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 0.2027887300000017 0.5291507399999986 0.3052453800000023 0.2543124999999975 0.3984876600000007 0.2569413000000011 0.1241067400000020 0.4580438200000003 0.2069619099999969 0.6577322699999968 0.6372515799999974 0.5071130299999993 0.5610655500000021 0.5788403900000034 0.5087068200000004 0.6076680899999971 0.7741088300000030 0.5063812400000032 0.2564453099999966 0.4916496000000024 0.2633975099999972 0.1559688999999977 0.5375887300000031 0.2246626000000020 0.3480281000000005 0.5414317099999977 0.3397578900000013 0.4372561200000007 0.4767861999999994 0.3409412600000010 0.3623491399999992 0.4240888599999977 0.4644446000000002 0.6182554199999970 0.5730110000000010 0.4597752999999969 0.6553692299999980 0.7237701099999967 0.4617768000000027 0.6486270600000026 0.4204108200000007 0.4560431499999993 0.5835273699999988 0.3192339799999999 0.3852525699999987 0.5784294999999986 0.3642281799999978 0.5797691100000009 0.2689012599999998 0.5241932500000033 0.1651095100000006 0.2966153200000008 0.5119861299999968 0.3339082099999970 0.1801056199999991 0.5634036800000004 0.1299774399999976 0.1205563199999986 0.5986013500000027 0.2526076099999983 0.6158956900000021 0.5810202500000017 0.3500858600000001 0.6382924400000007 0.4983573900000025 0.4843191000000004 0.6518381500000032 0.7123970000000028 0.3514229700000016 0.7026993899999994 0.7657186599999974 0.4776424499999976 0.3828306500000025 0.4785898900000021 0.3819724700000009 0.3330305400000029 0.4617618500000020 0.5494920000000008 0.4596377800000013 0.5563765200000006 0.3470151900000005 0.6032171000000019 0.3684240400000007 0.4740245400000020 0.6135786299999992 0.3835128200000000 0.6673448000000022 0.6182425599999988 0.2563723600000003 0.3476067200000017 0.1910170600000001 0.5008651699999973 0.3639165499999990 0.2105947399999977 0.5801519099999979 0.3289574799999997 0.2435106100000013 0.5451082900000017 0.1348880800000032 0.2490752300000025 0.3756382099999982 0.3227585200000007 0.2859863600000025 0.3793535300000030 0.2302620399999995 0.2275281699999994 0.3816237799999982 0.2122432500000002 0.0976207000000002 0.4645431599999981 0.1568126599999999 0.1084626199999974 0.4405662899999996 0.2692225500000021 0.1463543400000020 0.4179591299999998 0.1834304500000030 0.1616139500000031 0.5868038600000034 0.0872341099999971 0.0922665699999996 0.5859423899999996 0.2778697600000015 0.3646590600000010 0.5616650099999987 0.2501063899999991 0.3465127400000014 0.6001640799999990 0.4010202400000011 0.4610721700000013 0.4239289100000008 0.3931859799999984 0.4391989699999996 0.4596138799999991 0.2438938299999975 0.3310494899999981 0.3752121699999975 0.4235826000000031 0.4017734700000020 0.3900087600000006 0.5034101899999968 0.3013099599999975 0.4778937600000006 0.5381628100000029 0.3487035899999995 0.4925248199999999 0.5932741700000008 0.4822279600000030 0.5713083300000008 0.3008984900000016 0.4653911500000021 0.5787284800000023 0.4073593700000018 0.6538664899999986 0.6388086199999989 0.5802400399999996 0.6917893500000005 0.6185175500000000 0.4942686099999989 0.6283543699999967 0.6231870100000023 0.3278794900000008 0.5610149800000030 0.5692676299999988 0.5809643099999988 0.5391343399999968 0.5416333900000012 0.4770386900000005 0.5464690299999972 0.6286324800000003 0.4972924300000017 0.6068229799999969 0.8246343400000029 0.4771541599999978 0.6099939500000033 0.7795217899999969 0.5793884599999970 0.5755208100000004 0.7499385799999985 0.4916651899999991 0.6595754499999984 0.7499382199999971 0.3133982100000026 0.7030775200000008 0.8002703800000006 0.5231791100000009 0.6601976700000023 0.4154737100000006 0.3594196700000012 0.6877004899999974 0.3997952599999977 0.5109345400000009 0.5416884699999969 0.2875824899999984 0.4181306099999986 0.5754127200000028 0.3622231200000030 0.3055220700000021 0.5408947199999972 0.4129520999999983 0.5866340999999977 0.5618106699999998 0.2945023799999973 0.5916676200000026 0.6200109099999978 0.4320536099999970 0.6815960899999993 0.6406266999999986 0.3546363499999998 0.6805167799999978 0.6428070999999989 0.2672380300000015 0.3026321899999971 0.6276087700000019 0.2180947200000034 0.3880969800000003 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00