iterations/neb0_image06_iter43_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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0.1704265099999986 0.5347517299999964 0.2479181799999992
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0.1232103899999970 0.4379523400000025 0.2926173600000013
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0.1064371800000004 0.5824656699999977 0.3022942899999990
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0.3616381200000021 0.5975938699999972 0.4251209399999993
0.4756055799999999 0.4292243000000013 0.4110782200000003
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0.3158367999999996 0.4760553400000020 0.5625223500000018
0.3631184899999980 0.4903432500000022 0.6176237199999974
0.4901654399999984 0.5634214399999991 0.3173228699999981
0.4500182999999964 0.5811135300000032 0.3971534100000014
0.6405130200000002 0.6410724899999991 0.5553362400000026
0.6829341299999996 0.6246168200000000 0.4723191400000033
0.6121150099999966 0.6246113099999988 0.3052082800000022
0.5574431799999999 0.5804767200000001 0.5830003499999989
0.5496203900000012 0.5340026599999987 0.4813603599999965
0.5374997999999991 0.6264485800000017 0.4833908399999984
0.5923499100000029 0.8268717400000014 0.4533817900000017
0.5953198400000019 0.7820897000000002 0.5557816900000034
0.5608559000000000 0.7527259800000010 0.4681366800000006
0.6445560900000018 0.7524596599999995 0.2890593699999968
0.6886412400000026 0.8035138700000033 0.4992804299999989
0.6453530499999971 0.4178179999999969 0.3347461500000009
0.6736543399999988 0.4024086599999990 0.4870924200000033
0.5274252000000033 0.2897128500000008 0.3947523000000004
0.5609366899999984 0.3645414000000002 0.2825265299999984
0.5265853100000015 0.4166119899999998 0.5661922299999986
0.5466977299999982 0.2972674700000013 0.5687180199999986
0.6052523600000015 0.4343965799999978 0.6589354299999997
0.6263542599999994 0.3570385000000016 0.6573196100000018
0.6283068299999996 0.2697567299999974 0.2790781400000029
0.6131120499999980 0.2202461700000029 0.3637930100000020
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