iterations/neb0_image04_iter73_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
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0.2644588900000002 0.4900546800000001 0.2767564600000014
0.1641588199999973 0.5361216700000000 0.2380524699999995
0.3556442799999999 0.5401893000000015 0.3531461500000006
0.4436718600000020 0.4744746699999993 0.3499229999999969
0.3702480600000015 0.4223180400000004 0.4781014699999986
0.6116168400000035 0.5748544300000020 0.4482211099999986
0.6476027699999989 0.7256193699999969 0.4480709400000009
0.6407440600000029 0.4215456299999971 0.4424627000000001
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0.1883341099999996 0.5624521499999986 0.1436198000000033
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0.2943410399999991 0.3778090599999970 0.2440376400000019
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0.1547474699999967 0.4163465299999984 0.1969247600000017
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0.3721682899999976 0.5604082400000010 0.2632367699999989
0.3549604600000009 0.5986462500000016 0.4149846899999972
0.4696977999999987 0.4247071200000008 0.4047357399999996
0.4456577899999985 0.4536459400000012 0.2546748800000032
0.3389574899999985 0.3730425099999977 0.4379276000000019
0.4099413499999969 0.3887172900000024 0.5165382200000010
0.3095182100000002 0.4765331899999978 0.5518754599999980
0.3570890000000020 0.4908961000000005 0.6068853200000035
0.4892727300000033 0.5687551299999996 0.3110721600000019
0.4657676300000020 0.5795612800000001 0.4108990699999993
0.6469969600000027 0.6406829000000016 0.5667627699999969
0.6856109200000020 0.6215475500000025 0.4816210600000019
0.6190736799999996 0.6244393899999992 0.3150714399999970
0.5566385899999986 0.5732893899999993 0.5743477700000028
0.5349108799999982 0.5403531299999997 0.4733528000000007
0.5394313400000001 0.6285146900000029 0.4873330200000012
0.5988048500000005 0.8258356700000036 0.4634440399999988
0.6017390499999991 0.7810299400000034 0.5657965899999979
0.5674952899999965 0.7513314600000029 0.4778903899999989
0.6509261200000012 0.7514747399999990 0.2995816600000012
0.6950487200000026 0.8023411699999983 0.5097010200000014
0.6519887999999980 0.4166858999999974 0.3458250300000003
0.6796759200000011 0.4006109500000008 0.4973733200000012
0.5336138400000010 0.2889384699999979 0.4044799200000000
0.5671499299999994 0.3636401799999973 0.2920839900000018
0.5327530100000004 0.4147884300000015 0.5736927700000010
0.5535366299999964 0.2961764799999997 0.5782718500000001
0.6119445699999986 0.4336116200000006 0.6683812899999992
0.6326135600000029 0.3562006399999973 0.6671115799999967
0.6346134400000025 0.2687083300000026 0.2891797500000024
0.6192546699999966 0.2195459799999995 0.3743669500000024
0.00000000E+00 0.00000000E+00 0.00000000E+00
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