000005 0.3634110599999971 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00