iterations/neb0_image05_iter74_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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0.2653051099999999 0.3967178199999992 0.2746329900000006
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0.2668693099999970 0.4897817200000034 0.2811504399999976
0.1666325599999965 0.5356551899999999 0.2422453900000008
0.3579474800000000 0.5390775600000026 0.3573522000000011
0.4460290700000016 0.4730808600000032 0.3544926799999999
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0.6090842099999989 0.5749512499999980 0.4437878499999997
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0.5734717899999993 0.3209546699999990 0.3691810899999979
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0.1195526599999965 0.4382619599999984 0.2868533400000004
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0.1029477299999968 0.5838662499999998 0.2957058300000028
0.3741064199999968 0.5596626600000008 0.2666028599999990
0.3578472000000019 0.5977830900000001 0.4185615199999972
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0.4482642899999973 0.4539050899999992 0.2598065600000012
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0.4125051600000020 0.3883931599999997 0.5204336400000003
0.3121652399999988 0.4762668400000010 0.5560876899999982
0.3601761899999971 0.4901993900000008 0.6109035899999995
0.4919416600000019 0.5708189899999994 0.3141583000000026
0.4684364700000003 0.5793780899999987 0.4146381500000018
0.6447356799999966 0.6412318200000016 0.5627773200000021
0.6823684100000023 0.6214953699999981 0.4772094699999982
0.6166093200000020 0.6256507599999992 0.3110096300000009
0.5541900699999971 0.5733849599999985 0.5692111400000002
0.5317925700000004 0.5414113000000000 0.4702822300000022
0.5365294400000025 0.6293118999999976 0.4833089700000031
0.5963912599999972 0.8257448800000020 0.4596006100000025
0.5991293299999967 0.7812423499999994 0.5620443800000032
0.5653113199999993 0.7513216099999980 0.4738897399999971
0.6481468799999988 0.7519744700000004 0.2959498800000020
0.6926829200000029 0.8027329100000031 0.5050467399999974
0.6493622599999966 0.4169518100000005 0.3405887300000003
0.6770388600000032 0.4008370499999998 0.4924983699999999
0.5310377899999992 0.2892454500000028 0.4004228000000012
0.5644289600000008 0.3639920500000002 0.2877616800000027
0.5304590499999975 0.4156687400000010 0.5691540099999983
0.5506994799999987 0.2968408300000007 0.5741556199999991
0.6091802600000022 0.4324036800000002 0.6642197800000034
0.6294086699999966 0.3573176800000013 0.6624753600000020
0.6324289399999969 0.2693697300000011 0.2847820699999986
0.6167924299999967 0.2198482599999991 0.3710146199999969
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