./iterations/neb0_image05_iter12_CONTCAR output for 42: 3.3A-->1.3A 712(amd-3) Si-CH3H...HO-Si two dimer closed (TSS for CH3...OH)
Status: runningNo 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 0.3657993400000024 0.5659177900000003 0.4125069700000026 0.3613352300000017 0.4540533899999986 0.5578892400000015 0.4581155199999998 0.4954607299999978 0.3934762100000029 0.6252303799999979 0.6268256700000023 0.3504554200000030 0.5930545300000034 0.5323168700000025 0.5028866199999982 0.6376211199999986 0.7322710899999976 0.5042144499999992 0.3424470300000024 0.5393160599999973 0.5230976900000002 0.4276417399999985 0.5763305799999969 0.4079463899999993 0.2370110000000025 0.5420176299999966 0.5573805300000032 0.1948924499999976 0.4556561699999975 0.6989698599999983 0.2179233900000028 0.3962589400000027 0.5165101199999995 0.5827018600000002 0.5642333799999975 0.3879750700000031 0.6194996799999970 0.7152414999999976 0.3870587899999975 0.5763127100000034 0.4393385899999984 0.2477750600000022 0.5452434199999985 0.3050813899999980 0.3145805799999977 0.6434852900000010 0.3359391899999977 0.3161556399999981 0.3555758500000010 0.5960085899999967 0.5992283599999979 0.2874403200000017 0.5375725000000031 0.5161271500000026 0.4401085300000034 0.6119758899999965 0.5070454199999972 0.4397974500000004 0.6288759799999966 0.3249356999999975 0.5329930300000001 0.6016102999999973 0.3825766400000035 0.5827965900000009 0.4998368500000012 0.3207229400000031 0.5645889199999985 0.7300555899999992 0.3755233099999984 0.6472341599999965 0.7645536500000034 0.3171950999999993 0.2173561999999976 0.4638903999999968 0.5916003600000010 0.2118343100000004 0.4175240699999989 0.4061256499999999 0.1444481400000015 0.4946413699999965 0.7192534899999998 0.5888943799999993 0.3613054500000032 0.2908022700000004 0.6845340300000018 0.3821699499999980 0.2649812599999990 0.5213948199999976 0.2619758000000019 0.2275192899999965 0.3557307000000023 0.5301729800000032 0.3601947900000013 0.3501122699999968 0.6142482999999999 0.3954596700000010 0.3854248100000035 0.6143852399999972 0.5895105600000008 0.3526421400000004 0.4154596200000000 0.5085340099999982 0.3456139500000006 0.4402224999999973 0.6215782399999981 0.3976735500000004 0.4528252599999973 0.5678046800000018 0.4938130000000029 0.5055782000000022 0.3903475299999997 0.4487269600000019 0.4717709099999965 0.3302209100000013 0.4520398000000014 0.4603637199999966 0.4482652900000019 0.4710142799999986 0.6257761399999993 0.5132031600000033 0.4717551299999982 0.6294059299999972 0.3130644000000018 0.2353088300000010 0.5862294000000006 0.6376549100000020 0.2081479300000026 0.5701766600000013 0.4857763799999972 0.1881931499999965 0.3825827499999974 0.7133164500000007 0.2264171099999999 0.4848255100000003 0.7650684799999965 0.2611766599999967 0.3596961399999969 0.5223293199999972 0.1803222200000008 0.3516042600000020 0.5431204500000035 0.2388216599999993 0.4321082700000005 0.3700572799999975 0.1838095800000019 0.4408479499999984 0.3839229900000021 0.1436845899999994 0.5442552499999991 0.7341969800000001 0.1164221299999966 0.4809088299999971 0.6856448599999965 0.6585311500000017 0.6084538899999998 0.3692455600000031 0.6243593000000018 0.6275478499999991 0.2768477799999971 0.5352193000000014 0.6506027100000011 0.3780312399999985 0.6251514499999971 0.5057792400000025 0.5055471699999998 0.5669192499999980 0.4968108099999995 0.5231248300000004 0.5939628499999969 0.5728492300000028 0.5524476399999969 0.6323635700000025 0.7850496300000032 0.5223888900000020 0.6732122800000013 0.7208832500000000 0.5135946799999971 0.6186440199999979 0.7017387799999995 0.5519967299999990 0.5541551399999989 0.7759226000000012 0.3726009100000027 0.6651344499999965 0.8002879900000011 0.3422344499999994 0.5287269800000018 0.4374503900000022 0.2191353699999965 0.6056195700000018 0.4554626400000004 0.1704369200000002 0.5652231899999975 0.2542237799999967 0.3755874000000006 0.5084127399999971 0.3430389700000021 0.3577182000000008 0.6527242700000002 0.3420549499999979 0.4136987899999980 0.6472363600000008 0.2645163299999993 0.2880500600000033 0.6977549699999983 0.4229578899999993 0.2953661900000029 0.6874802800000026 0.3850883899999999 0.1976801100000003 0.4991564400000001 0.2851195499999974 0.1865005300000036 0.5387728899999971 0.2263982500000026 0.1935312499999995 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00