./iterations/neb0_image02_iter25_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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0.6131794699999986 0.2648569199999997 0.4774521000000007
0.5077257700000004 0.4028685899999971 0.4190048099999970
0.5255922699999971 0.3913322200000025 0.5311112999999992
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0.5047470000000018 0.1747131300000007 0.2638304600000012
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0.6300337799999980 0.6845370599999967 0.4265870099999987
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