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 0.2028573099999988 0.5291694900000010 0.3049411000000006 0.2542101299999970 0.3983046500000000 0.2570710099999971 0.1240638399999980 0.4581169699999990 0.2070500499999994 0.6577446800000004 0.6375294300000007 0.5071646099999967 0.5610042200000009 0.5787688400000022 0.5090232200000031 0.6075994600000030 0.7742985399999966 0.5060224799999986 0.2564838999999992 0.4914296899999968 0.2631736800000013 0.1559390800000031 0.5375344999999996 0.2244518799999966 0.3481222799999983 0.5413446700000009 0.3397162400000013 0.4373538800000034 0.4767003299999999 0.3410985100000019 0.3624681699999996 0.4242072699999966 0.4642160799999999 0.6183357500000000 0.5731308900000016 0.4602079399999965 0.6554721400000005 0.7241305900000015 0.4616730899999979 0.6487428499999979 0.4206597100000025 0.4565125000000023 0.5834272700000014 0.3195785500000028 0.3852417399999979 0.5785099400000036 0.3639807799999986 0.5801900900000021 0.2687908899999982 0.5233713499999979 0.1644968100000028 0.2968566099999990 0.5117274199999997 0.3332756900000007 0.1800153300000034 0.5631901499999969 0.1297671000000022 0.1209104599999975 0.5985022300000011 0.2532280799999995 0.6159266200000033 0.5809468300000020 0.3504332899999980 0.6385860500000007 0.4986584899999968 0.4847298199999983 0.6525160799999981 0.7122800400000031 0.3512214699999987 0.7025718499999982 0.7666181800000018 0.4775089399999999 0.3830128299999984 0.4788582500000018 0.3821211599999970 0.3328407300000009 0.4614701400000030 0.5494498199999995 0.4598320099999995 0.5560584999999989 0.3477494699999966 0.6032000399999973 0.3685358299999990 0.4738769000000005 0.6133319999999998 0.3833145500000015 0.6674511800000005 0.6181488699999989 0.2566510500000021 0.3472887100000008 0.1910517800000022 0.5011652900000030 0.3637459999999990 0.2107025299999989 0.5801305999999968 0.3285154100000014 0.2435340500000009 0.5450626100000022 0.1347308300000023 0.2489187199999989 0.3753018199999971 0.3228601300000022 0.2858702600000029 0.3790265000000019 0.2303727299999991 0.2274169900000018 0.3814485300000001 0.2122659300000009 0.0976453199999980 0.4648079400000000 0.1568853799999985 0.1083098000000007 0.4407898500000016 0.2692389899999981 0.1461026699999977 0.4178395699999982 0.1834963700000003 0.1614535399999966 0.5869883200000032 0.0871874899999980 0.0922104200000007 0.5854478999999984 0.2782018199999996 0.3648006000000024 0.5618170700000036 0.2504042699999971 0.3463972300000009 0.6000183700000008 0.4009241299999999 0.4610338399999989 0.4235898199999966 0.3929766899999976 0.4391679399999973 0.4596558900000005 0.2443222100000000 0.3311409800000007 0.3751483799999988 0.4232174799999981 0.4018971400000027 0.3898718000000017 0.5033217399999970 0.3012569200000002 0.4775038300000034 0.5377794400000013 0.3484681500000022 0.4927004700000026 0.5931857799999989 0.4824564299999992 0.5712887999999978 0.3009312000000008 0.4656727799999985 0.5785851799999975 0.4069827499999974 0.6540131699999989 0.6391433599999985 0.5803347000000016 0.6918278599999965 0.6190650300000016 0.4939164399999996 0.6283717299999978 0.6229761100000033 0.3280397500000021 0.5607456899999974 0.5694338999999999 0.5813115699999969 0.5391087200000015 0.5414342500000018 0.4775406400000008 0.5463220500000006 0.6284473300000002 0.4973064200000010 0.6067170099999970 0.8248706700000028 0.4771638699999983 0.6101162000000002 0.7796542199999976 0.5789404000000005 0.5753863799999976 0.7502480200000008 0.4918560799999980 0.6598549300000016 0.7499475300000000 0.3132468100000025 0.7029590499999969 0.8005258900000030 0.5233971899999972 0.6602596899999966 0.4155947100000006 0.3597795100000027 0.6877948699999976 0.3997118599999965 0.5112955499999998 0.5415956200000025 0.2880408600000024 0.4182093599999988 0.5753816699999987 0.3624200699999989 0.3055283500000030 0.5406599000000014 0.4122941199999985 0.5868009100000009 0.5620504600000018 0.2940450600000020 0.5914262300000033 0.6198708699999997 0.4322960499999979 0.6812544900000006 0.6405920199999997 0.3547718299999971 0.6806972999999985 0.6423728999999980 0.2672336500000014 0.3023638900000023 0.6272937499999998 0.2178921699999989 0.3874994199999975 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00