./Stage_1/CONTCAR output for 741: H-OSi + OH-Si on SiO2 surface (pair job 733)
Status: finishedH-OSi + OH-Si on SiO2 surface (pair job 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 0.1300426900000033 0.1268366199999988 0.3856665200000009 F F F 0.3757118400000010 0.1207351700000032 0.3068022599999978 F F F 0.3137744926243851 0.0845425741860872 0.6088649423665576 T T T 0.1024219000000031 0.3942800900000023 0.1493270100000004 F F F 0.0954177400000020 0.3787341900000030 0.4622179099999997 F F F 0.3534611600000019 0.3676220899999976 0.2282802000000004 F F F 0.3486895930765847 0.3462539817583249 0.5366007397496146 T T T 0.1308480000000003 0.6279610799999986 0.3816246499999991 F F F 0.3816046800000024 0.6210310700000008 0.3063127699999981 F F F 0.3261836737721511 0.5937700340995818 0.6130423899963430 T T T 0.1155085600000021 0.8927947700000018 0.1462340200000014 F F F 0.0902798500000017 0.8727663000000021 0.4632146499999976 F F F 0.3616125900000000 0.8685258200000021 0.2281455399999999 F F F 0.3473565647264392 0.8363855744739708 0.5378677613806453 T T T 0.6267879800000031 0.1699720299999967 0.3863804499999972 F F F 0.8714588200000009 0.0956849499999990 0.3078518900000020 F F F 0.8213317252965621 0.1167969299199218 0.6157750910963099 T T T 0.5986584799999974 0.3657824000000005 0.1481890700000008 F F F 0.6020115399999995 0.4214618199999975 0.4606362700000020 F F F 0.8488941900000029 0.3443303800000024 0.2291378999999978 F F F 0.8396162513464347 0.3487895213129475 0.5355273634894422 T T T 0.6341666799999999 0.6755978600000034 0.3847964500000032 F F F 0.8778562700000023 0.6014017299999992 0.3047259499999981 F F F 0.8252916719913733 0.6526387847622682 0.6526893341424297 T T T 0.6059650700000034 0.8663080099999974 0.1472514599999997 F F F 0.5920317300000022 0.9216540299999991 0.4628767399999987 F F F 0.8589917799999967 0.8470820000000003 0.2260862899999978 F F F 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