./iterations/neb0_image02_iter11_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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0.6261887200000018 0.3327242499999983 0.2903964300000013
0.6131645500000005 0.2649210100000019 0.4774742199999977
0.5077052600000016 0.4028402100000008 0.4190145600000008
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