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 0.2237173700000028 0.5253110000000021 0.3400557900000010 0.2757160900000031 0.3951326700000024 0.2911961100000013 0.1454996399999970 0.4540570799999983 0.2412973699999981 0.6369372200000001 0.6406161399999988 0.4722916099999992 0.5477758099999974 0.5863064999999992 0.4838206299999968 0.5865120400000023 0.7776740099999984 0.4724598700000016 0.2777200900000025 0.4883410300000008 0.2982886599999972 0.1770514899999966 0.5337842899999998 0.2590346499999967 0.3692402599999980 0.5373157900000010 0.3741404100000025 0.4555607699999982 0.4702647299999967 0.3715884000000003 0.3834736499999991 0.4204998900000021 0.4987033999999966 0.5984691900000030 0.5775108799999984 0.4267755500000021 0.6341851299999988 0.7270513699999981 0.4279219399999974 0.6272534200000024 0.4239771299999973 0.4210139400000017 0.5624778600000013 0.3223396200000010 0.3506936100000004 0.5570888000000025 0.3685356900000016 0.5452632900000012 0.2902659000000014 0.5213950500000024 0.2004266000000001 0.3176464900000013 0.5087300599999978 0.3692469699999990 0.2015526200000011 0.5597074000000006 0.1648257200000032 0.1416978999999969 0.5948460299999994 0.2859859100000008 0.5940682299999978 0.5848281800000024 0.3155445800000010 0.6165763699999971 0.5021089000000032 0.4487601599999991 0.6298022900000007 0.7163169100000033 0.3171761700000033 0.6816465799999989 0.7685864800000033 0.4434067899999974 0.4036691499999989 0.4744401199999970 0.4166359299999982 0.3544092599999971 0.4581962600000011 0.5840164999999971 0.4700512900000007 0.5536718500000006 0.3669217300000014 0.5820157899999998 0.3719676500000020 0.4396675899999991 0.5926271399999976 0.3873195800000033 0.6325509600000032 0.5974020800000019 0.2599954499999981 0.3133871300000024 0.2121442299999998 0.4966705000000005 0.3985182699999967 0.2315932799999985 0.5761099599999966 0.3642271000000008 0.2647447900000017 0.5415032399999973 0.1696865299999999 0.2705673500000003 0.3721392100000003 0.3570442999999983 0.3074399699999972 0.3760831100000033 0.2644666899999990 0.2489450200000007 0.3780106099999969 0.2465376099999972 0.1189915499999969 0.4602537399999989 0.1912532300000009 0.1299794399999996 0.4363103100000032 0.3035140300000023 0.1679242000000016 0.4142547000000008 0.2177008399999991 0.1830535699999984 0.5827102699999998 0.1215727900000019 0.1133231199999969 0.5825371700000019 0.3120785699999971 0.3854399200000032 0.5574868799999990 0.2844678399999978 0.3680167899999987 0.5963073300000019 0.4353260199999980 0.4821955199999977 0.4216115600000023 0.4270051600000002 0.4605557000000005 0.4550162800000024 0.2777611100000001 0.3520102299999976 0.3711893400000008 0.4585853000000029 0.4230041799999995 0.3861017999999987 0.5379979100000014 0.3227481600000033 0.4746524199999982 0.5732182100000003 0.3703586000000030 0.4885776899999996 0.6281646199999997 0.5012615600000032 0.5672841599999998 0.3355656399999987 0.4769168099999987 0.5764519800000016 0.4302061799999990 0.6322504400000000 0.6419862199999997 0.5454075000000032 0.6707588599999994 0.6219399499999980 0.4601395999999980 0.6069273100000032 0.6273782499999996 0.2933118799999974 0.5412205599999993 0.5734277199999980 0.5513318100000006 0.5297061600000035 0.5428270900000030 0.4516469200000017 0.5267506400000030 0.6320796899999976 0.4641077799999991 0.5857443399999980 0.8280844900000019 0.4430725400000028 0.5885582900000017 0.7831468400000006 0.5454255599999982 0.5544266300000018 0.7534926200000029 0.4573082499999970 0.6378123100000010 0.7538374900000022 0.2793004600000017 0.6820461399999971 0.8036038400000010 0.4880448600000022 0.6388042100000035 0.4190228300000030 0.3243144899999990 0.6664552599999993 0.4037245499999997 0.4759287700000030 0.5206375400000027 0.2906676200000007 0.3835582299999984 0.5542070799999976 0.3655829699999984 0.2711750300000020 0.5203543599999989 0.4178746999999987 0.5527493499999991 0.5400579800000003 0.2991214799999966 0.5575320199999965 0.5990490399999970 0.4360258299999984 0.6477373299999982 0.6196607600000021 0.3581132600000032 0.6459850600000010 0.6220049900000006 0.2710476700000015 0.2691692200000020 0.6069210200000015 0.2222278500000030 0.3545654999999996 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00