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 0.1217913999999993 0.1315237999999965 0.3862939999999995 F F F 0.3674605499999970 0.1254223500000009 0.3074297400000034 F F F 0.3040651800000020 0.0898974199999998 0.6095885399999972 T T T 0.0941706099999990 0.3989672700000000 0.1499544899999989 F F F 0.0871664499999980 0.3834213700000006 0.4628453899999982 F F F 0.3452098699999979 0.3723092700000024 0.2289076799999989 F F F 0.3407896100000016 0.3514119600000001 0.5372503999999978 T T T 0.1225967100000034 0.6326482600000034 0.3822521299999977 F F F 0.3733533899999983 0.6257182499999985 0.3069402499999967 F F F 0.3167885699999999 0.5988083399999979 0.6141156500000022 T T T 0.1072572699999981 0.8974819499999995 0.1468615000000000 F F F 0.0820285599999977 0.8774534799999998 0.4638421300000033 F F F 0.3533613000000031 0.8732129999999998 0.2287730199999984 F F F 0.3392350900000025 0.8417669600000011 0.5385747600000030 T T T 0.6185366899999991 0.1746592100000015 0.3870079300000029 F F F 0.8632075299999968 0.1003721299999967 0.3084793700000006 F F F 0.8116030300000006 0.1229264600000022 0.6170369100000030 T T T 0.5904071900000005 0.3704695799999982 0.1488165499999994 F F F 0.5937602500000025 0.4261490000000023 0.4612637500000005 F F F 0.8406428999999989 0.3490175600000001 0.2297653800000035 F F F 0.8315614600000032 0.3540317499999972 0.5362214000000023 T T T 0.6259153900000030 0.6802850400000011 0.3854239300000017 F F F 0.8696049799999983 0.6060889099999969 0.3053534299999967 F F F 0.8143516499999990 0.6580619200000015 0.6534892499999998 T T T 0.5977137799999994 0.8709951900000021 0.1478789399999982 F F F 0.5837804399999982 0.9263412099999968 0.4635042199999972 F F F 0.8507404899999997 0.8517691799999980 0.2267137700000035 F F F 0.8341771400000013 0.8565664999999996 0.5453705700000029 T T T 0.9639983900000004 0.3891264399999983 0.6504923800000029 T T T 0.5434111000000001 0.2188594699999982 0.6533969400000004 T T T 0.6245833199999993 0.4841278199999977 0.7221644800000036 T T T 0.0652132299999977 0.0186806099999970 0.1036316300000024 F F F 0.0751277999999971 0.0321993299999974 0.4387679299999974 F F F 0.2950994199999997 0.2442205700000031 0.2686939700000011 F F F 0.3068334299999975 0.1894751700000015 0.5530832299999986 T T T 0.1480431199999970 0.2721398500000021 0.1078808199999983 F F F 0.1498128599999973 0.2800334599999985 0.4152689699999996 F F F 0.4117994400000029 0.4930399799999989 0.2681713899999991 F F F 0.3533824900000013 0.4428676300000021 0.5954567200000014 T T T 0.4588111899999987 0.3123866899999967 0.1843713000000022 F F F 0.4420704099999995 0.3783973000000032 0.4809405900000030 F F F 0.2163444500000011 0.4389706199999992 0.1946863000000008 F F F 0.1913559400000011 0.4061434700000035 0.5146435999999994 T T T 0.2609689900000021 0.0737210599999969 0.3565797199999992 F F F 0.1505881200000019 0.0755191699999997 0.6368894299999965 T T T 0.0076425399999991 0.1481620200000009 0.3364117799999988 F F F 0.8956804000000034 0.2320288499999990 0.6578773700000013 T T T 0.0444176100000035 0.5237991899999983 0.1099948399999988 F F F 0.0645290200000019 0.5305551399999970 0.4315524299999964 F F F 0.3019523000000035 0.7456197599999967 0.2685175100000023 F F F 0.3731362700000034 0.6885034200000035 0.5599477900000025 T T T 0.1594312900000006 0.7660811599999988 0.1069393599999984 F F F 0.1376742799999988 0.7817534499999965 0.4124105000000000 F F F 0.4153838300000032 0.9957112900000027 0.2685850700000003 F F F 0.3721046200000018 0.9441052900000031 0.5918478399999998 T T T 0.4702289100000030 0.8128665699999971 0.1858788999999987 F F F 0.4334701200000026 0.8737050000000011 0.4839233000000007 F F F 0.2271501099999966 0.9384463299999979 0.1924569600000012 F F F 0.1802759300000005 0.8681525399999970 0.5199180199999986 T T T 0.2707128200000000 0.5808338000000006 0.3587071999999978 F F F 0.0223591700000014 0.6457715900000025 0.3272711199999989 F F F 0.9320528800000005 0.5451811300000031 0.6774236899999977 T T T 0.5516023799999985 0.9912792900000014 0.1048003200000025 F F F 0.5691796999999994 0.0837265099999982 0.4417868600000006 F F F 0.8110677499999994 0.1983824599999977 0.2567758599999976 F F F 0.7807235000000006 0.2006091299999966 0.5560171400000016 T T T 0.6441293500000000 0.2402922200000006 0.1085634399999975 F F F 0.6524465500000005 0.3281592900000021 0.4104981199999997 F F F 0.8727145699999994 0.4483564399999977 0.2838451399999968 F F F 0.9144057000000032 0.4304257599999985 0.5862515000000030 T T T 0.9687536799999990 0.3327900700000015 0.1861819200000028 F F F 0.9400930999999986 0.3299634999999981 0.4874122900000017 F F F 0.7099026400000028 0.4087797399999999 0.1948360199999968 F F F 0.6996192100000016 0.4374178699999973 0.5147504500000011 T T T 0.7524395699999999 0.1009719199999992 0.3601157499999985 F F F 0.6672959699999979 0.0997162900000035 0.6523174699999998 T T T 0.5018955500000004 0.1894271999999972 0.3382094899999970 F F F 0.3941997000000015 0.1479646000000017 0.6634840199999985 T T T 0.5478347900000031 0.4924723399999991 0.1060076099999989 F F F 0.5815036099999986 0.5824969499999995 0.4383567599999978 F F F 0.8197924600000022 0.6991610999999978 0.2517169099999990 F F F 0.8224532600000032 0.7193030899999968 0.5871066899999988 T T T 0.6482452400000014 0.7393398999999974 0.1077995899999991 F F F 0.6420782699999990 0.8341948799999983 0.4112192999999991 F F F 0.8832029499999976 0.9480841800000022 0.2818615699999967 F F F 0.8837195199999996 0.9788484500000010 0.5938420900000025 T T T 0.9787414299999995 0.8380921999999984 0.1831545399999968 F F F 0.9302890900000023 0.8320716300000015 0.4862960700000016 F F F 0.7204095399999986 0.9130090299999978 0.1919217000000017 F F F 0.6869524999999967 0.9088480899999993 0.5195155700000029 T T T 0.7698552800000016 0.6254970199999974 0.3600654000000034 F F F 0.6718004700000009 0.5732128499999973 0.6652542400000030 T T T 0.5138208799999973 0.6849176300000011 0.3345048500000019 F F F 0.3990481499999987 0.6185129200000006 0.6735001199999999 T T T 0.5609444899999971 0.3378472200000004 0.7006339300000022 T T T 0.5438739299999966 0.2780988399999984 0.5874573400000003 T T T 0.8329250299999984 0.7835970300000028 0.6995672899999974 T T T 0.1208295899999996 0.3657171999999989 0.6717440299999993 T T T 0.1577938599999982 0.6505465799999968 0.6215279700000025 T T T 0.7585785599999966 0.4345836800000029 0.7608185100000000 T T T 0.5247562500000029 0.5700632599999977 0.7659749000000033 T T T 0.0967915000000019 0.1155372600000035 0.1077401100000017 F F F 0.1933645399999975 0.3012927400000009 0.0730195200000026 F F F 0.0895797000000016 0.6155764199999965 0.1100350700000021 F F F 0.2036784900000015 0.7916028900000001 0.0713381699999971 F F F 0.5859962299999992 0.0874080399999997 0.1085174199999983 F F F 0.6827396899999982 0.2675410499999984 0.0720603899999972 F F F 0.5862665399999969 0.5871103400000024 0.1087894300000016 F F F 0.6882283999999999 0.7652751099999975 0.0713836999999984 F F F 0.6133310700000010 0.2328926400000029 0.5634816099999966 T T T 0.0812271100000004 0.0182478999999987 0.6183319800000007 T T T 0.7705911899999975 0.8609163200000012 0.6958256799999987 T T T 0.1459450500000017 0.2682739199999986 0.6726856499999982 T T T 0.1058325699999969 0.6183194700000030 0.6546565399999977 T T T 0.8293805400000025 0.5032430899999980 0.7666850999999966 T T T 0.5514071400000020 0.5580419799999987 0.8051590299999987 T T T 0.3716644000000002 0.6819617900000026 0.7032049099999966 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