%chk=000071122.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071122

0 1
 O   -2.723900      0.4955000     -0.5102000    
 O   -1.612700      -1.123000      -1.687900    
 O   0.9681000     -5.2299999E-02  -1.717600    
 O    3.667900      0.4770000      -1.063100    
 N    1.845500      0.4175000      0.3964000    
 N    3.961600      0.8738000       1.180900    
 C  -0.5091000      2.4400000E-02  0.1593000    
 C  -0.9330000       1.384000      0.6943000    
 C   -2.444600       1.318300      0.6294000    
 C  -0.4461000      -1.047100       1.245200    
 C   -1.638200     -0.2879000     -0.7961000    
 C   0.8305000      0.1153000     -0.5090000    
 C   -3.095900       2.677500      0.4534000    
 C  -0.1367000      -2.390800      0.6628000    
 C  -0.9279000      -3.461300      0.7952000    
 C    3.194500      0.5792000      6.7100003E-02
 H  -0.5554000       2.186500      4.6100002E-02
 H  -0.5782000       1.593500       1.709200    
 H   -2.862700      0.8229000       1.513400    
 H   -1.407300      -1.096200       1.775100    
 H   0.2957000     -0.8254000       2.020200    
 H   -4.182800       2.569600      0.3723000    
 H   -2.870800       3.336800       1.296800    
 H   -2.761200       3.159500     -0.4718000    
 H   0.8056000      -2.519400      0.1366000    
 H    1.605900      0.5841000       1.368800    
 H  -0.6379000      -4.414600      0.3669000    
 H   -1.871900      -3.408400       1.325900    
 H    4.962600       1.019600       1.104800    
 H    3.552500      0.9521000       2.105800    


%chk=000071122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071122

0 1
O -2.091671 0.567631 -1.180599
O -0.173927 -0.666069 -1.546302
O 1.111816 1.539087 1.975297
O 3.845957 0.570106 1.393276
N 1.813995 0.104502 0.230771
N 3.879928 -0.445579 -0.704679
C -0.605126 0.364690 0.704970
C -1.561420 1.558795 0.962280
C -2.725903 1.336641 -0.030248
C -1.003010 -0.865196 1.625007
C -0.885482 0.017156 -0.769466
C 0.872672 0.744196 1.031685
C -3.369902 2.593760 -0.602407
C -0.322562 -2.178856 1.304005
C 0.509601 -2.828190 2.155470
C 3.236729 0.123485 0.392207
H -1.044256 2.510563 0.749148
H -1.909295 1.596427 2.006538
H -3.491361 0.653853 0.384345
H -2.103089 -0.989981 1.549046
H -0.774619 -0.561531 2.663417
H -4.137668 2.338639 -1.352019
H -3.853645 3.165926 0.210223
H -2.611833 3.238592 -1.079169
H -0.550989 -2.626186 0.325971
H 1.412255 -0.462240 -0.537200
H 0.961917 -3.790419 1.891205
H 0.770642 -2.412029 3.136498
H 4.894670 -0.505551 -0.662676
H 3.399675 -0.731523 -1.556394


