iterations/neb0_image04_iter22_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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0.2622518299999967 0.3975739600000026 0.2694396799999978
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0.2642150499999971 0.4907541500000008 0.2764320699999985
0.1636080000000035 0.5362370599999977 0.2372653700000029
0.3556528900000018 0.5399907999999982 0.3525183499999969
0.4446767100000031 0.4753675799999968 0.3529878499999981
0.3700304700000032 0.4228472699999983 0.4769646199999968
0.6105807200000015 0.5742940599999997 0.4466585300000006
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0.6407483899999988 0.4216045599999987 0.4429396199999971
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0.2767853799999997 0.5237678700000004 0.1785629099999966
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0.2570902399999966 0.3745744499999972 0.3352682399999978
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0.1055450799999988 0.4627439899999999 0.1694772600000007
0.1165153000000032 0.4388042499999969 0.2817176499999974
0.1544512500000010 0.4167247999999972 0.1959160899999972
0.1695895499999978 0.5851939400000035 0.0997744599999990
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0.3720741699999977 0.5599667299999993 0.2626614500000031
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0.4688751300000007 0.4232299499999996 0.4057713400000011
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0.3385733100000010 0.3737021499999997 0.4366456200000002
0.4095266400000028 0.3886053499999989 0.5161807899999999
0.3092832299999984 0.4771391299999976 0.5513731500000034
0.3569034400000035 0.4910668999999999 0.6063341699999967
0.4896449299999972 0.5700039999999973 0.3133458200000021
0.4720537800000031 0.5774256199999996 0.4185578100000029
0.6457940399999984 0.6395982200000034 0.5674703899999969
0.6840488200000010 0.6193567899999977 0.4819584600000013
0.6204114700000005 0.6248186300000000 0.3150493699999970
0.5536535199999975 0.5705860599999966 0.5684139399999992
0.5319698599999967 0.5431578000000030 0.4644172100000006
0.5390260300000023 0.6302716100000012 0.4849336500000021
0.5992106300000017 0.8256189100000029 0.4648692499999996
0.6020204800000002 0.7807078800000014 0.5672017999999994
0.5678918999999993 0.7510428800000000 0.4790917899999982
0.6512795100000019 0.7513462100000012 0.3011066700000029
0.6955141500000011 0.8011455299999994 0.5098658499999971
0.6522697099999988 0.4165798399999971 0.3461945499999999
0.6799326100000016 0.4012423499999969 0.4977348399999997
0.5340640200000024 0.2882197599999969 0.4053367699999981
0.5676616699999997 0.3630656899999991 0.2929016599999983
0.5335097299999987 0.4154746700000018 0.5737857700000006
0.5535429299999990 0.2966542799999985 0.5791978700000016
0.6125122300000001 0.4334698199999991 0.6693741099999997
0.6329626599999969 0.3557881600000030 0.6675932500000030
0.6354696799999999 0.2685761799999966 0.2909031900000016
0.6203869799999993 0.2197165799999965 0.3763846399999977
0.00000000E+00 0.00000000E+00 0.00000000E+00
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