%chk=000249534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249534

0 1
O 1.829906 0.079470 0.414643
O -2.240155 -2.500123 0.379449
N -1.196695 -0.495882 0.251673
C -0.135603 -0.964203 1.177940
C -1.087922 0.907965 -0.215844
C 1.186215 -1.219044 0.440292
C -2.240142 -1.367348 -0.085124
C -3.325225 -0.838620 -1.005486
C 3.116415 0.078519 -0.253817
C -1.887964 1.867903 0.663915
C 3.588479 1.528000 -0.121949
C -4.047136 -1.985621 -1.701752
C 4.950024 1.727108 -0.776142
H -0.475871 -1.906423 1.676129
H 0.026746 -0.201538 1.974588
H 1.037120 -1.576759 -0.592589
H 1.827828 -1.926875 0.992784
H -0.003898 1.195192 -0.213261
H -1.430500 0.972680 -1.273542
H -4.042255 -0.247520 -0.396837
H -2.911898 -0.135271 -1.757786
H 2.976621 -0.227166 -1.304167
H 3.788932 -0.631531 0.256045
H -2.956126 1.625480 0.675516
H -1.542144 1.839524 1.705157
H -1.783322 2.900664 0.313148
H 2.834321 2.203670 -0.572893
H 3.624726 1.805514 0.951289
H -4.366317 -2.748592 -0.973994
H -3.393876 -2.496938 -2.419417
H -4.934190 -1.635013 -2.238227
H 4.926618 1.492331 -1.846727
H 5.283528 2.767508 -0.678830
H 5.719361 1.095940 -0.315789


%chk=000249534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249534

0 1
O 1.753913 0.198764 0.415169
O -1.754126 -2.567943 -0.186451
N -1.202234 -0.376740 0.346330
C -0.224843 -0.873641 1.337965
C -1.322331 1.091593 0.177635
C 1.171872 -1.109341 0.750744
C -1.936680 -1.318946 -0.368535
C -2.961637 -0.794228 -1.389752
C 3.091965 0.085176 -0.178734
C -2.295155 1.740872 1.188255
C 3.590912 1.497898 -0.499675
C -3.879305 -1.916565 -1.909097
C 5.004399 1.485707 -1.121768
H -0.599602 -1.833279 1.734346
H -0.150837 -0.143473 2.164497
H 1.102006 -1.749788 -0.153018
H 1.811189 -1.625719 1.502380
H -0.308991 1.514025 0.292008
H -1.644835 1.313199 -0.853878
H -3.564627 0.017354 -0.939350
H -2.412036 -0.337436 -2.238914
H 3.045752 -0.535084 -1.102849
H 3.780443 -0.420723 0.536799
H -3.321399 1.349280 1.068158
H -1.976347 1.542937 2.227606
H -2.323429 2.836989 1.044613
H 2.872662 1.978010 -1.191091
H 3.587264 2.094373 0.432183
H -4.479785 -2.345497 -1.088576
H -3.282801 -2.739030 -2.336703
H -4.565525 -1.528007 -2.683559
H 5.023212 0.908378 -2.065406
H 5.343975 2.511897 -1.349054
H 5.742561 1.031986 -0.433885


