./iterations/neb0_image08_iter15_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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0.3671753599999974 0.4689241499999994 0.5566565600000004
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0.6317189900000031 0.7174666499999987 0.5054798299999987
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0.4330771200000001 0.5899606199999994 0.4068892399999982
0.2429907000000000 0.5569473799999969 0.5561194400000034
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0.5794474799999989 0.5495531700000029 0.3892765499999982
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0.5393686099999968 0.2901387300000025 0.3156460100000018
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0.1222767699999991 0.4957780200000030 0.6843944700000009
0.6534293699999978 0.5938761000000028 0.3701822499999992
0.6185637099999965 0.6126422199999979 0.2780386800000016
0.5321069800000018 0.6424165600000009 0.3790331300000034
0.6193565000000021 0.4907496399999971 0.5071154099999973
0.5610258999999971 0.4819841500000024 0.5241492999999977
0.5881114499999995 0.5579958599999983 0.5536134999999973
0.6264852199999993 0.7702293299999994 0.5236338599999968
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0.5482878400000004 0.7615285199999988 0.3737611800000025
0.6592671399999972 0.7854875199999967 0.3434329899999966
0.5228108499999990 0.4226356899999999 0.2203766399999978
0.5997247099999967 0.4406377099999972 0.1717229699999976
0.5593700900000016 0.2394262800000035 0.3768153999999981
0.5025761099999997 0.3282489200000001 0.3589451599999975
0.6468653800000013 0.3272008400000033 0.4149256700000024
0.6413868500000035 0.2496889199999970 0.2892646399999990
0.6919098799999972 0.4081016199999965 0.2965556099999986
0.6816018800000023 0.3702640599999967 0.1988497500000008
0.4932888900000023 0.2702699299999978 0.1877550399999990
0.5329134199999999 0.2115604500000003 0.1947635100000014
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