%chk=000193921.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193921

0 1
O -3.158402 -0.855104 -0.659257
O 1.599339 -0.315280 -1.168679
O -1.363262 -2.151762 0.880183
O 1.274418 2.320461 1.771367
N -0.533587 1.318384 0.839100
N 0.617629 -1.175754 1.356621
C -1.118593 0.154524 0.147003
C 1.533992 -0.027474 1.268727
C -2.681295 0.228919 0.140607
C 2.415552 -0.067936 -0.024134
C -0.665267 -1.148781 0.820781
C 0.771348 1.310647 1.313422
C -3.208032 1.478657 -0.547420
C 3.531295 -1.094873 0.088966
H -0.753982 0.116282 -0.925418
H 2.217274 -0.038172 2.165505
H -3.075916 0.121747 1.176306
H 2.815175 0.956908 -0.234256
H -1.055397 2.194305 0.818375
H 0.950682 -2.014156 1.828830
H -4.258037 1.317269 -0.845942
H -3.180305 2.360541 0.098551
H -2.667443 1.702720 -1.476218
H 3.164852 -2.100009 0.325255
H 4.081786 -1.169743 -0.861381
H 4.265393 -0.821349 0.857334
H -2.959489 -1.730058 -0.219033
H 1.381776 -1.268213 -1.256295


%chk=000193921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193921

0 1
O -3.346147 -0.887079 -0.572335
O 1.882756 -0.208963 -1.233753
O -1.298731 -2.255991 0.574162
O 1.341948 2.462407 1.392142
N -0.524648 1.319415 0.600255
N 0.595904 -1.109665 1.232405
C -1.181546 0.137252 0.013537
C 1.510287 0.043898 1.208948
C -2.739058 0.191948 0.202326
C 2.572970 -0.071365 0.059826
C -0.632708 -1.167003 0.619033
C 0.764686 1.380699 1.075428
C -3.356118 1.495460 -0.319499
C 3.584107 -1.204790 0.289321
H -1.002145 0.093930 -1.082014
H 2.051309 0.096567 2.170996
H -2.958686 0.076165 1.287034
H 3.088062 0.901944 -0.001427
H -0.982989 2.224054 0.458879
H 0.909928 -1.982082 1.669753
H -4.453001 1.383057 -0.314946
H -3.109095 2.368024 0.312779
H -3.041683 1.689966 -1.360884
H 3.085692 -2.193015 0.348325
H 4.303182 -1.238568 -0.546814
H 4.153222 -1.049331 1.223873
H -2.905014 -1.734848 -0.267558
H 1.629019 -1.159387 -1.360891


