%chk=000108499.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108499

0 1
 O   -3.347800      0.7112000     -0.8002000    
 O   -2.578300       1.597700       1.063300    
 N   0.6945000     -0.8376000     -0.4539000    
 N   -2.422600       1.064100     -4.8599999E-02
 C    2.184200       1.095300     -0.2812000    
 C    2.642800      0.9013000       1.118300    
 C    3.621000       1.283300      4.6300001E-02
 C    1.786700     -0.1288000      -1.080000    
 C   0.9083000      -2.170700      8.9800000E-02
 C  -0.5599000     -0.3349000     -0.1542000    
 C  -0.5218000      -2.651000      0.3437000    
 C   -1.308200      -1.373600      0.6470000    
 C   -1.099000      0.8437000     -0.4904000    
 H    1.603800       1.976900     -0.5166000    
 H    2.725400     -9.7400002E-02   1.526800    
 H    2.373300       1.656400       1.846800    
 H    4.009500       2.294600      5.7900000E-02
 H    4.340200      0.5366000     -0.2665000    
 H    2.645100     -0.7989000      -1.212900    
 H    1.491400      0.1883000      -2.087600    
 H    1.473900      -2.117100       1.026000    
 H    1.430200      -2.829900     -0.6112000    
 H  -0.5782000      -3.384000       1.153800    
 H  -0.9198000      -3.122400     -0.5642000    
 H   -1.245100      -1.140600       1.716300    
 H   -2.355600      -1.510600      0.3646000    
 H  -0.6900000       1.655600      -1.068500    


%chk=000108499-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108499

0 1
O -2.937781 2.304976 -1.081859
O -3.482594 0.415089 0.097692
N 0.551611 -0.840093 -0.314544
N -2.616628 1.161227 -0.539604
C 2.232414 0.989488 0.063122
C 3.409944 0.581025 0.962704
C 3.637877 1.537875 -0.219096
C 1.617880 -0.015524 -0.909750
C 0.866465 -2.071895 0.456398
C -0.762317 -0.447759 -0.172083
C -0.523639 -2.721590 0.646340
C -1.514579 -1.523920 0.600272
C -1.255293 0.756469 -0.659055
H 1.511584 1.693914 0.493541
H 3.801341 -0.437811 0.871098
H 3.453930 0.988939 1.976310
H 3.834056 2.591868 -0.006335
H 4.174305 1.150588 -1.091931
H 2.405444 -0.696770 -1.285503
H 1.202140 0.510186 -1.790246
H 1.340524 -1.808314 1.423944
H 1.571886 -2.704988 -0.111878
H -0.594079 -3.288904 1.588325
H -0.731569 -3.414218 -0.187788
H -1.765587 -1.140193 1.606364
H -2.478235 -1.757502 0.125198
H -0.645100 1.495336 -1.177034


