%chk=000014188.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014188

0 1
 O   0.3507000     -0.1475000       1.993100    
 O    2.278600      7.5900003E-02  -2.193000    
 O    3.996300     -7.9999998E-04 -0.1573000    
 O    3.110300     -0.1060000       1.950400    
 N   8.2400002E-02  4.7100000E-02  -1.454200    
 N    1.701500     -2.2500001E-02  9.1600001E-02
 C  -0.6857000      5.2000000E-03 -0.2193000    
 C   -1.514400       1.291500     -0.1348000    
 C   -1.526900      -1.269000     -6.9300003E-02
 C   0.4930000     -6.1799999E-02  0.7767000    
 C    1.463000      3.8400002E-02  -1.280200    
 C   -2.540200       1.526400      -1.053300    
 C   -2.264000      -1.489600       1.096600    
 C   -1.247500       2.233800      0.8612000    
 C   -1.559400      -2.213200      -1.098300    
 C    2.956200     -4.7499999E-02  0.7321000    
 C   -3.294700       2.697100     -0.9765000    
 C   -3.029100      -2.647900       1.232900    
 C   -2.002100       3.404500      0.9380000    
 C   -2.324700      -3.371500     -0.9619000    
 C   -3.025800       3.636000      1.9200001E-02
 C   -3.059500      -3.588700      0.2037000    
 C    5.311000     -2.3700001E-02  0.4098000    
 C    6.331000      3.3900000E-02 -0.7073000    
 H  -0.3442000      9.8399997E-02  -2.374800    
 H   -2.763400      0.8074000      -1.837200    
 H   -2.260900     -0.7669000       1.908000    
 H  -0.4569000       2.111300       1.592200    
 H   -1.004200      -2.085200      -2.022200    
 H   -4.091300       2.877800      -1.692200    
 H   -3.602600      -2.816400       2.139600    
 H   -1.791400       4.137600       1.711300    
 H   -2.349100      -4.104400      -1.763000    
 H   -3.612600       4.547900      7.8500003E-02
 H   -3.655700      -4.490300      0.3096000    
 H    5.437800      0.8403000       1.071600    
 H    5.444100     -0.9466000      0.9852000    
 H    7.349200      1.8200001E-02 -0.3088000    
 H    6.204500     -0.8141000      -1.388400    
 H    6.198400      0.9427000      -1.303600    


%chk=000014188-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014188

0 1
O 0.366271 0.065813 2.045313
O 2.326800 0.877727 -2.190579
O 3.882778 -0.315826 -0.039394
O 3.256341 1.011093 1.784572
N 0.103167 0.468741 -1.485634
N 1.705922 0.394279 0.099639
C -0.662388 0.246485 -0.239229
C -1.649294 1.412476 -0.009234
C -1.349819 -1.136656 -0.201322
C 0.492468 0.232979 0.819100
C 1.471100 0.599112 -1.327670
C -2.887922 1.402136 -0.700854
C -2.210322 -1.448760 0.881694
C -1.316982 2.529284 0.795689
C -1.098179 -2.112527 -1.193750
C 3.001058 0.421522 0.717634
C -3.775036 2.494636 -0.597725
C -2.820270 -2.718036 0.960037
C -2.209718 3.619095 0.904427
C -1.716800 -3.381873 -1.117156
C -3.437916 3.608503 0.205922
C -2.579982 -3.688315 -0.041742
C 5.315427 -0.267909 0.406458
C 6.108786 -1.082232 -0.607341
H -0.342436 0.732839 -2.363537
H -3.165686 0.530661 -1.305572
H -2.390458 -0.702458 1.662511
H -0.376311 2.549723 1.356232
H -0.416864 -1.884412 -2.020100
H -4.728670 2.474452 -1.136569
H -3.480107 -2.951287 1.802824
H -1.945974 4.473765 1.536768
H -1.519021 -4.129334 -1.893476
H -4.127759 4.455233 0.291684
H -3.056473 -4.673056 0.019157
H 5.624376 0.792342 0.439745
H 5.366635 -0.681962 1.429219
H 7.179529 -1.072805 -0.333675
H 5.764406 -2.129982 -0.629051
H 6.001024 -0.657662 -1.619314


