./iterations/neb0_image03_iter35_CONTCAR output for 42: 3.3A-->1.3A 712(amd-3) Si-CH3H...HO-Si two dimer closed (TSS for CH3...OH)
Status:
finished
No 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
0.3618602399999986 0.5561907900000023 0.4132979899999967
0.3574643399999999 0.4444589100000016 0.5586136900000014
0.4545605599999973 0.4865086800000000 0.3942789199999979
0.6290150199999971 0.6363922099999968 0.3497021200000034
0.5967381000000032 0.5419920100000013 0.5020753200000030
0.6413854500000014 0.7418575900000022 0.5034561599999989
0.3386346300000014 0.5297284700000020 0.5238823299999993
0.4235309399999991 0.5668565400000034 0.4089325799999983
0.2332549899999989 0.5327180299999981 0.5581480499999998
0.1911872499999987 0.4460945000000009 0.6998588699999999
0.2141431499999982 0.3866880499999965 0.5172057899999984
0.5859333200000023 0.5739822000000032 0.3871513599999972
0.6232971299999974 0.7248349899999980 0.3862394300000034
0.5801622299999991 0.4489105400000000 0.2472075800000013
0.5490816399999972 0.3145658500000010 0.3135261700000029
0.6472559799999971 0.3456148599999977 0.3153263800000019
0.3517693800000004 0.5864261299999995 0.5998926600000019
0.2836201799999998 0.5282950599999978 0.5167410999999973
0.4364978699999966 0.6018675199999990 0.5078541999999970
0.4364586299999971 0.6185414500000022 0.3260539199999997
0.5359855999999965 0.6107286800000011 0.3816753300000002
0.5864147699999975 0.5094781999999967 0.3199980300000007
0.5684287999999995 0.7397174600000014 0.3748119799999969
0.6510305400000007 0.7742143799999965 0.3163338499999995
0.2136324900000020 0.4543867100000014 0.5923353299999974
0.2080228199999965 0.4078539300000017 0.4067488199999971
0.1407184999999984 0.4851544799999985 0.7200166599999989
0.5926881199999983 0.3709507800000011 0.2901644000000019
0.6882523100000029 0.3918146999999976 0.2642420600000008
0.5251937999999967 0.2714956000000015 0.2264796999999987
0.3519694599999994 0.5204577499999985 0.3608765399999996
0.3463953400000008 0.6046306000000001 0.3961555799999985
0.3816889200000020 0.6047686200000015 0.5903730699999983
0.3488090900000032 0.4058343700000009 0.5092726199999973
0.3417502900000002 0.4306064499999991 0.6223046100000005
0.3938046499999999 0.4432128699999964 0.5686428300000017
0.4906133900000000 0.4960712500000000 0.3913235300000011
0.4450392500000007 0.4621017500000022 0.3313377099999997
0.4483158399999994 0.4510520299999996 0.4488522600000024
0.4673603600000007 0.6159189700000027 0.5139160100000026
0.4684261700000008 0.6194742400000024 0.3142945800000021
0.2315331200000017 0.5767395499999992 0.6384504899999968
0.2043128199999984 0.5606226100000029 0.4865989899999974
0.1844591500000021 0.3730691600000000 0.7140816799999996
0.2227032099999988 0.4752834100000030 0.7658316999999997
0.2573634100000035 0.3501165600000036 0.5230627899999973
0.1765101100000024 0.3421933500000023 0.5438832800000029
0.2350616599999995 0.4225883900000014 0.3707912300000018
0.1800656699999976 0.4313489000000033 0.3846985200000006
0.1399322899999973 0.5347985800000004 0.7349510700000010
0.1126866800000030 0.4713487599999979 0.6865365299999979
0.6624250799999984 0.6180543400000005 0.3683620600000026
0.6281134399999999 0.6371446300000017 0.2760432999999978
0.5388877299999990 0.6598139000000032 0.3772472300000018
0.6288287699999984 0.5153734100000023 0.5050037299999985
0.5705779500000006 0.5065273499999989 0.5223215099999976
0.5976146300000025 0.5825507300000012 0.5516092299999968
0.6361360800000000 0.7946324899999979 0.5216393999999980
0.6769694099999981 0.7304245799999975 0.5128208599999979
0.6223860099999996 0.7113012900000015 0.5511762699999991
0.5578453800000034 0.7854799099999994 0.3718364500000035
0.6689130800000029 0.8099147499999972 0.3413666399999968
0.5325217999999978 0.4469722099999984 0.2183395300000015
0.6093872800000000 0.4650827199999981 0.1696633299999988
0.5690127700000005 0.2638036700000015 0.3747763399999968
0.5122614300000023 0.3524886800000004 0.3568475900000010
0.6565376100000009 0.3517152000000010 0.4129215600000009
0.6511122400000033 0.2741585500000028 0.2872483499999987
0.7016217899999972 0.4325470100000004 0.2945093900000018
0.6912341199999972 0.3947482499999992 0.1968146299999987
0.5029322600000015 0.2946373799999975 0.1857992500000023
0.5425837900000019 0.2360077800000013 0.1927185699999967
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00