./iterations/neb1_max2_image01_iter27_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
  0.3089171399999984  0.4450155700000025  0.5184318200000035
  0.7272293999999988  0.5064422900000025  0.5526114500000006
  0.5779440399999984  0.4589060799999984  0.4192961099999977
  0.3747610200000011  0.5613800900000001  0.5405553100000020
  0.1933524100000028  0.4553016099999994  0.4939716599999997
  0.3543443399999973  0.3094491000000019  0.5235058000000024
  0.6890347499999976  0.4868736800000022  0.4153205499999970
  0.8299635500000022  0.5680170799999971  0.5794996300000008
  0.6624559300000001  0.4559323300000031  0.6621727799999988
  0.4447430900000029  0.5904823600000029  0.4356553699999992
  0.3161249999999995  0.6604961900000035  0.5552713800000006
  0.4364604100000022  0.5412409400000016  0.6352329300000008
  0.1698306400000007  0.5759185200000019  0.4912865800000006
  0.1427048500000012  0.3981661299999999  0.5842682800000034
  0.1696278000000007  0.4026341100000010  0.3852159999999998
  0.4162319200000013  0.2891097899999977  0.4280519699999985
  0.2782684900000021  0.2296228900000017  0.5154361399999985
  0.4039390200000028  0.2920692000000003  0.6296167799999992
  0.4236413400000032  0.6030506900000034  0.3609064999999987
  0.7121903099999969  0.5917685800000001  0.3527279500000020
  0.7314157799999990  0.3887434600000006  0.3604102299999994
  0.8744119999999995  0.5907083700000015  0.4703203600000023
  0.8882987400000033  0.4923877000000019  0.6464894699999988
  0.8208873600000004  0.6754540700000007  0.6417724699999994
  0.5790817900000036  0.5215743600000025  0.6810911700000020
  0.7185692600000024  0.4668788999999975  0.7649309600000009
  0.6376536499999972  0.3361455800000002  0.6478512999999992
  0.5517373200000009  0.3890812100000005  0.3855438100000015
  0.5306126199999994  0.5201174199999983  0.4289757600000002
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00