%chk=000019324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019324

0 1
 O   0.1310000      0.4725000      0.5804000    
 O  -0.7478000       1.531600      -1.314900    
 N    2.793600     -0.2732000       1.158000    
 C    2.339000     -0.1385000     -0.2317000    
 C    1.194500      0.8717000     -0.2873000    
 C    3.493100      0.3050000      -1.141300    
 C   -1.065800       1.026300     -2.0000001E-03
 C   0.5219000      0.9622000      -1.632500    
 C    4.677800     -0.6516000      -1.037000    
 C    5.081600     -0.8466000      0.4204000    
 C    3.882500      -1.243000       1.278400    
 C   -1.524700       2.203400      0.8575000    
 C   -2.157700     -3.0300001E-02 -8.2099997E-02
 C   -1.824500       1.772800       2.283000    
 C   -3.403800      0.2940000     -0.6181000    
 C   -1.912400      -1.322800      0.3809000    
 C   -4.404900     -0.6746000     -0.6912000    
 C   -2.913500      -2.291500      0.3077000    
 C   -4.159700      -1.967400     -0.2284000    
 H    1.962000      -1.116800     -0.5603000    
 H    1.525000       1.865700      4.2900000E-02
 H    3.821300       1.316900     -0.8698000    
 H    3.166300      0.3453000      -2.186500    
 H    1.051500       1.600200      -2.344500    
 H   0.3494000     -2.0500001E-02  -2.085700    
 H    5.525300     -0.2648000      -1.613400    
 H    4.405300      -1.620100      -1.474100    
 H    2.012600     -0.5667000       1.744500    
 H    5.858400      -1.616400      0.4896000    
 H    5.517800      8.3800003E-02  0.8056000    
 H    3.529100      -2.243000      0.9989000    
 H    4.194400      -1.295800       2.327100    
 H   -2.393800       2.712900      0.4253000    
 H  -0.7277000       2.958100      0.8892000    
 H   -2.682400       1.096600       2.340600    
 H  -0.9647000       1.285100       2.752700    
 H   -2.069200       2.652900       2.887600    
 H   -3.611000       1.291900     -0.9941000    
 H  -0.9558000      -1.613700      0.8046000    
 H   -5.374600     -0.4230000      -1.110800    
 H   -2.723000      -3.298300      0.6678000    
 H   -4.938900      -2.721700     -0.2860000    


%chk=000019324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019324

0 1
O 0.263628 1.276060 0.880005
O -0.803923 2.175521 -1.001460
N 2.727849 -0.161512 1.093629
C 2.099499 0.020538 -0.232630
C 1.286784 1.323207 -0.215676
C 3.207588 0.058894 -1.315181
C -1.074478 1.472586 0.269908
C 0.451551 1.578156 -1.497542
C 4.086502 -1.213017 -1.243125
C 4.654582 -1.409711 0.182345
C 3.508923 -1.410686 1.217272
C -1.894465 2.426426 1.153505
C -1.758828 0.123385 0.000753
C -2.137191 1.893054 2.579460
C -2.770557 0.044782 -0.989459
C -1.433941 -1.031612 0.751367
C -3.442892 -1.174119 -1.228280
C -2.107546 -2.251470 0.514008
C -3.114298 -2.326704 -0.475918
H 1.399145 -0.819727 -0.482526
H 1.956935 2.168837 0.025753
H 3.837160 0.954235 -1.141068
H 2.752956 0.150352 -2.321371
H 0.904271 2.310379 -2.182154
H 0.242724 0.629612 -2.033272
H 4.907102 -1.151117 -1.982899
H 3.472483 -2.096328 -1.516520
H 2.038073 -0.033697 1.845983
H 5.220627 -2.358850 0.247001
H 5.348592 -0.581670 0.423381
H 2.882674 -2.325542 1.049373
H 3.918164 -1.470897 2.242601
H -2.857579 2.616588 0.642982
H -1.339219 3.380981 1.187575
H -2.717104 0.953006 2.569252
H -1.176825 1.702142 3.089428
H -2.701114 2.634533 3.172933
H -3.008489 0.936793 -1.579630
H -0.650128 -0.965017 1.513313
H -4.218846 -1.226893 -2.000540
H -1.846828 -3.140429 1.099713
H -3.636061 -3.272472 -0.661284


