./transitionstate1 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
  0.2552451322729414  0.4877859797257950  0.5216460805312400
  0.7765154938287058  0.4677265589948582  0.5479130820928511
  0.6257412062987932  0.4254108881846134  0.4143462891665499
  0.3237170100256912  0.6029315954481574  0.5422140255668069
  0.1402537664818949  0.4986400971297839  0.4971265575258701
  0.2996049587916586  0.3524566070422037  0.5277547147260440
  0.7386502397478207  0.4493368177244145  0.4113681242323181
  0.8792784448280569  0.5282619086478532  0.5785634872853836
  0.7124465788311880  0.4147559029203962  0.6578739875950168
  0.3959903450255112  0.6236042638431393  0.4390726695854384
  0.2644494617536388  0.7015485843575847  0.5574759459839168
  0.3830839278453672  0.5835313270440408  0.6395821381569584
  0.1160195503256603  0.6192046655023973  0.4955843418965600
  0.0896441804347058  0.4403149859435438  0.5868025549738375
  0.1156196241053570  0.4470694179074834  0.3880000447396558
  0.3608656253724850  0.3291739152229743  0.4323552218074554
  0.2230492616832319  0.2730005862510262  0.5223440119077892
  0.3498973938718067  0.3357527562849312  0.6337992940473373
  0.3722782288912362  0.6435482648063854  0.3664430933042937
  0.7654871795811464  0.5507379242353754  0.3471189036311973
  0.7783574785251256  0.3482540777550637  0.3580498790237769
  0.9294817113907318  0.5440343829997945  0.4718875503841087
  0.9323393588059006  0.4545718488479336  0.6536106577338784
  0.8700666181326074  0.6392650016077318  0.6341158929331031
  0.6278526293883370  0.4777422107004954  0.6757369493248320
  0.7687260483546449  0.4274601245488380  0.7601807518872200
  0.6910530674775504  0.2942340033713307  0.6423506740112794
  0.5995948696271168  0.3566519699331037  0.3775265082952797
  0.5791245483013149  0.4859616530186460  0.4255771376497420
 
  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