%chk=000269254.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269254

0 1
O 1.695506 -3.042059 0.018931
N -0.616851 -3.244556 0.164346
N -1.734542 -2.433358 0.147714
C 0.172356 -1.051188 -0.107262
C 0.795314 -0.163741 0.975184
C -1.351946 -1.175233 -0.000624
C 0.609713 -2.522146 0.026525
C 2.043281 0.522238 0.483964
C -2.271311 -0.038614 -0.070158
C 3.179361 -0.231484 0.151590
C 2.076356 1.919112 0.365831
C -1.863221 1.169413 -0.663604
C -3.571487 -0.150594 0.454698
C 4.337422 0.409621 -0.292512
C 3.239584 2.555724 -0.077960
C -2.746649 2.248759 -0.726854
C -4.448087 0.934776 0.387736
C 4.370893 1.803896 -0.407574
C -4.038306 2.134845 -0.201305
H 0.454643 -0.683470 -1.126577
H 1.032067 -0.760769 1.882961
H 0.046118 0.583240 1.318476
H -0.742729 -4.244246 0.281847
H 3.154605 -1.322796 0.234847
H 1.201339 2.512683 0.621948
H -0.860870 1.268003 -1.079945
H -3.895081 -1.088793 0.910147
H 5.217075 -0.179313 -0.549208
H 3.262823 3.640558 -0.165751
H -2.428632 3.182142 -1.189788
H -5.454480 0.843161 0.794925
H 5.275388 2.300717 -0.752006
H -4.723952 2.979371 -0.252741


%chk=000269254-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269254

0 1
O 1.679500 -3.161112 0.197097
N -0.682253 -3.269514 0.372844
N -1.818048 -2.428650 0.326413
C 0.156100 -1.132990 -0.001857
C 0.867428 -0.192842 1.039167
C -1.365257 -1.191135 0.105701
C 0.541919 -2.620892 0.182960
C 2.091302 0.528906 0.483621
C -2.282187 -0.052291 -0.037869
C 3.158754 -0.196023 -0.111080
C 2.184859 1.941297 0.566256
C -1.809880 1.204205 -0.512278
C -3.664032 -0.192279 0.280969
C 4.291194 0.483610 -0.611061
C 3.319868 2.621558 0.066064
C -2.697487 2.290972 -0.662833
C -4.544600 0.894947 0.129662
C 4.376864 1.893827 -0.525504
C -4.066146 2.142988 -0.341866
H 0.453222 -0.816371 -1.020268
H 1.155836 -0.805370 1.914619
H 0.134814 0.548791 1.401765
H -0.818512 -4.264672 0.542719
H 3.098174 -1.290273 -0.166422
H 1.368671 2.511288 1.028768
H -0.754712 1.330191 -0.780799
H -4.024372 -1.160033 0.643859
H 5.110149 -0.087430 -1.063270
H 3.377648 3.713706 0.138157
H -2.322485 3.250596 -1.035110
H -5.604611 0.774814 0.379141
H 5.257519 2.418036 -0.913485
H -4.753537 2.988042 -0.458280


