iterations/neb0_image04_iter19_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
0.2103113699999994 0.5277729199999968 0.3182414799999975
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0.1636347499999999 0.5362164900000010 0.2372725500000001
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0.1544610099999986 0.4167237599999964 0.1959522100000015
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0.3092934599999992 0.4771371100000010 0.5513960800000035
0.3568981499999992 0.4910639799999998 0.6063395700000029
0.4896431800000016 0.5699711199999982 0.3134277300000008
0.4718657399999984 0.5774309299999985 0.4181739699999980
0.6457873000000021 0.6395966799999968 0.5674275699999995
0.6840441499999983 0.6193959200000023 0.4819257199999996
0.6203879400000005 0.6248073399999967 0.3150205800000023
0.5536733499999968 0.5706379599999991 0.5686850299999975
0.5322699900000032 0.5430739099999968 0.4646449999999973
0.5390638699999997 0.6302429799999985 0.4849796600000005
0.5991910799999971 0.8256370399999966 0.4648223599999994
0.6019995999999992 0.7807211399999971 0.5671802600000007
0.5678773500000034 0.7510703900000024 0.4790721800000028
0.6512675900000033 0.7513503300000011 0.3010583399999973
0.6955011299999967 0.8011674099999979 0.5098476900000009
0.6522532700000028 0.4166005299999966 0.3461862500000024
0.6799316899999965 0.4012568099999996 0.4977405200000007
0.5340475400000031 0.2882366099999984 0.4052928899999984
0.5676389099999994 0.3630643500000019 0.2928738600000003
0.5334795999999997 0.4154703000000026 0.5737985700000010
0.5535393899999974 0.2966309099999975 0.5791674199999974
0.6124974600000002 0.4334798699999993 0.6693337499999998
0.6329612700000027 0.3557971500000008 0.6675934000000012
0.6354416100000009 0.2685860899999994 0.2908473000000029
0.6203499800000003 0.2197155200000012 0.3763253799999973
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