%chk=000279636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279636

0 1
O -4.678049 -1.536570 0.891624
O 1.018545 0.967320 1.066636
O -0.795858 2.130642 1.869488
N -2.676354 0.198137 -0.128121
N -0.617755 1.418357 -0.434700
N 0.343226 0.651365 -1.076599
N 5.051520 -1.595482 -0.614458
C -3.265474 -0.869221 -0.992653
C -3.646589 0.684375 0.901843
C -2.042535 1.296438 -0.893863
C -3.737591 -2.020083 -0.086950
C -4.109851 -0.518177 1.740118
C -0.279835 1.559309 0.957923
C 1.318027 0.427212 -0.208193
C 2.596293 -0.263184 -0.347895
C 3.437859 -0.420912 0.763928
C 2.989160 -0.773694 -1.594418
C 4.656387 -1.094671 0.584841
C 4.226720 -1.432872 -1.680474
H -2.478876 -1.235909 -1.688432
H -4.116868 -0.501485 -1.605453
H -4.526925 1.194004 0.455131
H -3.123262 1.419950 1.558161
H -2.026228 1.116589 -1.996958
H -2.498270 2.301076 -0.705621
H -4.331296 -2.768384 -0.640977
H -2.891739 -2.506025 0.431320
H -3.280144 -0.954428 2.324506
H -4.954305 -0.261775 2.404077
H 3.148011 -0.027384 1.740171
H 2.352132 -0.661107 -2.472430
H 5.349736 -1.244909 1.422274
H 4.580789 -1.849705 -2.631944


%chk=000279636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279636

0 1
O -4.866769 -1.598719 0.725613
O 1.222005 1.088953 1.139482
O -0.701184 2.271891 1.959912
N -2.882258 0.282355 -0.141143
N -0.592857 1.171969 -0.174064
N 0.352610 0.390505 -0.865219
N 5.191107 -1.582465 -0.771189
C -3.299316 -0.817601 -1.034789
C -3.912536 0.689614 0.840112
C -1.998773 1.294522 -0.663884
C -3.789281 -2.009022 -0.190163
C -4.378233 -0.544716 1.632402
C -0.147008 1.608014 1.072564
C 1.416008 0.372293 -0.061502
C 2.694333 -0.287385 -0.301425
C 3.729109 -0.241868 0.668929
C 2.930637 -0.991529 -1.512839
C 4.946062 -0.899882 0.387717
C 4.181361 -1.614449 -1.696088
H -2.437497 -1.135109 -1.650346
H -4.121443 -0.498651 -1.719463
H -4.796123 1.149054 0.336612
H -3.478099 1.430146 1.535947
H -1.919707 1.256812 -1.765275
H -2.327192 2.305220 -0.360325
H -4.225736 -2.796161 -0.826704
H -2.939101 -2.423928 0.393156
H -3.534670 -0.935016 2.241115
H -5.230414 -0.300514 2.287292
H 3.583490 0.291389 1.612330
H 2.156361 -1.045087 -2.283476
H 5.766082 -0.886234 1.113904
H 4.399634 -2.165605 -2.617289


