./iterations/neb0_image08_iter19_CONTCAR output for 42: 3.3A-->1.3A 712(amd-3) Si-CH3H...HO-Si two dimer closed (TSS for CH3...OH)
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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0.6186703699999967 0.6124751999999987 0.2778661899999975
0.5337802999999965 0.6437964100000002 0.3791853099999969
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0.5609898399999977 0.4819581100000008 0.5238402600000001
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0.6264198699999994 0.7701014800000010 0.5236487700000012
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0.6918830999999983 0.4079651099999992 0.2965566499999994
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0.5328376000000006 0.2114437199999983 0.1948203299999989
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