iterations/neb0_image07_iter11_CONTCAR output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
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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0.2701726100000030 0.3961643299999977 0.2822207399999996
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0.2721225399999980 0.4893586199999973 0.2892889199999971
0.1714980699999984 0.5348155599999984 0.2500498899999997
0.3636079899999984 0.5385089700000023 0.3652342500000003
0.4517001399999998 0.4730006599999967 0.3646332300000026
0.3778674799999990 0.4214510199999992 0.4899958000000026
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0.5680614199999994 0.3214810999999997 0.3597618599999990
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0.2650136299999986 0.3731573499999996 0.3480348399999968
0.3018842600000013 0.3771013699999983 0.2554727300000010
0.2433925799999983 0.3790384300000014 0.2375364199999979
0.1134483000000017 0.4612761100000000 0.1822716799999995
0.1244252600000024 0.4373373800000024 0.2945203499999991
0.1623733400000020 0.4152809500000032 0.2087146200000021
0.1774918500000027 0.5837389100000010 0.1125588199999967
0.1077658000000028 0.5835515999999998 0.3030878699999988
0.3799583699999971 0.5585001600000012 0.2754719799999990
0.3624772000000007 0.5973139199999977 0.4263159400000021
0.4768000700000030 0.4222152500000007 0.4183784000000017
0.4549182499999986 0.4563226599999979 0.2687949600000010
0.3464998199999982 0.3722767100000013 0.4494470100000001
0.4174226299999972 0.3871823100000000 0.5289148700000013
0.3172279699999976 0.4756893599999970 0.5641733699999989
0.3648060599999994 0.4895819600000024 0.6190859299999971
0.4968733400000005 0.5683687699999993 0.3265918000000028
0.4771276900000032 0.5762293299999968 0.4272637700000033
0.6378618900000035 0.6410208499999968 0.5545448199999967
0.6762016599999967 0.6208222200000009 0.4691538900000012
0.6124824700000033 0.6262368399999971 0.3023157599999990
0.5462272099999979 0.5721943799999991 0.5576755499999990
0.5276785200000020 0.5439049299999965 0.4547511600000007
0.5316120399999988 0.6312209800000019 0.4725633099999982
0.5913038799999981 0.8270439799999991 0.4520777999999979
0.5941116899999983 0.7821454199999991 0.5544442300000014
0.5599919599999978 0.7524890999999982 0.4662949699999999
0.6433578600000018 0.7527717199999984 0.2883386700000017
0.6876082100000005 0.8025757200000001 0.4970301399999997
0.6443564400000028 0.4180400500000019 0.3333446400000000
0.6720092699999967 0.4027622099999988 0.4849007199999988
0.5262046799999993 0.2897121100000035 0.3925933499999985
0.5597721000000035 0.3645161000000030 0.2802537800000025
0.5256616599999973 0.4169872800000007 0.5613165600000016
0.5456135900000021 0.2980840999999970 0.5665266500000001
0.6046102199999979 0.4349496900000034 0.6567107099999987
0.6251394800000014 0.3571675199999973 0.6548830099999989
0.6275448999999966 0.2700459799999990 0.2781708999999992
0.6124713999999969 0.2212189800000033 0.3635539300000019
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