%chk=000029779.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029779

0 1
 O  -0.9967000      -2.022500     -0.3275000    
 N  -0.7131000      0.2607000     -1.2700000E-02
 C    1.321300       1.649700     -0.3234000    
 C    2.478700      0.7008000     -1.9200001E-02
 C   7.8500003E-02   1.373100      0.5158000    
 C    2.171900     -0.7733000     -0.2720000    
 C    1.070300      -1.328000      0.6245000    
 C  -0.3106000      -1.070900      5.3199999E-02
 C   -1.988400      0.6050000     -0.6273000    
 C   -3.111900      0.6053000      0.3886000    
 H    1.664000       2.669600     -0.1100000    
 H    1.077700       1.612700      -1.392100    
 H    2.794800      0.8336000       1.023100    
 H    3.335600      0.9899000     -0.6400000    
 H   0.3486000       1.152800       1.554400    
 H  -0.5501000       2.270900      0.5405000    
 H    3.090700      -1.341700     -8.1200004E-02
 H    1.920700     -0.9230000      -1.329100    
 H    1.136400     -0.9509000       1.649900    
 H    1.189300      -2.417100      0.6887000    
 H   -1.903200       1.578400      -1.122800    
 H   -2.216900     -0.1319000      -1.405900    
 H   -3.217400     -0.3761000      0.8628000    
 H   -2.927800       1.338600       1.180500    
 H   -4.062000      0.8551000     -9.3400002E-02


%chk=000029779-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029779

0 1
O -1.039597 -2.042420 -0.432873
N -0.727314 0.230166 -0.045416
C 1.351181 1.677407 -0.302689
C 2.530531 0.726679 0.004520
C 0.064570 1.358098 0.497738
C 2.253882 -0.770870 -0.266213
C 1.089659 -1.373945 0.569953
C -0.306701 -1.094287 0.002312
C -2.056097 0.532028 -0.631306
C -3.160716 0.686895 0.436333
H 1.661863 2.713703 -0.060278
H 1.109077 1.657556 -1.383362
H 2.811301 0.846161 1.072433
H 3.412351 1.043078 -0.586873
H 0.327150 1.170309 1.559044
H -0.597580 2.242096 0.490354
H 3.174836 -1.339910 -0.032885
H 2.048960 -0.933279 -1.342695
H 1.167081 -1.015211 1.616930
H 1.174684 -2.472872 0.592448
H -1.968068 1.455102 -1.236227
H -2.308031 -0.304798 -1.303881
H -3.284191 -0.256770 0.994382
H -2.922648 1.491398 1.156844
H -4.125784 0.934485 -0.043193


