%chk=000099481.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099481

0 1
 O   -3.159500      -2.482500       1.849000    
 O    3.202900      -2.437400      -1.914400    
 O   -1.361100      -1.260600       1.546300    
 O    1.400300      -1.214100      -1.643800    
 O   -7.572600      0.7977000      -1.008500    
 O    7.540700      0.7770000       1.127100    
 O   -7.401800      -1.083700      0.1095000    
 O    7.396700      -1.084400     -2.7500000E-02
 N   -1.389800      0.8939000      0.3046000    
 N    1.399500      0.9189000     -0.3651000    
 N   -2.588100      -1.464700       1.392600    
 N    2.621500      -1.425400      -1.457600    
 N   -6.892100     -4.4199999E-02 -0.3741000    
 N    6.876300     -5.1399998E-02  0.4587000    
 C  -0.7506000       2.057700     -0.2229000    
 C   0.7221000       2.081700      0.1597000    
 C   -2.771100      0.6407000      0.1449000    
 C    2.747500      0.6629000     -0.1733000    
 C   -3.359000     -0.5082000      0.6745000    
 C    3.374100     -0.4841000     -0.7009000    
 C   -3.548600       1.562200     -0.5563000    
 C    3.534100       1.564300      0.5701000    
 C   -4.724500     -0.7352000      0.5027000    
 C    4.733200     -0.7192000     -0.4931000    
 C   -5.502000      0.1865000     -0.1986000    
 C    5.492700      0.1875000      0.2464000    
 C   -4.914000       1.335100     -0.7281000    
 C    4.893200       1.329200      0.7780000    
 H   -1.215000       2.968300      0.1743000    
 H  -0.8344000       2.076600      -1.316700    
 H   0.8061000       2.105800       1.253500    
 H    1.170900       2.997400     -0.2428000    
 H  -0.8222000      0.2199000      0.7995000    
 H   0.8455000      0.2673000     -0.9040000    
 H   -3.136900       2.469000     -0.9885000    
 H    3.113700       2.467600       1.003800    
 H   -5.187000      -1.629600      0.9136000    
 H    5.204700      -1.608200     -0.9054000    
 H   -5.488900       2.074200      -1.280400    
 H    5.454100       2.057000       1.358900    


%chk=000099481-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099481

0 1
O -3.218970 -2.342460 2.218590
O 3.232954 -2.319181 -2.245069
O -1.349699 -1.078471 1.925542
O 1.360642 -1.057908 -1.959587
O -7.579994 0.536660 -1.250080
O 7.565256 0.542652 1.273375
O -7.391517 -1.297382 0.101689
O 7.389120 -1.282084 -0.092566
N -1.422688 1.031217 0.387052
N 1.419120 1.039968 -0.404527
N -2.617616 -1.336542 1.691208
N 2.626910 -1.316584 -1.716739
N -6.903453 -0.251670 -0.478139
N 6.895370 -0.241281 0.491242
C -0.749534 2.196899 -0.196819
C 0.739432 2.200612 0.182334
C -2.740086 0.716431 0.184922
C 2.735608 0.726171 -0.195529
C -3.361187 -0.439235 0.803349
C 3.362763 -0.424430 -0.817314
C -3.578785 1.527310 -0.655363
C 3.567384 1.532694 0.655809
C -4.717957 -0.752689 0.583212
C 4.718268 -0.737678 -0.589414
C -5.483779 0.072342 -0.248806
C 5.476997 0.082563 0.253754
C -4.919215 1.217393 -0.872489
C 4.906569 1.222923 0.880667
H -1.205996 3.138265 0.170399
H -0.851529 2.190842 -1.301518
H 0.841234 2.191662 1.286912
H 1.190758 3.145484 -0.182260
H -0.918152 0.379607 1.016307
H 0.921240 0.393611 -1.044397
H -3.154393 2.411249 -1.137431
H 3.138637 2.413427 1.139845
H -5.159658 -1.630941 1.061426
H 5.164512 -1.612152 -1.070343
H -5.551683 1.836949 -1.513914
H 5.533714 1.839256 1.530369


