No title 1.00000000000000 7.6631000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 25.3262000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 10.8372600000000006 Si O H N F 42 16 15 1 6 Direct 0.8479742299999984 0.3067469000000003 0.0634147199999973 0.8480108899999976 0.3851079800000008 0.4448203700000022 0.0978017099999988 0.3067650699999973 0.1933454400000016 0.0978503700000033 0.3830518500000011 0.3181129000000027 0.8535099899999992 0.5406640699999983 0.4351701499999976 0.1028169800000001 0.5370652599999985 0.3085713099999978 0.8500628800000030 0.4582246900000015 0.0646758099999971 0.8443976399999968 0.2288870399999965 0.4420026000000021 0.0989235699999966 0.4581913399999991 0.1931060799999997 0.0944235099999986 0.2282231300000035 0.3142525900000024 0.3447487199999983 0.6569507500000000 0.5213806699999992 0.8479243399999987 0.3073703700000010 0.5642452199999966 0.8491879199999985 0.3832020899999975 0.9390949599999985 0.0981337099999990 0.3075098300000008 0.6931748299999967 0.0989611700000026 0.3853868100000000 0.8120535799999971 0.8502910500000027 0.5369294099999991 0.9490554300000014 0.0989537800000022 0.5406885900000020 0.8226945799999967 0.8496600699999988 0.4638574299999974 0.5631271000000027 0.8443505999999985 0.2281345999999971 0.9426633100000004 0.0986469500000027 0.4640612500000003 0.6932807999999966 0.0943949500000016 0.2289111099999985 0.8149095699999975 0.3477524999999986 0.3066464699999969 0.0635070900000017 0.3482959800000032 0.3849179999999990 0.4444049199999967 0.5978569399999998 0.3066632600000005 0.1931690700000033 0.5984145600000019 0.3829979599999973 0.3176845400000019 0.3551596699999990 0.5388290300000023 0.4328000699999990 0.6056707500000016 0.5368588099999982 0.3071331900000018 0.3486610599999977 0.4578179900000023 0.0658924900000031 0.3445594000000014 0.2288441099999972 0.4419524899999985 0.6003091500000011 0.4580001100000004 0.1919248800000020 0.5944849999999988 0.2281541999999988 0.3140936900000000 0.3480782500000004 0.3073146099999988 0.5641322199999976 0.3484853000000001 0.3830589499999988 0.9393481800000032 0.5979908899999984 0.3074095999999997 0.6932899999999975 0.5988212199999978 0.3851328800000005 0.8127035400000011 0.3478571500000029 0.5364840299999969 0.9504377599999998 0.5974959999999996 0.5386023900000012 0.8249788899999970 0.3490045499999965 0.4632248699999977 0.5638817999999972 0.3442397999999969 0.2280836999999991 0.9427787600000030 0.5995032000000009 0.4634053199999997 0.6928022900000030 0.5943104799999972 0.2288846499999977 0.8150245300000023 0.6029547999999991 0.6577154399999969 0.7413896300000005 0.3616852099999974 0.5929388599999967 0.5179500500000032 0.1112257600000035 0.5895751600000025 0.2131269500000030 0.3336900600000021 0.1777002199999984 0.5415437999999995 0.0834593499999983 0.1765808399999997 0.2160139599999980 0.3609624899999986 0.5886228500000001 0.0462646399999969 0.1111977600000031 0.5962761700000030 0.7428495699999971 0.3334154900000001 0.1764514099999985 0.0410414400000008 0.0836608999999982 0.1778833700000035 0.7149533600000026 0.8430629100000004 0.5956530699999973 0.5177044100000003 0.6136602999999994 0.5889843699999986 0.2109158199999968 0.8335737399999985 0.1777766200000030 0.5417011899999977 0.5835627100000025 0.1764628500000001 0.2159643199999977 0.8617964000000029 0.5894212999999979 0.0442634999999996 0.5920139199999994 0.5935795899999974 0.7431722899999968 0.8336078999999970 0.1765315399999992 0.0410018500000007 0.5836042700000021 0.1778782499999991 0.7150338900000008 0.0115188300000000 0.5931171300000031 0.1527743299999997 0.9328814599999973 0.1745009699999969 0.6018625399999991 0.1824382799999995 0.1731102800000031 0.1558003700000015 0.2613843000000031 0.5932538699999981 0.1062401399999970 0.0137881799999988 0.6214521200000007 0.7409889899999982 0.9325401899999974 0.1731686800000034 0.1012975699999998 0.1829924600000012 0.1745361299999999 0.6548490099999995 0.9395415199999988 0.6210060299999967 0.5174909699999972 0.5123984100000030 0.5929566000000008 0.1518762500000008 0.4329234300000024 0.1743998500000004 0.6017376400000032 0.6825175600000009 0.1730520300000009 0.1557179699999978 0.7617949600000031 0.5933307000000028 0.1045461599999982 0.4324130099999977 0.1730456200000035 0.1012643600000018 0.6829522199999971 0.1745880900000003 0.6549131900000020 0.4570086000000018 0.7246493199999975 0.6406070000000028 0.4673416999999986 0.6836962599999978 0.6347338300000018 0.8064609799999971 0.6720324799999986 0.7208723600000013 0.3913334200000023 0.6803841099999985 0.3882837499999994 0.5621280700000000 0.6808744699999991 0.8756230799999969 0.1393060099999985 0.6701544299999966 0.5356477699999971 0.4253698500000027 0.7936168100000032 0.6647606300000035 0.5798984300000001 0.7962158799999983 0.5623803200000026 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00