%chk=000294339.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294339

0 1
O 4.724581 -1.442697 0.260468
N 4.059026 -1.154579 -1.866297
N -2.798829 -4.195921 -0.586655
C 1.088706 -0.276991 0.307042
C 1.969473 0.676804 -0.569270
C -0.409512 -0.114913 -0.126755
C 3.481826 0.627639 -0.184209
C 1.297545 0.066625 1.798299
C 1.484087 2.143019 -0.476088
C 3.660887 0.888538 1.330123
C 2.775232 -0.011359 2.196550
C -1.369950 -0.897082 0.790901
C -0.865330 1.320321 -0.241145
C 1.453708 -1.753218 0.054509
C 0.003650 2.323748 -0.436962
C -2.828321 -0.816112 0.304277
C 4.306419 1.668259 -0.969048
C 4.122119 -0.736642 -0.533027
C -2.312115 1.573513 -0.188287
C -3.229640 0.623087 0.053963
C -3.052966 -1.633393 -0.992826
C -4.717237 0.917232 0.116539
C -5.031514 1.776459 1.348510
C -5.201713 1.595388 -1.171599
C -2.911767 -3.059524 -0.765581
H 1.856952 0.354096 -1.630399
H -0.493348 -0.548500 -1.160851
H 0.712899 -0.623486 2.434800
H 0.898773 1.078769 2.001779
H 1.894915 2.716137 -1.333124
H 1.907429 2.618467 0.439284
H 3.435078 1.951203 1.544056
H 4.723184 0.729792 1.607782
H 3.136253 -1.061019 2.113634
H 2.893095 0.264301 3.260990
H -1.046140 -1.955201 0.863470
H -1.316454 -0.490393 1.820747
H 2.388249 -2.039894 0.558877
H 0.687281 -2.429894 0.456734
H 1.561008 -1.984193 -1.007576
H -0.328558 3.354549 -0.554670
H -3.481812 -1.242647 1.108718
H 5.384265 1.492984 -0.849816
H 4.087589 1.652142 -2.040855
H 4.120171 2.688227 -0.613915
H -2.616045 2.609611 -0.352052
H -2.330181 -1.297893 -1.775126
H -4.064390 -1.416379 -1.409620
H -5.279011 -0.047534 0.222435
H 4.473041 -2.035184 -2.129515
H 3.564504 -0.658491 -2.581222
H -4.544073 2.756552 1.295786
H -4.686841 1.292223 2.269186
H -6.108344 1.950661 1.446623
H -4.937984 1.007799 -2.057148
H -4.761775 2.591024 -1.299078
H -6.290098 1.720970 -1.165867


%chk=000294339-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294339

0 1
O 4.949747 -1.420434 0.255808
N 4.090872 -1.193217 -1.869584
N -2.681673 -4.285087 -0.221028
C 1.102587 -0.283166 0.328731
C 2.008396 0.642755 -0.579874
C -0.406659 -0.127376 -0.114457
C 3.546114 0.589353 -0.200336
C 1.320072 0.116864 1.819227
C 1.532134 2.126854 -0.573808
C 3.731547 0.872964 1.320234
C 2.808040 0.043738 2.239691
C -1.424949 -0.788721 0.856790
C -0.858187 1.307050 -0.380091
C 1.462823 -1.784084 0.123403
C 0.039299 2.309422 -0.608411
C -2.872454 -0.751027 0.305628
C 4.368917 1.651990 -1.003564
C 4.228501 -0.766636 -0.557521
C -2.302224 1.580466 -0.410897
C -3.275552 0.663927 -0.114057
C -3.086228 -1.738345 -0.899468
C -4.771819 0.984422 -0.108850
C -5.267403 1.241903 1.346079
C -5.177750 2.163044 -1.023149
C -2.865426 -3.147898 -0.534948
H 1.880567 0.280120 -1.625229
H -0.479252 -0.669800 -1.085590
H 0.730363 -0.553895 2.472916
H 0.932760 1.142961 1.985299
H 1.977606 2.653750 -1.440698
H 1.930267 2.654806 0.318943
H 3.547652 1.951605 1.496932
H 4.785288 0.674240 1.586744
H 3.154934 -1.005421 2.245504
H 2.912135 0.412114 3.279157
H -1.144111 -1.834406 1.074799
H -1.417731 -0.240073 1.817070
H 2.460372 -2.043200 0.506972
H 0.742782 -2.434906 0.650449
H 1.434736 -2.055210 -0.948856
H -0.331547 3.326545 -0.806589
H -3.555423 -1.092370 1.110577
H 5.450308 1.491249 -0.841087
H 4.178769 1.598111 -2.091980
H 4.132342 2.674870 -0.664808
H -2.590403 2.603207 -0.689700
H -2.405484 -1.471501 -1.728839
H -4.116958 -1.635546 -1.288631
H -5.308877 0.080371 -0.473321
H 4.564008 -2.052665 -2.147516
H 3.522118 -0.696229 -2.551415
H -4.799049 2.157276 1.752032
H -5.018791 0.403909 2.022243
H -6.364880 1.376606 1.363561
H -4.825087 2.012919 -2.059537
H -4.762289 3.119483 -0.654784
H -6.277855 2.269322 -1.042667


