%chk=000253334.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253334

0 1
O 2.107443 2.099312 -0.259877
O -0.594974 -1.874865 0.085247
O 2.648751 -1.007143 -1.288278
O -3.867369 0.563510 0.474415
O -3.057515 -1.438181 0.392551
N -2.928585 -0.198143 0.362335
C 0.837459 -0.033353 -0.113134
C 0.986052 1.360629 -0.152229
C -0.475125 -0.543903 0.058966
C -1.600895 0.316103 0.190076
C -0.142425 2.240434 -0.020010
C -1.398376 1.727169 0.141892
C 1.947445 -1.019698 -0.300535
C 2.140399 -2.005055 0.807985
C 3.418690 1.501318 -0.445830
H 0.041532 3.315564 -0.059834
H -2.276141 2.379883 0.239384
H 1.318549 -2.745032 0.816312
H 2.143718 -1.533243 1.798061
H 3.075555 -2.570664 0.688313
H -1.598955 -2.200167 0.190256
H 4.059259 2.393536 -0.466420
H 3.453044 0.963477 -1.406523
H 3.666463 0.852011 0.396675


%chk=000253334-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253334

0 1
O 2.118823 2.091997 -0.535533
O -0.623566 -1.871749 0.481470
O 2.711499 -0.825283 -1.361380
O -3.929796 0.652189 0.580503
O -3.062517 -1.444826 0.824013
N -2.921807 -0.142666 0.559430
C 0.831635 -0.034095 -0.099562
C 0.959294 1.373460 -0.338344
C -0.469904 -0.534487 0.232611
C -1.603877 0.351821 0.249268
C -0.189927 2.231305 -0.344805
C -1.451446 1.730775 -0.059478
C 1.949803 -1.014787 -0.365650
C 2.151959 -2.215311 0.541364
C 3.470512 1.606583 -0.204122
H -0.024864 3.291614 -0.549772
H -2.335927 2.372412 -0.045804
H 1.523198 -3.051825 0.187408
H 1.850330 -2.013285 1.581915
H 3.209437 -2.523978 0.488467
H -1.639657 -2.019931 0.672673
H 4.061110 2.525791 -0.076201
H 3.861030 0.984257 -1.023991
H 3.458658 1.023515 0.735317


