%chk=000133602.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133602

0 1
 O    2.969100       1.687500     -0.1566000    
 N   -1.360300     -0.1499000     -4.6999999E-03
 N   -4.206000      3.3300001E-02  0.1268000    
 N   0.5563000      -1.593600      0.1186000    
 C   -2.193800      -1.222000     -0.5655000    
 C   -1.996200      0.6765000       1.027200    
 C   -3.561200     -0.6770000     -0.9766000    
 C   -3.371500       1.152600      0.5601000    
 C   2.6799999E-02 -0.3349000      1.1900000E-02
 C   0.9135000      0.7559000     -7.9300001E-02
 C    2.282300      0.5147000     -5.7900000E-02
 C    1.901900      -1.763200      0.1340000    
 C   0.7697000       2.162500     -0.1985000    
 C    2.843200     -0.7485000      4.9100000E-02
 C    2.044000       2.679400     -0.2413000    
 C    2.382100      -3.173300      0.2527000    
 H   -2.311600      -2.021500      0.1771000    
 H   -1.715400      -1.657200      -1.451800    
 H   -1.397000       1.552100       1.292000    
 H   -2.100300      7.9800002E-02   1.943000    
 H   -3.457800     -8.7000001E-03  -1.840700    
 H   -4.201000      -1.509200      -1.289800    
 H   -3.871400       1.671800       1.385000    
 H   -3.263100       1.877100     -0.2569000    
 H   -5.109700      0.3882000     -0.1843000    
 H  -0.1423000       2.738600     -0.2610000    
 H    3.911600     -0.9156000      6.3800000E-02
 H    2.440700       3.680300     -0.3293000    
 H    2.985200      -3.295000       1.158100    
 H    1.541000      -3.872000      0.3112000    
 H    2.985700      -3.444500     -0.6194000    


%chk=000133602-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133602

0 1
O 3.040824 1.743470 0.046358
N -1.371543 -0.197043 0.203528
N -4.188925 0.116408 -0.054571
N 0.532464 -1.566175 0.013513
C -2.225336 -1.385461 -0.020192
C -2.076842 0.883683 0.922633
C -3.492864 -0.963324 -0.791169
C -3.337043 1.308537 0.141333
C 0.018718 -0.299844 0.127320
C 0.905288 0.836658 0.120844
C 2.298479 0.547754 0.073861
C 1.883927 -1.787654 -0.063700
C 0.801068 2.292670 0.085894
C 2.839067 -0.744293 -0.008679
C 2.084570 2.791308 0.046975
C 2.320185 -3.234657 -0.201077
H -2.518757 -1.832827 0.953168
H -1.640181 -2.132365 -0.576507
H -1.411002 1.740307 1.088625
H -2.399563 0.505240 1.917211
H -3.186696 -0.655832 -1.821688
H -4.169868 -1.833013 -0.876881
H -3.897422 2.060356 0.727390
H -3.013818 1.780721 -0.820371
H -5.110539 0.341695 -0.447927
H -0.097300 2.904361 0.059877
H 3.913214 -0.933118 -0.052225
H 2.497450 3.795525 0.011572
H 2.987535 -3.532292 0.629132
H 1.434244 -3.888009 -0.193493
H 2.875166 -3.398586 -1.143753


