%chk=000250782.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250782

0 1
O -0.182554 -0.519055 -2.259619
O -2.225106 2.714042 0.338333
N 1.221417 0.880543 -1.091813
N -1.214416 1.114089 -0.981244
N 0.618029 3.565626 1.202069
N 2.466078 2.485680 0.391036
C 1.322430 1.912405 -0.160676
C 0.159156 2.566765 0.329593
C 2.429576 0.102407 -1.500436
C -0.075259 0.410203 -1.481103
C -2.554878 0.573556 -1.382734
C -1.191045 2.202343 -0.039715
C 2.712746 -1.007073 -0.518707
C -3.003260 -0.497132 -0.419605
C 2.005216 3.482609 1.210293
C 2.063280 -2.242424 -0.657321
C 3.618317 -0.803078 0.531281
C -3.749280 -0.149629 0.715433
C -2.669998 -1.837905 -0.658138
C 2.335453 -3.275660 0.242480
C 3.887215 -1.841043 1.428082
C -4.179123 -1.145510 1.596288
C -3.102476 -2.829465 0.226259
C 3.249733 -3.077438 1.282978
C -3.860081 -2.485293 1.350844
H 3.289917 0.810450 -1.576880
H 2.245386 -0.306006 -2.525184
H -2.482757 0.176558 -2.424046
H -3.277333 1.425833 -1.403919
H 0.014674 4.194394 1.704415
H 2.648832 4.129897 1.795615
H 1.338438 -2.387369 -1.461861
H 4.102895 0.167208 0.653537
H -3.981149 0.899247 0.912275
H -2.063409 -2.099804 -1.527686
H 1.832838 -4.235233 0.134475
H 4.592642 -1.684343 2.242093
H -4.761334 -0.876647 2.475796
H -2.846783 -3.870916 0.039918
H 3.461975 -3.884620 1.981568
H -4.198103 -3.259511 2.036830


%chk=000250782-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250782

0 1
O -0.205138 -0.598304 -2.199154
O -2.252587 2.804863 0.365465
N 1.195367 0.831882 -0.989816
N -1.209124 1.094075 -0.907626
N 0.643006 3.609995 1.149682
N 2.463126 2.480059 0.376505
C 1.294791 1.911635 -0.127342
C 0.155115 2.587322 0.330802
C 2.414412 0.098351 -1.447901
C -0.077372 0.381191 -1.408380
C -2.554997 0.591011 -1.338254
C -1.191941 2.224554 -0.023923
C 2.820859 -1.031035 -0.507090
C -3.116723 -0.477118 -0.405280
C 2.023549 3.508110 1.146804
C 2.308953 -2.339834 -0.697183
C 3.718290 -0.783384 0.562673
C -3.912767 -0.107145 0.709201
C -2.859130 -1.850600 -0.648538
C 2.687797 -3.386371 0.173004
C 4.097127 -1.830920 1.431930
C -4.441545 -1.096293 1.568505
C -3.388668 -2.838948 0.211211
C 3.583272 -3.134594 1.238809
C -4.181694 -2.464744 1.321184
H 3.215272 0.852406 -1.524601
H 2.176456 -0.293904 -2.449635
H -2.426600 0.193164 -2.357059
H -3.212990 1.474954 -1.357864
H 0.062486 4.286416 1.645544
H 2.671713 4.179726 1.703541
H 1.608152 -2.525592 -1.519141
H 4.104535 0.231588 0.713202
H -4.102705 0.955469 0.899579
H -2.234475 -2.132075 -1.503654
H 2.288118 -4.395148 0.020065
H 4.792361 -1.632819 2.255637
H -5.057037 -0.801762 2.426166
H -3.185809 -3.898042 0.015421
H 3.878882 -3.947252 1.912205
H -4.594440 -3.232184 1.986110


