./iterations/neb0_image05_iter7_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
  0.2801315199999976  0.4664769500000006  0.5209064399999974
  0.7535610300000002  0.4864800900000006  0.5497116299999973
  0.6014760600000031  0.4440303299999968  0.4166881299999972
  0.3489429199999989  0.5813496900000032  0.5411473400000020
  0.1650048699999971  0.4771563199999989  0.4967707500000031
  0.3251635600000000  0.3313724400000027  0.5257905899999997
  0.7140477599999997  0.4691297500000005  0.4135510600000032
  0.8567194600000008  0.5476957099999993  0.5769473599999984
  0.6890357400000013  0.4359342500000025  0.6602573999999990
  0.4220266299999977  0.6008130600000001  0.4381982600000001
  0.2903351200000017  0.6808964800000012  0.5545031600000030
  0.4080490300000008  0.5622233100000003  0.6388102200000034
  0.1407384800000031  0.5975848900000003  0.4940009000000032
  0.1138380800000007  0.4198258699999968  0.5867894900000010
  0.1406334999999999  0.4244030899999984  0.3880636199999969
  0.3873944999999992  0.3107142300000021  0.4307849300000015
  0.2492361700000032  0.2512419600000015  0.5179418199999972
  0.3747474600000018  0.3135795900000033  0.6321585399999989
  0.3987832099999977  0.6225453899999991  0.3658790499999967
  0.7389547499999978  0.5719180299999991  0.3503926599999971
  0.7551339299999995  0.3695138699999987  0.3589607700000030
  0.9014471500000028  0.5704147300000031  0.4678772500000008
  0.9150941500000016  0.4721881500000009  0.6438981800000008
  0.8479309000000015  0.6551295399999972  0.6391717200000002
  0.6057225300000013  0.5014624100000020  0.6785615399999969
  0.7456269999999989  0.4467965500000020  0.7625190099999983
  0.6648058500000005  0.3161640499999976  0.6452767899999969
  0.5763229200000026  0.3724813899999972  0.3844145799999978
  0.5535296600000024  0.5034462400000024  0.4264473699999982
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00