%chk=000258117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258117

0 1
O 6.835565 -0.937736 -0.522942
O 6.890825 0.946372 0.537890
N -2.302646 0.498305 -0.102343
N -3.807799 -1.837680 0.524256
N 6.297917 0.027874 -0.004759
C -3.691787 0.527956 -0.105372
C -4.449500 -0.643174 0.208635
C 2.037084 0.200753 -0.091493
C -1.702616 -0.655075 0.201692
C 0.567726 0.283174 -0.117650
C -0.234277 -0.738533 0.218168
C 2.709664 -0.887193 -0.676620
C 2.772191 1.236114 0.516145
C -4.374035 1.744721 -0.426383
C -5.878614 -0.584762 0.198153
C -2.484018 -1.843155 0.521360
C 4.821491 0.088554 -0.036172
C 4.101801 -0.946645 -0.652938
C 4.163396 1.182093 0.550053
C -5.745894 1.767158 -0.427563
C -6.502272 0.597079 -0.113840
H 0.156272 1.255598 -0.424505
H 0.171039 -1.703346 0.537490
H 2.141052 -1.682509 -1.160105
H 2.250627 2.081410 0.968181
H -3.778069 2.627581 -0.663273
H -6.436990 -1.490969 0.441086
H -1.977142 -2.783644 0.770491
H 4.638850 -1.787139 -1.107173
H 4.748389 1.978307 1.024502
H -6.285146 2.684109 -0.669487
H -7.590884 0.663203 -0.127584


%chk=000258117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258117

0 1
O 6.962299 -0.956372 -0.010630
O 6.934078 1.326366 0.020827
N -2.307441 0.466506 -0.003820
N -3.916286 -1.927618 -0.042360
N 6.340794 0.177641 0.004064
C -3.688628 0.535569 -0.002994
C -4.506205 -0.665942 -0.022294
C 2.035991 0.115484 -0.003813
C -1.746486 -0.772469 -0.023768
C 0.571294 0.160501 -0.005464
C -0.286221 -0.909359 -0.023605
C 2.787399 -1.100356 -0.019458
C 2.753542 1.349973 0.014546
C -4.328981 1.815622 0.016928
C -5.928513 -0.554891 -0.021193
C -2.575047 -1.960822 -0.043043
C 4.862539 0.159080 0.001304
C 4.189664 -1.086205 -0.016986
C 4.157779 1.383179 0.017159
C -5.723423 1.896354 0.017727
C -6.526918 0.708690 -0.001412
H 0.106002 1.155510 0.009228
H 0.092783 -1.939593 -0.039584
H 2.269767 -2.064636 -0.033371
H 2.191158 2.290410 0.026793
H -3.695461 2.707753 0.031325
H -6.516568 -1.477671 -0.036066
H -2.105660 -2.952407 -0.057245
H 4.776458 -2.008415 -0.028679
H 4.714994 2.323341 0.031057
H -6.214048 2.875510 0.033166
H -7.618455 0.798069 -0.000440


