iterations/neb0_image09_iter58_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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0.2787892300000010 0.4873342699999981 0.3049543099999994
0.1807722499999969 0.5334076800000034 0.2662712799999980
0.3638052700000003 0.5291838200000001 0.3794088300000027
0.4390957199999974 0.4618144299999969 0.3280380599999972
0.3838980499999991 0.4148224699999972 0.5026471799999968
0.6166623200000032 0.5792820599999970 0.4402162499999989
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0.6274565699999997 0.4236268499999980 0.4136381499999970
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0.1349726999999987 0.4363046599999976 0.3112667600000023
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0.1177774399999976 0.5794127099999997 0.3221436299999993
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0.4448904699999972 0.3985771799999966 0.2545295999999979
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0.4248453699999999 0.3868948699999990 0.5424727500000017
0.3277331199999978 0.4744743899999975 0.5859259500000036
0.3735384000000010 0.4862350499999977 0.6346037499999966
0.4528690799999993 0.5779933600000007 0.3008987400000009
0.3779402099999984 0.6131797299999988 0.3030449000000033
0.6537038499999994 0.6529004000000000 0.5367066199999968
0.6988332800000023 0.6547927399999978 0.4728481599999981
0.5908196600000011 0.6213031999999998 0.3054493799999989
0.5896510099999972 0.6147614899999994 0.6012368900000027
0.5775483099999974 0.5273122600000022 0.5777633399999971
0.5427583399999989 0.5859753499999982 0.5129064300000010
0.5822204099999979 0.8257199299999982 0.4339322900000013
0.5846449200000023 0.7829707400000032 0.5364634000000024
0.5520387500000012 0.7517926800000012 0.4476511900000020
0.6319043199999967 0.7557668000000035 0.2645187299999989
0.6797154699999979 0.8152431500000006 0.4824690299999972
0.6340783400000021 0.4154448999999971 0.3160003400000022
0.6645633199999992 0.3955641399999976 0.4671996599999986
0.5160139799999968 0.2905566700000008 0.3764624100000020
0.5491968199999988 0.3665313400000016 0.2648942100000014
0.5191109499999982 0.4186229999999966 0.5612823299999974
0.5361943999999994 0.2985494799999984 0.5501770799999974
0.5949475500000005 0.4344498600000009 0.6434270499999997
0.6196039900000017 0.3591142100000013 0.6427410300000034
0.6166179700000001 0.2716182200000006 0.2597238700000020
0.6013168500000035 0.2213037300000025 0.3434041000000008
0.00000000E+00 0.00000000E+00 0.00000000E+00
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