iterations/neb0_image04_iter33_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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0.2623311400000006 0.3974568000000005 0.2697121599999974
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0.1637431500000019 0.5362071899999989 0.2373986500000029
0.3556962199999987 0.5401039200000000 0.3527495399999978
0.4444132599999975 0.4752136899999968 0.3522236399999983
0.3700899899999968 0.4227569299999985 0.4772588700000000
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0.6475342700000013 0.7248912599999997 0.4492376399999998
0.6407048100000026 0.4216264200000026 0.4429211899999999
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0.3042057999999983 0.5111749900000007 0.3474238200000030
0.1881534299999998 0.5621361199999981 0.1430687300000031
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0.2183180700000023 0.5786010799999985 0.3424046900000022
0.2513807200000002 0.5439494399999987 0.1478789100000029
0.2571365000000014 0.3743883799999992 0.3354753300000013
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0.2355571200000028 0.3804982600000031 0.2249285299999997
0.1056552699999997 0.4628173500000017 0.1696582300000031
0.1165859199999986 0.4388715500000018 0.2819350099999980
0.1545051100000023 0.4166277699999981 0.1961208099999965
0.1696346100000028 0.5852372700000004 0.0999830599999996
0.0999887400000006 0.5847543699999989 0.2905748900000020
0.3721617100000003 0.5600237299999975 0.2629698599999983
0.3546320600000001 0.5988605599999985 0.4138714099999987
0.4689600399999989 0.4235327299999980 0.4055847699999973
0.4468111999999991 0.4571694600000029 0.2558523300000033
0.3386713700000001 0.3736109000000027 0.4367918800000012
0.4096559299999996 0.3885632400000034 0.5162396300000012
0.3093180500000017 0.4770665200000010 0.5514679500000028
0.3569040799999996 0.4910869599999970 0.6064798499999995
0.4895698400000015 0.5694483899999980 0.3129483600000000
0.4706038699999979 0.5776391699999976 0.4169682899999998
0.6458261300000032 0.6396481000000023 0.5672136499999993
0.6843186700000032 0.6197440999999984 0.4818006100000005
0.6201876599999991 0.6247032799999985 0.3149306299999992
0.5541288800000004 0.5711978900000005 0.5699491199999969
0.5332558599999970 0.5424825500000026 0.4659027399999971
0.5392523000000011 0.6299770500000008 0.4854200300000002
0.5991093399999983 0.8257184400000028 0.4646225400000006
0.6019357099999993 0.7808081100000024 0.5669575599999988
0.5677540000000008 0.7511795500000034 0.4789282600000035
0.6512146600000008 0.7513761299999970 0.3007964500000000
0.6954129100000017 0.8012966900000009 0.5097681600000001
0.6521854699999992 0.4166627999999974 0.3461326799999966
0.6799011499999992 0.4012600900000010 0.4977340299999966
0.5339788499999969 0.2883439900000013 0.4051057100000008
0.5675424499999977 0.3631372500000012 0.2926880400000016
0.5333531599999972 0.4153430000000000 0.5738662400000010
0.5535219100000006 0.2965430699999985 0.5790211699999972
0.6123876500000023 0.4334824000000026 0.6691124399999993
0.6328785199999984 0.3558732899999981 0.6675166599999969
0.6353098299999971 0.2685913799999966 0.2905420299999975
0.6201731800000019 0.2196628499999989 0.3759675200000032
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