No title 1.00000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 9.7443200000000001 0.0000000000000000 0.0000000000000000 0.0000000000000000 23.4276799999999987 Si O H 31 70 16 Selective dynamics Direct 0.1254586399999980 0.1294406100000032 0.3860151200000033 F F F 0.3711277900000027 0.1233391600000004 0.3071508600000001 F F F 0.3033228999999977 0.0885516100000032 0.6090380099999990 T T T 0.0978378499999977 0.3968840799999995 0.1496756100000027 F F F 0.0908336899999966 0.3813381800000002 0.4625665100000020 F F F 0.3488771099999965 0.3702260800000019 0.2286288000000027 F F F 0.3429046199999988 0.3474331000000035 0.5365467299999978 T T T 0.1262639500000020 0.6305650700000029 0.3819732500000015 F F F 0.3770206299999970 0.6236350599999980 0.3066613700000005 F F F 0.3252923699999997 0.5936870499999998 0.6169702500000014 T T T 0.1109245099999967 0.8953987599999991 0.1465826199999967 F F F 0.0856958000000034 0.8753702899999993 0.4635632500000000 F F F 0.3570285400000017 0.8711298099999993 0.2284941400000022 F F F 0.3430446200000006 0.8400598799999983 0.5389578400000019 T T T 0.6222039299999977 0.1725760200000011 0.3867290499999996 F F F 0.8668747700000026 0.0982889400000033 0.3082004899999973 F F F 0.8135955799999977 0.1215045799999999 0.6167157900000007 T T T 0.5940744299999992 0.3683863899999977 0.1485376700000032 F F F 0.5974274900000012 0.4240658100000019 0.4609848699999972 F F F 0.8443101399999975 0.3469343699999996 0.2294865000000001 F F F 0.8358017300000000 0.3529747099999980 0.5359609100000000 T T T 0.6295826300000016 0.6782018500000007 0.3851450499999984 F F F 0.8732722199999969 0.6040057200000035 0.3050745500000005 F F F 0.8185908000000026 0.6571371300000024 0.6513263000000009 T T T 0.6013810199999980 0.8689120000000017 0.1476000600000020 F F F 0.5874476799999968 0.9242580200000035 0.4632253400000010 F F F 0.8544077299999984 0.8496859899999976 0.2264348900000002 F F F 0.8388425300000009 0.8558382300000034 0.5447112499999989 T T T 0.9651537000000019 0.3870597599999996 0.6506307699999994 T T T 0.5432503899999972 0.2131905900000035 0.6496871499999983 T T T 0.5747257900000022 0.5093168399999968 0.7055545799999976 T T T 0.0688804700000034 0.0165974199999965 0.1033527499999991 F F F 0.0787950400000028 0.0301161399999970 0.4384890500000012 F F F 0.2987666599999983 0.2421373800000026 0.2684150899999977 F F F 0.3026548300000016 0.1870960999999980 0.5523396700000021 T T T 0.1517103600000027 0.2700566600000016 0.1076019400000021 F F F 0.1534801000000030 0.2779502699999981 0.4149900900000034 F F F 0.4154666800000015 0.4909567899999985 0.2678925100000029 F F F 0.3569371199999978 0.4387518099999994 0.5951249399999980 T T T 0.4624784299999973 0.3103035000000034 0.1840924199999989 F F F 0.4457376499999981 0.3763141100000027 0.4806617099999997 F F F 0.2200116899999998 0.4368874299999987 0.1944074199999974 F F F 0.1956521800000033 0.4066631399999991 0.5137438300000028 T T T 0.2646362300000007 0.0716378700000035 0.3563008400000029 F F F 0.1515500599999982 0.0718319699999981 0.6374123900000015 T T T 0.0113097799999977 0.1460788300000004 0.3361329000000026 F F F 0.8964651000000003 0.2303377900000001 0.6581911700000020 T T T 0.0480848500000022 0.5217159999999978 0.1097159600000026 F F F 0.0681962600000006 0.5284719499999966 0.4312735500000002 F F F 0.3056195400000021 0.7435365700000034 0.2682386299999990 F F F 0.3767871599999992 0.6872908599999974 0.5623585800000015 T T T 0.1630985299999992 0.7639979699999984 0.1066604800000022 F F F 0.1413415199999974 0.7796702600000032 0.4121316199999967 F F F 0.4190510700000019 0.9936281000000022 0.2683061899999970 F F F 0.3749152899999970 0.9440452199999996 0.5915589800000021 T T T 0.4738961500000016 0.8107833799999966 0.1856000200000025 F F F 0.4371373600000013 0.8716218100000006 0.4836444199999974 F F F 0.2308173500000024 0.9363631399999974 0.1921780799999979 F F F 0.1842687400000003 0.8651412099999973 0.5195948200000018 T T T 0.2743800599999986 0.5787506100000002 0.3584283200000016 F F F 0.0260264100000001 0.6436884000000020 0.3269922400000027 F F F 0.9253739999999979 0.5393866000000003 0.6787597200000022 T T T 0.5552696199999971 0.9891961000000009 0.1045214399999992 F F F 0.5728469399999980 0.0816433199999977 0.4415079799999972 F F F 0.8147349899999980 0.1962992699999973 0.2564969800000014 F F F 0.7835945599999974 0.2003994700000007 0.5559615499999992 T T T 0.6477965899999987 0.2382090300000002 0.1082845600000013 F F F 0.6561137899999991 0.3260761000000016 0.4102192400000035 F F F 0.8763818099999980 0.4462732499999973 0.2835662600000006 F F F 0.9198516399999974 0.4283887400000026 0.5859038700000028 T T T 0.9724209199999976 0.3307068800000010 0.1859030399999995 F F F 0.9437603399999972 0.3278803099999976 0.4871334099999984 F F F 0.7135698800000014 0.4066965499999995 0.1945571400000006 F F F 0.7034090200000023 0.4360271199999985 0.5145369900000034 T T T 0.7561068099999986 0.0988887299999988 0.3598368700000023 F F F 0.6682102199999989 0.0973648599999990 0.6509983400000010 T T T 0.5055627899999990 0.1873440099999968 0.3379306100000008 F F F 0.3932180799999969 0.1494306299999977 0.6624262099999996 T T T 0.5515020300000018 0.4903891499999986 0.1057287300000027 F F F 0.5851708499999972 0.5804137599999990 0.4380778800000016 F F F 0.8234597000000008 0.6970779099999973 0.2514380300000028 F F F 0.8329441500000030 0.7183484600000014 0.5855615899999975 T T T 0.6519124800000000 0.7372567099999969 0.1075207100000029 F F F 0.6457455099999976 0.8321116899999979 0.4109404200000029 F F F 0.8868701900000033 0.9460009900000017 0.2815826900000005 F F F 0.8862548999999973 0.9779033900000016 0.5935300100000021 T T T 0.9824086699999981 0.8360090099999979 0.1828756600000006 F F F 0.9339563300000009 0.8299884400000010 0.4860171899999983 F F F 0.7240767799999972 0.9109258399999973 0.1916428199999984 F F F 0.6908365600000010 0.9070168800000005 0.5192456600000028 T T T 0.7735225200000002 0.6234138299999969 0.3597865200000001 F F F 0.6706884800000026 0.5777927000000034 0.6524329100000017 T T T 0.5174881200000030 0.6828344400000006 0.3342259699999985 F F F 0.4074134800000024 0.6073259899999996 0.6800489999999968 T T T 0.5654940399999973 0.3383620600000015 0.6946721400000015 T T T 0.5421799900000011 0.2699973900000003 0.5835716400000024 T T T 0.8291544300000027 0.7795128899999995 0.6987711700000006 T T T 0.1211815300000012 0.3659103900000034 0.6731812200000036 T T T 0.1657594200000005 0.6464271800000034 0.6257483500000021 T T T 0.6850560199999975 0.4857100199999991 0.7646289199999998 T T T 0.4348753000000016 0.6394472100000002 0.7784363999999968 T T T 0.1004587400000005 0.1134540700000031 0.1074612299999984 F F F 0.1970317800000032 0.2992095500000005 0.0727406399999992 F F F 0.0932469400000002 0.6134932300000031 0.1097561899999988 F F F 0.2073457300000001 0.7895196999999996 0.0710592900000009 F F F 0.5896634699999979 0.0853248499999992 0.1082385400000021 F F F 0.6864069299999969 0.2654578599999979 0.0717815100000010 F F F 0.5899337800000026 0.5850271500000019 0.1085105499999983 F F F 0.6918956399999985 0.7631919199999970 0.0711048200000022 F F F 0.6146513200000001 0.2282319799999968 0.5603181500000005 T T T 0.0817817599999984 0.0147830399999975 0.6190433200000030 T T T 0.7680250700000002 0.8575650000000010 0.6948728899999992 T T T 0.1482791199999980 0.2693328300000033 0.6746446000000006 T T T 0.1183746299999981 0.6132734999999983 0.6599227100000036 T T T 0.7800252299999997 0.5235062200000016 0.7700812900000003 T T T 0.5035007399999998 0.6021178199999966 0.8073845099999986 T T T 0.3726880700000024 0.6774466299999986 0.7316917400000023 T T T 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00