./iterations/neb0_image06_iter19_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
  0.2860323499999993  0.4620397500000024  0.5203830499999995
  0.7480068500000030  0.4906117199999969  0.5502457199999995
  0.5961046800000034  0.4479840600000031  0.4171666900000019
  0.3546559600000023  0.5769191199999995  0.5409309699999980
  0.1709149499999967  0.4726682000000011  0.4961059099999972
  0.3311887899999988  0.3269600599999976  0.5252970100000027
  0.7085379600000010  0.4731131099999999  0.4139898299999984
  0.8511062199999984  0.5518850999999998  0.5773838900000001
  0.6834863699999971  0.4400845099999984  0.6606679799999995
  0.4276335099999997  0.5969269400000030  0.4378300600000031
  0.2962630700000020  0.6764897899999980  0.5540893399999973
  0.4140431300000031  0.5577769900000007  0.6382265499999988
  0.1467378099999976  0.5932578199999980  0.4933215399999966
  0.1197622899999971  0.4154398200000031  0.5861971100000005
  0.1466347599999978  0.4198875399999977  0.3874945100000033
  0.3933380799999995  0.3062217700000005  0.4302126099999981
  0.2552862599999983  0.2468360399999980  0.5175396100000000
  0.3807998300000008  0.3091425799999996  0.6316267999999994
  0.4046752400000031  0.6182619000000003  0.3652583300000032
  0.7334447100000006  0.5759950699999976  0.3509459300000017
  0.7497380200000023  0.3736866100000000  0.3593569299999970
  0.8958781299999998  0.5746435499999976  0.4683735799999980
  0.9095248900000001  0.4763229599999974  0.6443408700000006
  0.8423594500000036  0.6592718599999969  0.6397512300000017
  0.6001554300000009  0.5055612199999970  0.6790574700000036
  0.7400010699999982  0.4508988199999990  0.7630082800000011
  0.6592310600000033  0.3202450100000007  0.6458506999999969
  0.5708886899999968  0.3763974200000035  0.3849032600000015
  0.5480043900000027  0.5074390199999996  0.4268648099999979
 
  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