./iterations/neb1_max2_image01_iter114_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
  0.0768304099999995  0.9812472799999981  0.6416401700000023
  0.9610385900000011  0.6555699800000028  0.7810964299999981
  0.4771398800000028  0.4125219000000016  0.4351343200000031
  0.0847825099999966  0.3149566199999967  0.7724192000000016
  0.2522610400000005  0.0611743600000025  0.4914777999999984
  0.4341525099999970  0.1206209899999990  0.8365654799999973
  0.1917760500000014  0.0102477800000003  0.8165975399999965
  0.7966775499999983  0.1166002000000006  0.5853399599999989
  0.0281466400000028  0.7601240099999984  0.3306588800000014
  0.1417169599999966  0.4471232499999971  0.3893863899999985
  0.0902798300000001  0.6255259699999982  0.3063038100000028
  0.5069925900000030  0.6560646100000014  0.1755896199999967
  0.3419977200000019  0.1350361900000010  0.3984199000000004
  0.8423195700000008  0.8961936500000007  0.8128675299999983
  0.1136904299999983  0.8055592799999971  0.0586708200000032
  0.2742023099999997  0.7443747200000033  0.3386751600000011
  0.2983338499999988  0.5513520299999968  0.7373789099999968
  0.6727437899999984  0.7580787300000011  0.8332807600000010
  0.9953717100000006  0.3180844899999968  0.5358039899999980
  0.8300911600000020  0.1977348300000017  0.6350629000000012
  0.6693349299999980  0.3148520900000022  0.4643871500000003
  0.7831185000000005  0.1832806999999974  0.3697348600000012
  0.0306185499999998  0.9064210000000017  0.7519485899999978
  0.8194173199999994  0.3517692400000030  0.7789164499999970
  0.8867716999999971  0.7803306300000017  0.6886238900000023
  0.4965770000000020  0.8137422000000001  0.7395468899999997
  0.4577486700000009  0.6595410099999981  0.7366234699999978
  0.8533195500000019  0.0088731900000028  0.3498326400000025
  0.5578359800000001  0.2037562100000017  0.3144285199999999
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00