%chk=000297239.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297239

0 1
O -1.494828 1.229694 -0.756012
O 2.922019 -3.030562 1.407539
O -0.838867 -0.872697 -1.428764
N 0.470278 0.442800 -0.009197
N 3.200505 0.027115 -1.937182
N 3.635516 1.190610 -0.036301
N 4.339559 -1.333448 1.902640
N 4.253502 0.873998 -2.076720
N 4.502335 1.567037 -0.920803
C 1.633096 -0.471043 0.026680
C 1.961191 -0.815724 1.489672
C 2.795517 0.213133 -0.648431
C 3.083056 -1.835879 1.577520
C -0.637235 0.145445 -0.801944
C -2.805479 1.043904 -1.387915
C -3.739209 0.365658 -0.427859
C -3.721813 -1.032218 -0.307967
C -4.628817 1.122805 0.347173
C -4.596629 -1.667222 0.576439
C -5.504261 0.482169 1.229046
C -5.490062 -0.911571 1.343461
H 1.379556 -1.421126 -0.544486
H 1.056558 -1.260618 1.969934
H 2.181240 0.099237 2.077597
H 0.543354 1.346313 0.456717
H -3.074496 2.094949 -1.606155
H -2.673800 0.477598 -2.330364
H -3.013170 -1.619441 -0.900953
H -4.638085 2.208548 0.268091
H 5.128647 -1.959788 1.959800
H 4.540894 -0.348383 1.960807
H 4.778658 0.965235 -2.945938
H -4.580884 -2.752409 0.668590
H -6.196404 1.070484 1.828904
H -6.172742 -1.408603 2.030682


%chk=000297239-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297239

0 1
O -1.488275 1.205168 -0.733659
O 2.670061 -3.112550 1.666746
O -0.707724 -0.917667 -1.426150
N 0.574229 0.524300 -0.084050
N 3.090708 0.452487 -1.988922
N 4.010624 0.878145 0.067631
N 4.351457 -1.507361 1.799327
N 4.272812 1.134489 -2.062083
N 4.867278 1.410668 -0.840964
C 1.748114 -0.357578 0.014627
C 2.019762 -0.750363 1.494927
C 2.945948 0.305132 -0.635616
C 3.034103 -1.899150 1.654760
C -0.549232 0.163281 -0.803161
C -2.811994 0.921627 -1.393012
C -3.794292 0.295924 -0.427319
C -3.800156 -1.108654 -0.219697
C -4.721478 1.103276 0.279159
C -4.715100 -1.690826 0.684737
C -5.639137 0.521109 1.182158
C -5.636904 -0.878406 1.386767
H 1.489478 -1.264613 -0.562142
H 1.066690 -1.112417 1.912773
H 2.344560 0.139937 2.063515
H 0.568597 1.425157 0.397360
H -3.138983 1.919363 -1.725103
H -2.617154 0.267901 -2.260498
H -3.078180 -1.730990 -0.760476
H -4.723294 2.189156 0.121798
H 5.065409 -2.228349 1.903345
H 4.621338 -0.530938 1.649281
H 4.693211 1.413061 -2.948933
H -4.711862 -2.775400 0.840018
H -6.353484 1.153361 1.721266
H -6.348427 -1.332280 2.085893


