iterations/neb0_image08_iter72_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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0.1132490600000011 0.4600895299999976 0.1823418900000036
0.1246188799999999 0.4364177900000001 0.2952769300000000
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0.4576985899999997 0.4834140800000029 0.2856804400000001
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0.4204675599999987 0.3874773499999975 0.5264488999999983
0.3159356000000031 0.4739831899999984 0.5614643500000014
0.3685591400000021 0.4886928700000013 0.6187715399999973
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0.5136406399999984 0.5405186200000003 0.4499111800000009
0.6292229000000020 0.6391942599999965 0.5565080000000009
0.6629077899999984 0.6043526899999989 0.4496458699999977
0.6159658999999991 0.6288202200000015 0.3010805899999980
0.5294752100000011 0.5606963800000031 0.5414410400000023
0.5256601500000002 0.5534753100000032 0.4177260200000035
0.5303359899999975 0.6453343100000026 0.4685149000000024
0.5927940799999973 0.8248409999999993 0.4512922199999991
0.5941788599999995 0.7810760899999991 0.5543831199999971
0.5620248099999969 0.7500233000000023 0.4657670400000029
0.6432726900000034 0.7529760299999992 0.2935784499999983
0.6867188800000008 0.8005504799999983 0.4945988999999997
0.6445311700000005 0.4200393300000016 0.3315416599999992
0.6715084599999983 0.4025828300000001 0.4833841800000016
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0.5593665700000017 0.3658688900000016 0.2781292199999967
0.5253134900000020 0.4163425099999998 0.5557781099999985
0.5460278700000032 0.2994910899999965 0.5643581300000022
0.6042999499999979 0.4346481700000027 0.6563720999999987
0.6238772499999996 0.3564687499999977 0.6518516300000030
0.6276821299999966 0.2700223399999970 0.2785318600000011
0.6126042400000031 0.2220020999999974 0.3638072399999999
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