iterations/neb0_image06_iter72_CONTCAR output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
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
0.2148369599999995 0.5268294500000010 0.3262172399999983
0.2666505700000030 0.3967409199999992 0.2762719700000034
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0.5957981600000011 0.7758162700000000 0.4876266999999999
0.2677835100000010 0.4892129899999986 0.2834885099999980
0.1681757200000007 0.5355820899999983 0.2449261699999994
0.3600213400000030 0.5383810599999990 0.3611278500000026
0.4510082700000027 0.4718079299999971 0.3677586900000023
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0.6038579499999983 0.5739705200000031 0.4358781199999981
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0.3070423899999994 0.5081361800000010 0.3550643499999993
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0.2557202200000006 0.5431443599999994 0.1557537199999999
0.2616917400000034 0.3743815999999995 0.3421933400000015
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0.2401613500000011 0.3796661000000014 0.2321818500000035
0.1097844800000018 0.4615654899999981 0.1765251799999987
0.1209539000000035 0.4374985299999992 0.2894617500000010
0.1594518799999989 0.4165410100000031 0.2033517099999997
0.1743707600000022 0.5841101800000033 0.1070999200000031
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0.3591684100000023 0.5976313999999974 0.4202672300000003
0.4756069700000012 0.4148187799999974 0.4211417799999992
0.4530637299999967 0.4676923299999984 0.2709972800000031
0.3433572400000031 0.3735078699999974 0.4421186800000001
0.4145984900000030 0.3881669800000012 0.5217825599999983
0.3133224500000011 0.4756415599999997 0.5574308899999991
0.3629028599999984 0.4892303600000005 0.6128437400000024
0.5010669899999982 0.5755412999999976 0.3205852999999976
0.4898380099999997 0.5752096100000017 0.4463513199999980
0.6399915800000002 0.6405811099999994 0.5613534900000019
0.6729319700000005 0.6149345099999977 0.4703208600000011
0.6176089599999983 0.6280678299999991 0.3067709600000015
0.5421047999999971 0.5645735900000020 0.5505836199999976
0.5204572600000006 0.5486253099999985 0.4451868499999989
0.5312155900000022 0.6372467400000019 0.4725321199999968
0.5952963299999965 0.8255455999999981 0.4575565900000029
0.5974575999999985 0.7811712900000032 0.5605748899999980
0.5644959700000030 0.7506058100000033 0.4715105599999987
0.6465872400000023 0.7522713700000025 0.2958570899999984
0.6910565399999982 0.8013014400000031 0.5020459899999992
0.6480574799999985 0.4178911500000027 0.3382077899999985
0.6751057399999993 0.4018344699999972 0.4896285299999974
0.5297343200000029 0.2898350999999977 0.3982417499999968
0.5628615400000001 0.3643535900000003 0.2849521899999985
0.5292179500000032 0.4162201999999979 0.5646341200000009
0.5492622100000020 0.2976346700000008 0.5714791199999993
0.6078444400000009 0.4336529099999993 0.6614645200000027
0.6280502400000003 0.3563668199999981 0.6593903999999995
0.6312701299999972 0.2698205000000016 0.2839876299999986
0.6159727300000029 0.2212115399999988 0.3703912000000003
0.00000000E+00 0.00000000E+00 0.00000000E+00
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