iterations/neb0_image07_iter21_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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0.2702679799999999 0.3961260100000032 0.2824122700000018
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0.1716045800000003 0.5347733799999972 0.2502197100000032
0.3635982099999993 0.5386574300000007 0.3652879699999971
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0.3779005999999967 0.4211318999999989 0.4901696000000015
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0.3172240700000017 0.4757138000000012 0.5643078100000025
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0.4965607099999971 0.5678276699999998 0.3255064900000022
0.4752616800000027 0.5765632800000020 0.4263113000000018
0.6378107000000028 0.6409969799999971 0.5542787899999979
0.6765811799999994 0.6210703699999982 0.4690576300000018
0.6122398600000025 0.6260725100000002 0.3022646900000012
0.5469628999999969 0.5729469500000022 0.5595477099999968
0.5287192999999988 0.5429237600000008 0.4556428400000030
0.5318244500000020 0.6312109500000034 0.4730091400000020
0.5912222500000013 0.8270376700000028 0.4519198300000014
0.5940159199999968 0.7821763199999978 0.5542837500000033
0.5598938099999984 0.7525270499999976 0.4661544100000015
0.6432518499999986 0.7527583099999973 0.2881627000000009
0.6875094199999978 0.8026527000000030 0.4968956299999974
0.6442435700000004 0.4180716300000000 0.3332634599999977
0.6719365800000006 0.4027880800000005 0.4847816199999997
0.5261424500000018 0.2897119699999990 0.3924563899999995
0.5596993999999995 0.3644793500000034 0.2801976699999997
0.5255570100000000 0.4170339300000023 0.5613267900000025
0.5455176099999974 0.2981145999999981 0.5663259900000028
0.6044510299999999 0.4347259899999969 0.6564702499999981
0.6248975900000033 0.3573181800000000 0.6546412699999991
0.6275227400000034 0.2700657399999997 0.2778461300000004
0.6124148199999979 0.2210355100000001 0.3634552899999974
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