iterations/neb0_image02_iter5_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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0.4396600500000005 0.4764619600000017 0.3448291699999970
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0.6459083499999991 0.4206508899999974 0.4512991499999970
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0.3668701799999994 0.5608931000000013 0.2541871199999974
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0.3040999099999979 0.4781090199999980 0.5429758699999994
0.3517284899999993 0.4920085099999980 0.5979128199999977
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0.4674629800000005 0.5783503199999984 0.4109648499999992
0.6509700200000026 0.6386509399999980 0.5759305300000008
0.6891626800000026 0.6183145299999993 0.4903938400000030
0.6256463900000000 0.6239230999999990 0.3234546999999992
0.5586800900000028 0.5694564699999987 0.5761133700000016
0.5364616600000005 0.5424661400000019 0.4722052799999972
0.5440868000000023 0.6293832799999990 0.4931403699999990
0.6044111200000017 0.8246336799999980 0.4733214000000032
0.6072212799999974 0.7797268400000021 0.5756508999999994
0.5730947899999990 0.7500382500000029 0.4875055199999991
0.6564714800000004 0.7503956299999999 0.3095643199999998
0.7007094100000018 0.8001533300000006 0.5182697099999984
0.6574691799999997 0.4155888299999972 0.3545629400000010
0.6851105900000007 0.4002668500000013 0.5061104299999997
0.5392679200000003 0.2872473400000004 0.4137866399999979
0.5728720999999979 0.3621147899999997 0.3013268699999969
0.5387360200000018 0.4145470500000030 0.5821307499999975
0.5587192999999999 0.2957347400000003 0.5876423099999997
0.6177086799999998 0.4325118300000028 0.6778289299999969
0.6381522300000029 0.3548009900000011 0.6759837700000020
0.6406911899999983 0.2676182599999990 0.2993810199999984
0.6256207599999968 0.2187941800000033 0.3848650699999965
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