iterations/neb0_image05_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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0.2659447200000002 0.3963605400000034 0.2762161799999987
0.1359583200000003 0.4555259799999973 0.2254537499999998
0.6513790699999973 0.6403385799999981 0.4881743899999975
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0.2681368499999977 0.4897245000000012 0.2827251900000007
0.1674964999999986 0.5351858200000024 0.2432323700000012
0.3585499200000015 0.5396296099999986 0.3579401200000021
0.4446931599999999 0.4728984600000032 0.3495224099999987
0.3732852699999967 0.4213680299999965 0.4822757299999978
0.6111516599999973 0.5771814200000023 0.4460369600000007
0.6450874399999975 0.7267181799999989 0.4427766100000028
0.6377239999999986 0.4220936800000032 0.4363610899999983
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0.2804643899999988 0.5204188399999978 0.1833427899999975
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0.1915140699999967 0.5621956600000004 0.1488128700000004
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0.2605568500000004 0.3729603299999980 0.3417997000000028
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0.1095325799999998 0.4621956599999990 0.1756117400000008
0.1203567499999991 0.4384350600000033 0.2877336600000007
0.1579433599999973 0.4152120199999985 0.2020928999999967
0.1727288399999978 0.5849237700000032 0.1062506700000014
0.1036708399999995 0.5824002800000017 0.2977148200000030
0.3746125300000003 0.5592938699999976 0.2689366500000006
0.3584688199999988 0.5978037000000000 0.4206994700000024
0.4728276000000022 0.4295940200000032 0.4053325900000004
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0.3419246799999982 0.3716112600000017 0.4446035699999982
0.4132327800000013 0.3879277500000029 0.5220732200000029
0.3128195199999979 0.4763376399999970 0.5575253100000026
0.3601878400000018 0.4907299799999976 0.6123994800000006
0.4885960000000011 0.5655595799999986 0.3134820300000030
0.4554913200000001 0.5818841700000021 0.3984234599999965
0.6455089500000000 0.6417922700000034 0.5610455999999999
0.6862872600000003 0.6252084699999969 0.4775214800000001
0.6144097199999976 0.6239961499999964 0.3112201799999994
0.5594672499999973 0.5793603500000017 0.5808320699999996
0.5406779899999989 0.5365439799999976 0.4829191800000032
0.5381136199999972 0.6265163799999982 0.4878602400000034
0.5955411500000025 0.8264931200000021 0.4584173000000007
0.5985180899999989 0.7819252999999975 0.5607122999999987
0.5643861599999980 0.7520047300000030 0.4728259299999991
0.6475294800000029 0.7519900799999988 0.2932386800000018
0.6922485699999967 0.8036117300000001 0.5038622000000004
0.6484588200000019 0.4173252399999967 0.3408788999999999
0.6767715300000035 0.4013390499999971 0.4921073300000032
0.5302672600000022 0.2893324300000018 0.3999017699999996
0.5638871499999993 0.3639694900000023 0.2874005099999977
0.5292845600000007 0.4154881500000016 0.5693061999999998
0.5500445300000010 0.2971358799999990 0.5726957899999974
0.6081131400000004 0.4336753400000006 0.6633841000000018
0.6289515599999973 0.3568312100000028 0.6614812500000014
0.6311990100000031 0.2691279699999996 0.2832550500000011
0.6156698799999987 0.2191504800000033 0.3680845100000028
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