%chk=000001748.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001748

0 1
 O   -3.067200     -0.4051000     -7.6399997E-02
 O   -1.840700       2.088600     -5.4800000E-02
 N    4.690700      8.9100003E-02  0.6403000    
 C    2.538300     -7.9999998E-04 -0.5857000    
 C    1.056900     -0.1044000     -0.4509000    
 C    3.244100     -3.9500002E-02  0.7786000    
 C   0.2867000       1.050600     -0.3137000    
 C   0.4412000      -1.356000     -0.4615000    
 C   -1.099100      0.9537000     -0.1872000    
 C   -1.714600     -0.2980000     -0.1979000    
 C  -0.9445000      -1.452900     -0.3350000    
 C   -3.591900     -0.5253000       1.244300    
 H    2.909600     -0.8146000      -1.222900    
 H    2.795400      0.9267000      -1.114700    
 H    3.020200     -0.9793000       1.296300    
 H    2.878700      0.7709000       1.419800    
 H   0.7608000       2.029100     -0.3029000    
 H    1.030300      -2.263400     -0.5660000    
 H   -1.417400      -2.431200     -0.3445000    
 H    4.910200      0.9598000      0.1576000    
 H    5.042700     -0.6572000      4.1600000E-02
 H   -2.780800       1.841400     -2.0000000E-02
 H   -3.307300      0.3365000       1.856100    
 H   -3.239000      -1.449900       1.711900    
 H   -4.682600     -0.5616000       1.177400    


%chk=000001748-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001748

0 1
O -3.070786 0.195296 0.539275
O -1.691482 2.391345 -0.118388
N 4.865695 0.163815 0.415970
C 2.555277 -0.148014 -0.668275
C 1.061925 -0.114543 -0.390908
C 3.407322 0.165794 0.611111
C 0.359817 1.120560 -0.409708
C 0.355774 -1.292931 -0.044365
C -1.006992 1.169927 -0.091573
C -1.702929 -0.023546 0.254409
C -1.023688 -1.255501 0.277498
C -3.879717 -0.967098 0.900748
H 2.857155 -1.144195 -1.047845
H 2.823210 0.591838 -1.448481
H 3.155594 -0.571946 1.396420
H 3.106903 1.154803 1.005410
H 0.865165 2.054537 -0.678429
H 0.882937 -2.254037 -0.030483
H -1.548012 -2.180671 0.537128
H 5.215797 0.911422 -0.190585
H 5.262136 -0.747762 0.168289
H -2.640167 2.219911 0.125036
H -3.495865 -1.446248 1.822162
H -3.901107 -1.707500 0.077853
H -4.893261 -0.578053 1.077532


