%chk=000247848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247848

0 1
O -3.152481 1.210516 0.288339
O 0.889700 -1.194723 -0.536658
O 2.670870 -2.398100 -0.941589
N -6.344085 -0.528572 -0.064729
C -5.413735 0.621695 0.147745
C -7.501027 -0.166364 -0.947055
C -6.797133 -1.110006 1.243536
C -3.999308 0.054643 -0.042846
C 1.013783 1.122256 0.157729
C 2.459636 1.067914 0.105530
C 0.277191 -0.040671 -0.174467
C 3.079637 -0.096896 -0.260146
C -1.803309 1.071510 0.211764
C -1.129413 -0.089168 -0.154602
C 0.271216 2.277164 0.523908
C -7.026773 0.008122 -2.389963
C -7.295483 -2.539734 1.030795
C -1.104687 2.268209 0.555256
C 4.551389 -0.229858 -0.336674
C 2.341313 -1.297576 -0.602952
C 3.238199 2.290692 0.453886
C 5.277460 -0.640521 0.791987
C 5.219264 0.056247 -1.537416
C 6.667627 -0.759056 0.716609
C 6.609669 -0.065138 -1.603267
C 7.335277 -0.470011 -0.478056
H -5.500649 1.100337 1.146668
H -5.587022 1.437392 -0.588039
H -8.236729 -1.002405 -0.904559
H -8.036040 0.745102 -0.603693
H -5.927509 -1.129553 1.938372
H -7.583823 -0.498511 1.736089
H -3.799841 -0.248072 -1.083699
H -3.764327 -0.766291 0.653649
H -1.627000 -1.016676 -0.422539
H 0.808333 3.191434 0.785977
H -6.386608 0.888661 -2.513176
H -6.440880 -0.861998 -2.717388
H -7.876698 0.114545 -3.072122
H -8.230687 -2.570292 0.460190
H -6.560325 -3.132162 0.468118
H -7.469254 -3.041862 1.988143
H -1.682775 3.146190 0.833867
H 4.328574 2.141583 0.381850
H 3.035566 2.616510 1.485287
H 2.993163 3.128246 -0.216571
H 4.755614 -0.874903 1.717745
H 4.652366 0.361248 -2.414866
H 7.231457 -1.082830 1.589967
H 7.128377 0.151264 -2.535797
H 8.417519 -0.566433 -0.533939


%chk=000247848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247848

0 1
O -3.214244 1.446142 0.183085
O 0.843627 -1.185033 -0.266749
O 2.700188 -2.503677 -0.482057
N -6.405036 -0.478211 -0.087476
C -5.513457 0.701484 0.020753
C -7.588797 -0.258514 -0.959048
C -6.735068 -1.077261 1.234841
C -4.050425 0.244223 -0.038456
C 1.029106 1.222612 0.155623
C 2.484470 1.116794 0.129318
C 0.242157 0.055484 -0.056557
C 3.092118 -0.114931 -0.136469
C -1.830156 1.294428 0.159842
C -1.166957 0.067254 -0.058654
C 0.317760 2.442914 0.374184
C -7.229700 -0.237728 -2.456855
C -7.062325 -2.580476 1.153783
C -1.079273 2.487261 0.376511
C 4.570996 -0.293564 -0.272838
C 2.286470 -1.340281 -0.306236
C 3.289734 2.364251 0.437359
C 5.261890 -1.284235 0.475482
C 5.313008 0.508055 -1.182981
C 6.657057 -1.446070 0.338590
C 6.707463 0.340359 -1.326991
C 7.386921 -0.634641 -0.561302
H -5.680765 1.280169 0.957820
H -5.701417 1.393906 -0.818442
H -8.296085 -1.088056 -0.779186
H -8.129816 0.682634 -0.685819
H -5.855078 -0.945084 1.892735
H -7.578983 -0.531737 1.728223
H -3.826162 -0.198530 -1.027661
H -3.835585 -0.505902 0.748746
H -1.693555 -0.874101 -0.229271
H 0.875362 3.369716 0.536497
H -6.525595 0.579116 -2.699969
H -6.757011 -1.192059 -2.747173
H -8.137517 -0.088824 -3.070850
H -7.948322 -2.777133 0.523733
H -6.210048 -3.133612 0.722342
H -7.273998 -2.983399 2.161768
H -1.622201 3.422170 0.540370
H 4.357006 2.137800 0.568887
H 2.919845 2.837532 1.365546
H 3.197076 3.115934 -0.370039
H 4.702537 -1.932214 1.156872
H 4.787893 1.246692 -1.799799
H 7.173066 -2.212173 0.927853
H 7.258541 0.961779 -2.041743
H 8.468884 -0.768165 -0.671940


