%chk=000162798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162798

0 1
 O   -2.939600      0.5593000       2.172500    
 O    2.388000     -5.0700001E-02  -1.195600    
 N    5.783200     -0.1416000      0.2364000    
 C   -2.849300      0.7714000      0.7344000    
 C   -3.315200       2.265300      0.5624000    
 C   -1.465000      0.5543000      0.2245000    
 C   -3.854500     -0.2369000      0.1137000    
 C   -1.030600       1.222600     -0.9200000    
 C  -0.6046000     -0.3174000      0.8921000    
 C   -4.662700       2.568100       1.218200    
 C    4.726900      0.1443000     -0.7339000    
 C   -4.052900      -1.419600      0.7659000    
 C   -4.479300      0.1204000      -1.046200    
 C    3.385000     -0.3643000     -0.2319000    
 C    1.116100      0.1490000     -0.7262000    
 C    5.880800      -1.580800      0.4765000    
 C    7.063900      0.3866000     -0.2320000    
 C   0.2644000       1.019200      -1.397100    
 C   0.6903000     -0.5208000      0.4152000    
 C   -4.955700      -2.325300      0.2088000    
 C   -5.382200     -0.7852000      -1.603200    
 C    6.932300      -1.891800       1.528000    
 C    6.980900       1.882100     -0.4869000    
 C   -5.620400      -2.008100     -0.9756000    
 H   -3.369000       2.589200     -0.4809000    
 H   -2.574100       2.919100       1.044000    
 H    4.598800       1.220600     -0.8936000    
 H    4.946000     -0.2906000      -1.718400    
 H   -1.672100       1.889300      -1.485700    
 H  -0.9215000     -0.8629000       1.776700    
 H   -5.478600       1.983100      0.7864000    
 H   -4.639400       2.384900       2.296700    
 H   -4.908900       3.626000       1.075600    
 H    3.177500      0.1076000      0.7380000    
 H    3.365100      -1.452200     -0.1296000    
 H   -3.536200      -1.698500       1.677600    
 H   -4.298900       1.048300      -1.573500    
 H   -2.240700       1.087500       2.595700    
 H    6.095000      -2.139800     -0.4430000    
 H    4.954400      -1.977600      0.8996000    
 H    7.410500     -0.1225000      -1.140200    
 H    7.836200      0.2596000      0.5336000    
 H   0.5977000       1.537000      -2.292000    
 H    1.316800      -1.230500      0.9467000    
 H   -5.137900      -3.279400      0.6946000    
 H   -5.895300     -0.5414000      -2.528900    
 H    7.951700      -1.788400       1.143900    
 H    6.819900      -1.259100       2.415300    
 H    6.828100      -2.932700       1.855200    
 H    6.451700       2.121000      -1.414500    
 H    6.504100       2.412100      0.3450000    
 H    7.992300       2.290700     -0.5944000    
 H   -6.321500      -2.714200      -1.410800    


%chk=000162798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162798

0 1
O -3.108041 1.367758 2.128021
O 2.516767 1.065169 -0.903847
N 5.884591 -0.383078 -0.191346
C -3.062828 1.120130 0.656857
C -3.904595 2.221485 -0.059438
C -1.583872 1.117569 0.217167
C -3.705078 -0.263629 0.444873
C -1.083052 1.873802 -0.874349
C -0.667078 0.317916 0.946841
C -5.359211 2.309315 0.440852
C 4.860545 0.488476 -0.818987
C -4.407454 -0.919238 1.484074
C -3.624886 -0.881604 -0.828901
C 3.496167 0.251259 -0.158308
C 1.181030 1.034495 -0.479453
C 5.970311 -1.722221 -0.836550
C 7.205058 0.279223 -0.022111
C 0.281454 1.835697 -1.222218
C 0.701836 0.268471 0.614827
C -5.019333 -2.173222 1.252292
C -4.240722 -2.130278 -1.062236
C 6.489035 -2.818632 0.113389
C 7.212356 1.311318 1.121379
C -4.942198 -2.782423 -0.020585
H -3.904512 2.021655 -1.148753
H -3.399380 3.198085 0.089198
H 5.137073 1.548334 -0.681707
H 4.769628 0.320368 -1.917043
H -1.753145 2.504484 -1.466418
H -1.042226 -0.275110 1.788014
H -5.919142 1.386383 0.209580
H -5.386652 2.454334 1.534903
H -5.881606 3.157321 -0.038385
H 3.528376 0.561241 0.904299
H 3.211732 -0.819654 -0.209404
H -4.460061 -0.441549 2.465813
H -3.061990 -0.394980 -1.634851
H -2.535003 2.155345 2.310438
H 6.603422 -1.689214 -1.759414
H 4.952589 -1.999875 -1.170208
H 7.543971 0.763848 -0.972606
H 7.947183 -0.506118 0.209705
H 0.670382 2.418405 -2.063080
H 1.376867 -0.359866 1.203270
H -5.557914 -2.672228 2.066388
H -4.167331 -2.597625 -2.051019
H 7.517016 -2.611731 0.461903
H 5.837989 -2.890970 1.001968
H 6.501803 -3.798690 -0.399159
H 6.493968 2.132167 0.940978
H 6.939245 0.823847 2.073411
H 8.215872 1.764119 1.228208
H -5.417459 -3.753786 -0.199170


