iterations/neb0_image03_iter17_CONTCAR output for 43: 3.6A-->1.6A 715(amd-3) Si-CH2H...H2HC-Si two dimer closed (TSS)
Status:
finished
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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0.1028097700000004 0.4601983499999989 0.6222481000000002
0.5695977099999965 0.3641794199999993 0.2637644499999965
0.6243362499999989 0.3375550100000027 0.2901255900000024
0.6113172800000015 0.2697689299999979 0.4772194700000014
0.5059377899999973 0.4075317200000015 0.4187277999999992
0.5237544000000014 0.3961196899999990 0.5308185399999985
0.5081936999999996 0.3256856699999986 0.4656918700000006
0.5028532899999973 0.1795867399999977 0.2635439700000006
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0.4917470399999999 0.2555908399999964 0.3209415500000006
0.5910492000000005 0.1563770899999994 0.3837916199999967
0.5895658399999988 0.2023223899999991 0.1531292299999976
0.6726321499999983 0.4570652299999978 0.5410226999999992
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0.5614158699999976 0.6197842600000030 0.4160495300000022
0.6281714200000010 0.6893955500000004 0.4264355899999970
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0.6538855800000007 0.6048403200000010 0.2745051400000023
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0.7113064999999992 0.6534266299999985 0.6069327599999994
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