iterations/neb0_image07_iter56_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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0.3207684899999990 0.4750734699999981 0.5714949700000034
0.3677483700000010 0.4885974399999995 0.6251296399999973
0.4778660599999967 0.5680448499999997 0.3185103599999977
0.4282856700000011 0.5875048999999990 0.3542054899999982
0.6447748000000004 0.6455486300000004 0.5478387699999985
0.6890437400000025 0.6359129000000010 0.4715198900000033
0.6030964999999995 0.6234761899999981 0.3031394799999987
0.5699773500000020 0.5945622099999994 0.5909393600000001
0.5533094199999979 0.5295175700000030 0.5164997199999988
0.5364330100000032 0.6148323000000033 0.4913411900000000
0.5879952000000017 0.8265444600000009 0.4455061900000032
0.5907232899999997 0.7828013700000014 0.5476939799999982
0.5569762000000011 0.7526671700000023 0.4597022700000011
0.6390644000000023 0.7537482299999994 0.2786633199999997
0.6846846299999996 0.8081076699999983 0.4921581999999987
0.6405880100000019 0.4170352200000025 0.3280610799999977
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0.5228597500000021 0.4171812499999987 0.5609439099999989
0.5423224000000033 0.2982277199999999 0.5605323500000026
0.6010486200000003 0.4361503900000017 0.6527713500000019
0.6238056600000021 0.3573670099999973 0.6507580999999973
0.6229333200000013 0.2704522499999982 0.2707336499999968
0.6076014799999996 0.2207135000000022 0.3546077999999966
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