./iterations/neb0_image03_iter16_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
  0.2682462000000001  0.4754144400000015  0.5220913200000012
  0.7645452800000001  0.4783693600000021  0.5487609500000019
  0.6124426499999984  0.4358874099999994  0.4156875099999979
  0.3372383199999973  0.5901227900000023  0.5420093899999969
  0.1531463000000031  0.4859991399999970  0.4977580600000024
  0.3132308899999998  0.3402880900000014  0.5268206800000002
  0.7251219099999986  0.4609632100000027  0.4124855800000020
  0.8677174299999990  0.5394772499999974  0.5760055399999970
  0.7001486899999989  0.4276852300000016  0.6592838899999975
  0.4105969599999995  0.6091365999999994  0.4392118900000028
  0.2784835799999996  0.6894910999999979  0.5557623400000011
  0.3960373199999978  0.5710269799999992  0.6397886800000023
  0.1288275100000007  0.6064556400000001  0.4949957299999994
  0.1020414199999991  0.4286814600000000  0.5877397300000027
  0.1286857099999992  0.4332484700000023  0.3891594500000011
  0.3755221799999973  0.3194695899999971  0.4318672500000034
  0.2373963499999974  0.2600467899999970  0.5191372700000016
  0.3628206200000008  0.3224212900000012  0.6331181199999989
  0.3869612399999980  0.6312946299999993  0.3670827700000032
  0.7500841499999993  0.5637240300000030  0.3493338700000024
  0.7659673400000031  0.3613309400000020  0.3579733899999979
  0.9125761100000034  0.5621496799999974  0.4669964100000001
  0.9260101500000033  0.4639252899999988  0.6429493300000004
  0.8590142199999988  0.6469341900000032  0.6381651599999998
  0.6168365600000030  0.4932371000000018  0.6774545199999977
  0.7567667200000017  0.4385796700000029  0.7615133700000030
  0.6759907300000023  0.3079015900000002  0.6442949600000034
  0.5871176899999995  0.3643632200000013  0.3834163699999991
  0.5648597200000012  0.4953431899999998  0.4255570300000002
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00