iterations/neb0_image07_iter45_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
0.2202102299999993 0.5261621499999976 0.3341593099999969
0.2723837799999984 0.3956188900000015 0.2862421199999972
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0.2737958399999982 0.4888848800000005 0.2923449999999974
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0.6096258399999996 0.5797375000000002 0.4401078599999977
0.6388622899999987 0.7280482399999997 0.4322661799999992
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0.2864962499999990 0.5201747999999995 0.1935743599999995
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0.4787129799999974 0.4317179499999995 0.4139082200000033
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0.3191131900000030 0.4755175900000026 0.5680442600000006
0.3664323100000004 0.4895340699999977 0.6229887399999967
0.4891259700000035 0.5620880499999998 0.3189526800000024
0.4409221700000003 0.5830971700000021 0.3901494899999989
0.6381484899999990 0.6417074800000009 0.5495211799999993
0.6826082600000021 0.6266640300000006 0.4679476299999976
0.6079559399999965 0.6248343500000004 0.3004675199999980
0.5585323099999968 0.5846285300000034 0.5866860799999998
0.5552888599999974 0.5309231900000029 0.4866381599999983
0.5361431199999984 0.6243451300000018 0.4815318799999986
0.5892631899999969 0.8271880400000029 0.4483141799999970
0.5919987999999989 0.7827130000000011 0.5509384499999967
0.5577854400000035 0.7531474500000002 0.4628489299999998
0.6409894600000001 0.7528891700000031 0.2836780299999972
0.6855937999999995 0.8044360900000029 0.4937432899999976
0.6421476200000029 0.4182696000000021 0.3294884000000025
0.6705178699999976 0.4026635399999989 0.4819869100000034
0.5242104000000012 0.2900300599999994 0.3894091599999996
0.5576675800000004 0.3650869800000009 0.2770560800000013
0.5240038499999997 0.4171766099999985 0.5619811799999965
0.5435398099999986 0.2978276400000013 0.5633225999999993
0.6021881300000018 0.4349215299999969 0.6537649999999999
0.6236482999999993 0.3574222900000024 0.6522621200000032
0.6250961200000020 0.2702063600000031 0.2740170499999977
0.6099314200000023 0.2208893000000032 0.3584439799999970
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