./iterations/neb0_image07_iter3_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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0.1713284900000005 0.5348484200000030 0.2498269199999967
0.3634255400000015 0.5385010399999999 0.3650241799999989
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0.3170501600000009 0.4757288400000022 0.5639240799999996
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0.4974318000000011 0.5688101100000011 0.3259276300000025
0.4797585100000035 0.5761349200000012 0.4311079699999993
0.6380226799999988 0.6410219200000000 0.5549654599999982
0.6762314300000014 0.6206865999999991 0.4694397100000032
0.6127148200000008 0.6263222899999974 0.3024950000000004
0.5458483999999970 0.5719101400000000 0.5552770299999992
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0.5312050300000024 0.6318227800000003 0.4722295400000007
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0.5258345599999998 0.4169165100000001 0.5612539099999978
0.5457833399999998 0.2981320499999995 0.5667267800000033
0.6047699100000017 0.4349037699999982 0.6569146499999974
0.6252235799999966 0.3571642300000022 0.6550489799999966
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0.6126855300000003 0.2211810900000017 0.3639134900000016
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