./neb1_max1_image01_OSZICAR.out output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)

Status: finished

       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.413152748834E+03    0.41315E+03   -0.15819E+04   424   0.706E+02 
DAV:   2    -0.100282948923E+02   -0.42318E+03   -0.40578E+03   595   0.165E+02 
DAV:   3    -0.140050898849E+03   -0.13002E+03   -0.12931E+03   528   0.983E+01 
DAV:   4    -0.148949933305E+03   -0.88990E+01   -0.88779E+01   464   0.317E+01 
DAV:   5    -0.149192909588E+03   -0.24298E+00   -0.24285E+00   528   0.482E+00    0.248E+01
DAV:   6    -0.136728011355E+03    0.12465E+02   -0.37524E+01   457   0.261E+01    0.131E+01
DAV:   7    -0.135296730514E+03    0.14313E+01   -0.49945E+00   496   0.903E+00    0.603E+00
DAV:   8    -0.134667618069E+03    0.62911E+00   -0.91270E-01   472   0.442E+00    0.212E+00
DAV:   9    -0.134508786643E+03    0.15883E+00   -0.30210E-01   464   0.219E+00    0.595E-01
DAV:  10    -0.134489485861E+03    0.19301E-01   -0.51723E-02   473   0.976E-01    0.395E-01
DAV:  11    -0.134481345688E+03    0.81402E-02   -0.94542E-03   464   0.444E-01    0.179E-01
DAV:  12    -0.134477524441E+03    0.38212E-02   -0.70445E-03   464   0.299E-01    0.123E-01
DAV:  13    -0.134480703379E+03   -0.31789E-02   -0.31024E-03   465   0.249E-01    0.869E-02
DAV:  14    -0.134488345837E+03   -0.76425E-02   -0.27722E-03   456   0.210E-01    0.528E-02
DAV:  15    -0.134494050443E+03   -0.57046E-02   -0.94027E-04   504   0.125E-01    0.447E-02
DAV:  16    -0.134497966687E+03   -0.39162E-02   -0.47845E-04   472   0.849E-02    0.332E-02
DAV:  17    -0.134499686467E+03   -0.17198E-02   -0.26637E-04   528   0.690E-02    0.126E-02
DAV:  18    -0.134501166245E+03   -0.14798E-02   -0.16489E-04   464   0.453E-02    0.184E-02
DAV:  19    -0.134501536241E+03   -0.37000E-03   -0.12375E-05   376   0.147E-02    0.118E-02
DAV:  20    -0.134502151271E+03   -0.61503E-03   -0.11371E-04   457   0.391E-02    0.106E-02
DAV:  21    -0.134502181527E+03   -0.30257E-04   -0.12156E-05   392   0.172E-02    0.774E-03
DAV:  22    -0.134502248154E+03   -0.66626E-04   -0.22315E-05   417   0.188E-02    0.392E-03
DAV:  23    -0.134502291211E+03   -0.43057E-04   -0.43866E-06   336   0.105E-02    0.184E-03
DAV:  24    -0.134502306545E+03   -0.15334E-04   -0.16330E-06   328   0.453E-03    0.148E-03
DAV:  25    -0.134502311365E+03   -0.48204E-05   -0.38988E-07   352   0.218E-03 
   1 F= -.13450231E+03 E0= -.13450760E+03  d E =0.158575E-01