./iterations/neb0_image05_iter14_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
  0.2801308399999982  0.4665484699999993  0.5209527900000026
  0.7535693000000023  0.4864755199999991  0.5497717399999971
  0.6014885299999975  0.4440977200000020  0.4166879200000011
  0.3489468200000019  0.5813240100000030  0.5411914800000019
  0.1649979500000001  0.4771838099999997  0.4967488500000030
  0.3251579499999977  0.3314013999999972  0.5257826100000003
  0.7140147400000032  0.4690846800000017  0.4135508000000030
  0.8567077599999990  0.5476833000000028  0.5769055900000026
  0.6890560200000024  0.4359500999999995  0.6602205200000029
  0.4221761200000032  0.6006585299999969  0.4381955699999978
  0.2903487900000030  0.6808300900000006  0.5545444799999970
  0.4080029699999983  0.5622254399999989  0.6387665600000005
  0.1407157000000012  0.5976572100000013  0.4939484499999978
  0.1138089399999984  0.4198834500000004  0.5867346200000014
  0.1406168600000015  0.4244242600000021  0.3881146599999994
  0.3873699999999971  0.3106823600000013  0.4307627100000033
  0.2492525099999980  0.2512645799999973  0.5180039999999977
  0.3747224500000002  0.3135923000000034  0.6321120799999989
  0.3987971199999976  0.6225534100000019  0.3659238299999998
  0.7389854099999980  0.5718809899999968  0.3504098900000017
  0.7550929200000027  0.3695531999999986  0.3589624299999983
  0.9014637200000024  0.5704150999999982  0.4678831200000033
  0.9150890100000026  0.4721618399999983  0.6438696499999992
  0.8479416600000036  0.6550897700000036  0.6391734799999966
  0.6057252100000028  0.5014480500000005  0.6785331100000036
  0.7456263699999965  0.4467764600000024  0.7624983799999967
  0.6648429700000023  0.3161570500000010  0.6453005400000009
  0.5762686899999991  0.3724845200000004  0.3844230600000031
  0.5535166200000035  0.5034807299999997  0.4264476800000025
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00