%chk=000169013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169013

0 1
 O   0.7095000      -4.035900      3.3700000E-02
 O   -2.051900     -0.6243000       1.668700    
 O   -4.234200      0.6461000      0.6613000    
 N    3.123600       1.643300      0.2975000    
 C   0.6641000     -0.2797000      0.5865000    
 C    1.858900       1.507400     -0.3914000    
 C    1.652000      1.6899999E-02 -0.4846000    
 C    1.418500      0.2854000       1.880100    
 C  -0.6065000      0.5258000      0.1072000    
 C   0.9109000       2.048700      -1.442900    
 C    2.904100      0.9105000       1.619400    
 C  -0.4921000       1.564300     -0.9181000    
 C   0.4037000      -1.768300      0.7098000    
 C    2.204500     -0.8721000      -1.321800    
 C    1.878200      -2.335000      -1.240900    
 C   0.9439000      -2.683600     -0.1115000    
 C   -1.871600      0.2460000      0.6355000    
 C    3.513300       3.033100      0.4988000    
 C   -1.638600       2.204900      -1.394200    
 C   -2.998000      0.9147000      0.1484000    
 C   -2.884500       1.874000     -0.8628000    
 C  -0.4256000      -4.431000     -0.7115000    
 C   -4.982200     -0.3912000      3.2800000E-02
 H    1.292600       1.999500      0.4191000    
 H    1.533400     -0.5040000       2.634400    
 H   0.8012000       1.064600       2.348100    
 H    1.097000       1.668200      -2.452800    
 H   0.9311000       3.144500      -1.459300    
 H    3.157300       1.549600       2.474400    
 H    3.615600      7.4900001E-02   1.631700    
 H  -0.2073000      -2.125200       1.533900    
 H    2.912800     -0.5450000      -2.076600    
 H    1.438600      -2.645100      -2.195400    
 H    2.814300      -2.891200      -1.112200    
 H    4.481200       3.083400       1.009000    
 H    2.783500       3.595800       1.092100    
 H    3.634700       3.537400     -0.4659000    
 H   -1.566400       2.975800      -2.156000    
 H   -3.771200       2.385400      -1.229600    
 H   -2.990000     -0.6259000       1.924900    
 H  -0.2768000      -4.269900      -1.784600    
 H   -1.327200      -3.907300     -0.3743000    
 H  -0.5810000      -5.502400     -0.5523000    
 H   -5.214600     -0.1208000      -1.002100    
 H   -5.920600     -0.5170000      0.5798000    
 H   -4.433400      -1.338000      5.8200002E-02


%chk=000169013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169013

0 1
O 0.740112 -4.125630 0.253615
O -2.045428 -0.590081 1.807601
O -4.262620 0.394834 0.791246
N 3.060706 1.711043 0.232699
C 0.631579 -0.356158 0.624835
C 1.721443 1.457508 -0.374973
C 1.590262 -0.052001 -0.477791
C 1.458992 0.270622 1.881146
C -0.631776 0.470209 0.121847
C 0.825645 1.971694 -1.518655
C 2.934893 0.770311 1.466918
C -0.552169 1.406069 -1.001385
C 0.359404 -1.838991 0.766973
C 2.179082 -0.935693 -1.305224
C 1.888299 -2.423329 -1.201698
C 0.946778 -2.751670 -0.052800
C -1.906820 0.223987 0.671427
C 3.223529 3.134186 0.618593
C -1.737877 1.948508 -1.535375
C -3.088227 0.787249 0.104870
C -3.016481 1.632429 -1.011519
C 0.665621 -5.063445 -0.872477
C -5.540939 0.877552 0.271429
H 1.056788 1.784603 0.455857
H 1.616103 -0.533023 2.624735
H 0.875905 1.066080 2.380520
H 1.091621 1.577481 -2.515518
H 0.749028 3.074626 -1.580428
H 3.389233 1.281248 2.337371
H 3.534705 -0.128660 1.245320
H -0.309416 -2.181431 1.560105
H 2.897527 -0.608609 -2.067531
H 1.463703 -2.785768 -2.163594
H 2.837243 -2.987925 -1.066767
H 4.152885 3.257711 1.201451
H 2.370501 3.537091 1.223968
H 3.313318 3.748078 -0.295593
H -1.666839 2.656620 -2.369051
H -3.916107 2.067477 -1.456796
H -3.016425 -0.655791 2.015565
H 1.612261 -5.107631 -1.445730
H -0.167584 -4.809159 -1.557690
H 0.477466 -6.046535 -0.413834
H -5.590605 1.982906 0.306240
H -6.309121 0.448957 0.931766
H -5.701400 0.529750 -0.767168


