./iterations/neb1_max2_image01_iter108_CONTCAR output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)

Status: finished

No title                                
   1.00000000000000     
    15.0000000000000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000   12.0000000000000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000   12.0000000000000000
   N    Si   O    H 
     3     6     1    19
Direct
  0.0774457200000001  0.9809898299999986  0.6415820300000021
  0.9604272099999989  0.6559900099999965  0.7814843499999995
  0.4746892300000027  0.4155321000000001  0.4351267500000020
  0.0869276199999973  0.3136035699999979  0.7707994800000009
  0.2527219400000007  0.0608717300000023  0.4914800600000007
  0.4346148699999972  0.1202130699999984  0.8364135500000032
  0.1900201300000006  0.0114622899999972  0.8169003599999982
  0.7962024400000018  0.1168331599999988  0.5853421899999987
  0.0274693499999970  0.7604735099999971  0.3308252200000013
  0.1463847999999999  0.4407167600000008  0.3898972300000025
  0.0918651599999976  0.6250455400000021  0.3049596600000015
  0.5079440100000028  0.6555121700000015  0.1763036400000004
  0.3424119399999981  0.1347570399999967  0.3984641999999994
  0.8429652800000014  0.8959438600000027  0.8127561499999985
  0.1142156900000018  0.8053541700000011  0.0588277000000019
  0.2747735100000028  0.7441462000000030  0.3387163299999969
  0.2988199300000005  0.5511863099999985  0.7372685099999998
  0.6731090800000032  0.7578465799999989  0.8331788200000005
  0.9975567899999973  0.3167347799999973  0.5362187699999978
  0.8295342700000035  0.1984268000000000  0.6349158000000017
  0.6673902900000002  0.3153823099999968  0.4648285700000017
  0.7826658399999999  0.1834857400000018  0.3697828299999983
  0.0300516699999989  0.9067096899999996  0.7519009700000012
  0.8189186999999976  0.3519351799999981  0.7788509100000027
  0.8861178200000026  0.7807040599999979  0.6886188499999975
  0.4961893300000000  0.8140692200000004  0.7395573100000021
  0.4573392900000002  0.6598737400000019  0.7365791300000026
  0.8516880700000016  0.0105514099999979  0.3503457899999987
  0.5548252999999974  0.2064127100000022  0.3144868700000032
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00