./iterations/neb1_max2_image01_iter6_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
  0.3075860100000014  0.4458831700000019  0.5185124899999991
  0.7281868500000002  0.5056163300000023  0.5522302199999984
  0.5790768000000028  0.4592708099999996  0.4189846100000025
  0.3743345399999995  0.5616954300000003  0.5403430900000004
  0.1922929699999969  0.4564458899999977  0.4941829300000009
  0.3528722900000005  0.3105809099999988  0.5235534299999998
  0.6894608300000016  0.4868353299999981  0.4154099100000010
  0.8310761299999996  0.5669456899999972  0.5793191200000010
  0.6635257900000013  0.4550010399999991  0.6622251900000009
  0.4445752999999968  0.5879660800000011  0.4360833599999978
  0.3163352700000033  0.6611858200000000  0.5536760000000029
  0.4353839400000012  0.5419452000000007  0.6358009100000004
  0.1684557999999967  0.5770795399999997  0.4914908499999981
  0.1413779900000023  0.3992631799999984  0.5844176700000006
  0.1682768300000035  0.4038206299999985  0.3854366200000001
  0.4148930200000009  0.2901753299999967  0.4282521499999987
  0.2768254799999994  0.2306305299999991  0.5154866999999967
  0.4025012000000032  0.2930560799999995  0.6297786299999970
  0.4240948099999997  0.6033783299999982  0.3615718900000005
  0.7133353299999996  0.5909568900000011  0.3527049899999994
  0.7312906800000007  0.3880896300000032  0.3606337699999997
  0.8756753799999970  0.5896353999999988  0.4701683600000024
  0.8894677899999976  0.4913388399999974  0.6462945000000033
  0.8221973899999995  0.6744123400000035  0.6415848899999972
  0.5801756799999964  0.5205384899999999  0.6809798299999983
  0.7198248999999990  0.4659194600000021  0.7648526600000025
  0.6389432100000008  0.3352251199999969  0.6476794499999983
  0.5519835200000003  0.3894647700000036  0.3859660000000034
  0.5304082099999974  0.5206121100000018  0.4288003300000014
 
  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