%chk=000075390.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075390

0 1
 O    3.839800       3.018100      0.4293000    
 N   -4.713500     -0.1165000     -0.1552000    
 N   0.7433000      -1.365900     -0.3193000    
 C   -3.339400     -0.4323000     -0.1914000    
 C   -5.413600      0.2545000      -1.368800    
 C   -5.446700     -0.1725000       1.093900    
 C   -1.314900      -1.100500      0.9453000    
 C   -2.673900     -0.7882000      0.9817000    
 C  -0.6237000      -1.056400     -0.2641000    
 C   -2.645700     -0.3885000      -1.400800    
 C   -1.286800     -0.7010000      -1.437200    
 C    3.032300     -0.4623000     -0.1678000    
 C    1.549700     -0.3649000     -0.1489000    
 C   -5.158800       1.714000      -1.693300    
 C   -5.372000       1.165800       1.803600    
 C    3.809100      0.6877000      2.8800000E-02
 C  -0.6229000      -1.477200       2.214500    
 C   0.9582000      0.9738000      8.1699997E-02
 C    3.678600      -1.688200     -0.3792000    
 C    3.176600       2.002700      0.2560000    
 C    5.208400      0.6105000      1.3900000E-02
 C    1.704300       2.062100      0.2679000    
 C    5.074000      -1.760500     -0.3934000    
 C    5.837600     -0.6141000     -0.1974000    
 H   -5.168000     -0.3997000      -2.212900    
 H   -6.495400      0.1261000      -1.235300    
 H   -6.505500     -0.3803000      0.8900000    
 H   -5.147000      -1.000300       1.744500    
 H   -3.161700     -0.8141000       1.949600    
 H   -3.102400     -0.1216000      -2.347200    
 H  -0.7554000     -0.6658000      -2.384900    
 H   -5.565000       2.374600     -0.9225000    
 H   -4.096600       1.950800      -1.799700    
 H   -5.652200       1.975000      -2.635600    
 H   -4.339000       1.483400       1.976300    
 H   -5.875700       1.952400       1.235400    
 H   -5.869800       1.099600       2.776700    
 H   -1.337500      -1.717700       3.009300    
 H  -1.4000000E-03  -2.367900       2.072800    
 H   4.6000001E-03 -0.6528000       2.567100    
 H  -0.1062000       1.164700      0.1155000    
 H    3.107200      -2.599700     -0.5349000    
 H    5.824600       1.493000      0.1649000    
 H    1.244900       3.030500      0.4347000    
 H    5.563600      -2.716200     -0.5581000    
 H    6.921800     -0.6739000     -0.2089000    


%chk=000075390-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075390

0 1
O 4.905180 2.835095 -1.263094
N -4.812049 -0.252275 -0.333118
N 0.815047 -0.559589 0.392748
C -3.425952 -0.277956 -0.151158
C -5.413773 0.443373 -1.492971
C -5.727612 -0.820698 0.680611
C -1.441995 -0.956523 1.194395
C -2.831024 -0.869066 1.014316
C -0.555033 -0.386693 0.209804
C -2.530855 0.243692 -1.144420
C -1.146115 0.196303 -0.958799
C 3.175725 -0.205798 -0.003737
C 1.772711 0.277771 -0.024621
C -5.439174 1.986523 -1.371616
C -6.016789 0.116387 1.878969
C 4.239532 0.648314 -0.434396
C -0.861759 -1.596802 2.437673
C 1.545824 1.671157 -0.420276
C 3.481897 -1.531585 0.409152
C 3.971488 2.050034 -0.871782
C 5.574805 0.166833 -0.444415
C 2.572709 2.505537 -0.799522
C 4.810004 -1.994202 0.404489
C 5.863752 -1.144001 -0.026877
H -4.877983 0.148475 -2.415790
H -6.447023 0.068271 -1.604155
H -6.677610 -1.065643 0.171536
H -5.316009 -1.781068 1.043158
H -3.466769 -1.277818 1.804909
H -2.916255 0.661093 -2.078467
H -0.492584 0.546611 -1.765151
H -6.056181 2.308007 -0.514511
H -4.422554 2.391871 -1.230339
H -5.864449 2.433761 -2.289148
H -5.084150 0.407340 2.392202
H -6.524785 1.039100 1.548349
H -6.670861 -0.391821 2.611533
H -1.628676 -2.156989 2.999674
H -0.034038 -2.275458 2.165165
H -0.424090 -0.837524 3.112828
H 0.527367 2.065695 -0.335934
H 2.654733 -2.173254 0.726324
H 6.359915 0.850563 -0.783880
H 2.394422 3.559419 -1.041387
H 5.032764 -3.015925 0.732118
H 6.896173 -1.510236 -0.033790


