%chk=000258767.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258767

0 1
N 0.714394 3.438489 0.250969
C 0.762594 2.054524 -0.357441
C 0.096207 1.095334 0.665263
C 0.300080 -0.353994 0.318600
C -0.709088 -1.205456 0.057170
C 0.009321 1.990381 -1.691927
C 1.717206 -0.799007 0.328480
C -0.503124 -2.669696 -0.244864
C -2.131897 -0.782970 0.065434
C 0.947053 4.522743 -0.748833
C 1.725566 3.556538 1.348398
C 2.426824 -0.934706 -0.874965
C 2.355470 -1.072660 1.548302
C -0.597828 -2.953527 -1.743469
C -2.729758 -0.275415 -1.097899
C -2.890254 -0.912512 1.239947
C 3.763820 -1.339875 -0.855094
C 3.692276 -1.479074 1.560738
C 4.398674 -1.612653 0.361025
C -4.076149 0.099082 -1.083966
C -4.235293 -0.535252 1.246884
C -4.830731 -0.029911 0.086280
H 1.822029 1.728183 -0.531636
H 0.506291 1.283964 1.681958
H -0.982090 1.350132 0.744791
H 0.537623 2.516088 -2.491948
H -0.995110 2.424446 -1.604092
H -0.115960 0.947549 -2.008810
H -1.261423 -3.270241 0.300208
H 0.480026 -3.014118 0.139192
H 0.073281 4.582303 -1.417662
H 1.852850 4.402137 -1.359764
H 1.009004 5.491949 -0.228617
H 1.548436 2.762046 2.093659
H 1.579292 4.519106 1.863036
H 2.772884 3.491899 1.019785
H 1.931383 -0.723551 -1.820705
H 1.806067 -0.970652 2.481973
H -0.439884 -4.017086 -1.953469
H -1.582817 -2.679946 -2.141037
H 0.155432 -2.388882 -2.304569
H -2.141635 -0.171637 -2.007474
H -2.426922 -1.304036 2.143132
H 4.312355 -1.444303 -1.789546
H 4.184713 -1.692618 2.507855
H 5.439302 -1.928716 0.373649
H -4.537858 0.493827 -1.987188
H -4.821076 -0.634146 2.159077
H -5.877956 0.263525 0.094769


%chk=000258767-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258767

0 1
N 0.679039 3.532745 0.265045
C 0.882182 2.147665 -0.276129
C 0.113112 1.116062 0.607757
C 0.327357 -0.349017 0.224595
C -0.713518 -1.232108 0.032751
C 0.415435 2.042805 -1.742941
C 1.764657 -0.788293 0.182746
C -0.519640 -2.738731 -0.145787
C -2.156089 -0.803657 0.047300
C 1.182772 4.596363 -0.634716
C 1.251853 3.709512 1.619779
C 2.316778 -1.413324 -0.969634
C 2.631211 -0.544273 1.285016
C -0.937139 -3.255423 -1.547848
C -2.689666 0.056557 -0.950356
C -3.042607 -1.305368 1.039932
C 3.676155 -1.793772 -1.015123
C 3.988276 -0.931226 1.246750
C 4.519558 -1.557108 0.094586
C -4.056828 0.412625 -0.950454
C -4.407706 -0.943988 1.048198
C -4.922811 -0.083494 0.050768
H 1.973313 1.888446 -0.242843
H 0.448706 1.231603 1.657335
H -0.958004 1.377227 0.593518
H 1.069542 2.603429 -2.432034
H -0.617408 2.425101 -1.844338
H 0.430795 0.985123 -2.059156
H -1.143345 -3.261638 0.608219
H 0.527197 -3.020599 0.058089
H 0.638998 4.587371 -1.592417
H 2.278928 4.514935 -0.854025
H 1.004349 5.578594 -0.161458
H 0.736860 3.070349 2.355345
H 1.107401 4.756738 1.939260
H 2.348327 3.481629 1.665928
H 1.674133 -1.586149 -1.840552
H 2.233822 -0.064177 2.187045
H -0.825088 -4.353659 -1.607324
H -1.990701 -3.006138 -1.767477
H -0.311406 -2.805048 -2.340287
H -2.027081 0.436896 -1.734654
H -2.654608 -1.967448 1.823380
H 4.076864 -2.269834 -1.917426
H 4.631209 -0.744825 2.114690
H 5.574320 -1.852176 0.061631
H -4.445046 1.074843 -1.732842
H -5.068118 -1.331955 1.832276
H -5.982744 0.194414 0.053482


