iterations/neb0_image08_iter60_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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0.2807436399999972 0.3933567400000015 0.3006121000000022
0.1507551199999995 0.4533483299999972 0.2488920099999987
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0.2793655899999976 0.4868339499999976 0.3052966200000000
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0.3637803399999981 0.5305947299999971 0.3786345800000035
0.4391428899999994 0.4634825899999981 0.3292153599999992
0.3848302099999970 0.4153728300000026 0.5017610800000014
0.6135618899999997 0.5792278400000015 0.4402216300000035
0.6393105800000001 0.7305035500000017 0.4187350799999976
0.6271776600000010 0.4239620500000001 0.4134587100000005
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0.1352665900000005 0.4368625700000024 0.3116569499999997
0.1726747499999988 0.4127013100000028 0.2261386599999966
0.1875778100000005 0.5825623699999980 0.1303951299999966
0.1180637499999975 0.5786838300000028 0.3225393299999979
0.3731448899999990 0.5530979299999998 0.2840956800000001
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0.4839218400000007 0.4658937100000031 0.3878927900000022
0.4446649200000010 0.3983422399999981 0.2581796099999991
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0.3276698499999995 0.4742291800000018 0.5850316800000002
0.3741054799999972 0.4864289699999986 0.6355234199999984
0.4569429800000009 0.5788017599999975 0.3120232899999991
0.3941344099999995 0.5999615799999987 0.2937573999999969
0.6531551300000018 0.6529238000000035 0.5373613399999968
0.6992023800000027 0.6544079100000033 0.4725733699999992
0.5906514899999991 0.6217760899999973 0.3020611800000026
0.5896426400000010 0.6160928199999987 0.5995770299999990
0.5655198600000020 0.5250625700000029 0.5745697600000028
0.5396357699999967 0.5895506299999980 0.5101693499999982
0.5819248800000025 0.8260189499999981 0.4331321800000012
0.5844739899999993 0.7833434400000030 0.5354794400000031
0.5517895699999968 0.7519765500000020 0.4467130399999988
0.6316853200000025 0.7559235499999986 0.2640126599999988
0.6795136900000003 0.8159344000000033 0.4833590000000001
0.6337688999999997 0.4150574000000020 0.3156980199999992
0.6644111199999969 0.3946698199999972 0.4671074999999973
0.5155312699999968 0.2908457099999993 0.3760765800000030
0.5486299700000004 0.3665317999999971 0.2644828299999986
0.5178034699999969 0.4181415400000006 0.5574657399999978
0.5355620200000004 0.2985575900000015 0.5493920799999970
0.5941905600000013 0.4347647100000032 0.6425706500000032
0.6186208000000022 0.3592299999999966 0.6414692700000018
0.6154985499999981 0.2718638300000009 0.2588214600000001
0.6001679399999986 0.2211144600000026 0.3425848500000015
0.00000000E+00 0.00000000E+00 0.00000000E+00
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