%chk=000124900.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124900

0 1
 O   -3.478800       3.241400     -0.5069000    
 O   -2.869700      -1.642300      -1.657800    
 O   -3.682800       1.970300       1.398400    
 O    3.606700     -0.9913000      0.3061000    
 N   -2.596300     -0.2467000      0.1745000    
 N   -3.852300      -3.380300      0.4726000    
 N    1.992900       2.445800      0.6486000    
 N    4.090300       3.160400       1.328500    
 N    3.745100       2.951700     -0.9148000    
 C   -2.657800      0.9917000     -0.5590000    
 C   -1.268100       1.407700      -1.056700    
 C   -2.586800      -2.647500      0.5287000    
 C  -0.2771000       1.738600      6.9899999E-02
 C   -1.428600      -3.573200      0.1289000    
 C   -2.709600      -1.482500     -0.4487000    
 C    1.103600       2.107600     -0.4638000    
 C  -8.4899999E-02  -2.884300      0.1756000    
 C   -3.328000       2.106800      0.2321000    
 C   0.4047000      -2.231900     -0.9558000    
 C   0.6661000      -2.900800       1.351000    
 C    1.645400      -1.595900     -0.9120000    
 C    1.906800      -2.264800       1.394900    
 C    2.396300      -1.612500      0.2633000    
 C   -4.104500       4.340800      0.1627000    
 C    3.194000       2.825200      0.3410000    
 C    4.347100     -0.9274000     -0.9119000    
 C    5.826000     -0.9066000     -0.5893000    
 H   -3.299600      0.8186000      -1.432600    
 H  -0.8490000      0.6042000      -1.675300    
 H   -1.359700       2.284100      -1.710700    
 H   -2.434000      -2.282800       1.551000    
 H  -0.1786000      0.8821000      0.7479000    
 H  -0.6607000       2.570300      0.6732000    
 H   -2.447700     -0.2003000       1.178200    
 H   -1.583500      -3.975800     -0.8819000    
 H   -1.402100      -4.449300      0.7912000    
 H    1.511900       1.271700      -1.039900    
 H   0.9994000       2.968800      -1.135700    
 H   -4.605100      -2.788100      0.8221000    
 H   -3.809900      -4.183400       1.098900    
 H  -0.1654000      -2.213500      -1.880400    
 H   0.2941000      -3.403700       2.239600    
 H    1.979000      -1.081600      -1.808300    
 H    2.487000      -2.280000       2.313300    
 H   -4.162800       5.177200     -0.5389000    
 H   -3.506400       4.647800       1.026000    
 H   -5.118700       4.069300      0.4708000    
 H    4.071900     -1.7000001E-02  -1.454800    
 H    4.162600      -1.802700      -1.547200    
 H    5.034600       3.457500       1.108900    
 H    3.830700       3.116800       2.307900    
 H    3.224100       2.739900      -1.758200    
 H    4.705100       3.255800      -1.035700    
 H    6.068800     -4.8599999E-02  4.6300001E-02
 H    6.112800      -1.805500     -3.3599999E-02
 H    6.425300     -0.8493000      -1.502300    


%chk=000124900-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124900

0 1
O -2.903550 3.194484 0.683713
O -3.312840 -1.254508 -1.742341
O -2.389480 1.500680 2.196771
O 3.344610 -1.423957 1.506961
N -2.441051 -0.396652 0.229588
N -4.128494 -3.470639 -0.258550
N 2.379600 2.065585 -0.959002
N 4.430374 3.193085 -0.737819
N 3.192376 3.575883 -2.689838
C -2.549129 0.997117 -0.222171
C -1.412341 1.444565 -1.192957
C -2.837586 -2.845040 0.065703
C -0.014529 1.555662 -0.551571
C -1.593348 -3.649317 -0.476729
C -2.878074 -1.434805 -0.556700
C 1.056463 1.924357 -1.600895
C -0.257737 -3.103024 -0.007495
C -2.602291 1.882995 1.021724
C 0.564732 -2.327038 -0.858244
C 0.180781 -3.309854 1.330315
C 1.774328 -1.754736 -0.403941
C 1.381431 -2.749725 1.803480
C 2.180507 -1.958077 0.939108
C -2.950414 4.156775 1.814083
C 3.265241 2.895999 -1.462669
C 4.171508 -0.538770 0.653466
C 5.290301 -0.002723 1.544273
H -3.502424 1.100823 -0.776262
H -1.405664 0.711539 -2.021695
H -1.711892 2.421810 -1.619158
H -2.731388 -2.761393 1.166195
H 0.272477 0.601758 -0.073418
H -0.006338 2.330916 0.239362
H -2.137649 -0.556089 1.195303
H -1.657715 -3.658781 -1.581061
H -1.725278 -4.693595 -0.127867
H 1.084845 1.118200 -2.369109
H 0.726986 2.855619 -2.127306
H -4.448001 -3.220706 -1.202189
H -4.171881 -4.475491 -0.066317
H 0.249884 -2.155802 -1.895409
H -0.424909 -3.924399 2.009060
H 2.373737 -1.144292 -1.085067
H 1.719286 -2.904767 2.832946
H -3.185772 5.123049 1.347515
H -1.975397 4.186488 2.328368
H -3.732051 3.858704 2.532377
H 3.541772 0.278001 0.244278
H 4.583971 -1.133399 -0.188854
H 5.306524 3.351140 -1.233049
H 4.474490 2.802848 0.202057
H 2.454427 3.342018 -3.347814
H 3.683327 4.458541 -2.815624
H 4.873702 0.591611 2.376419
H 5.882265 -0.828799 1.974970
H 5.971081 0.638621 0.952985


