15
Coordinates from ORCA-job orca E -561.457565070563
  N       1.505761      0.619438     -0.145979
  C       1.704680     -0.754135     -0.378643
  N       0.533976     -1.514460     -0.311407
  C       0.320743      1.342760      0.140212
  C      -0.801332      0.431405      0.176572
  C      -0.687962     -0.942131     -0.043000
  N      -2.147329      0.633924      0.409738
  C      -2.750358     -0.587895      0.320608
  N      -1.891646     -1.571819      0.045907
  H      -3.830495     -0.718717      0.464538
  O       2.801627     -1.233906     -0.617192
  O       0.316222      2.556354      0.318720
  H      -2.577475      1.538509      0.608288
  H       0.621866     -2.518529     -0.475930
  H       2.362930      1.177672     -0.194197
15
Coordinates from ORCA-job orca E -561.457565167897
  N       1.505777      0.619423     -0.145919
  C       1.704646     -0.754115     -0.378771
  N       0.533913     -1.514399     -0.311838
  C       0.320718      1.342814      0.139977
  C      -0.801346      0.431476      0.176346
  C      -0.687989     -0.942091     -0.043179
  N      -2.147342      0.633908      0.409602
  C      -2.750368     -0.587953      0.320747
  N      -1.891594     -1.571856      0.046149
  H      -3.830493     -0.718699      0.464806
  O       2.801666     -1.233915     -0.617028
  O       0.316348      2.556327      0.319089
  H      -2.577580      1.538471      0.608057
  H       0.621887     -2.518562     -0.475769
  H       2.362966      1.177641     -0.194034