%chk=000126025.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126025

0 1
 O   -4.842800       1.014600      0.7787000    
 O   -5.500000       2.950600      -1.534600    
 O   -7.193200      0.5804000       2.228800    
 O  -0.2320000      -3.795500      0.4835000    
 O    5.027300      -2.302400     -0.9546000    
 N   -3.340300     -0.5734000     -0.1423000    
 N   -1.011700      0.1195000     -0.2570000    
 N   -2.980800      -2.750400      0.2685000    
 N   0.5677000      -1.656600      8.6800002E-02
 N    1.237300      0.5412000     -0.3221000    
 N    4.554500      -1.054900     -0.5669000    
 N    2.896200       2.577900      0.5355000    
 C   -4.066000      0.6687000     -0.3811000    
 C   -6.035300       1.678700      -1.174900    
 C   -5.032600      0.6134000      -1.555300    
 C   -6.104400       1.564900      0.3444000    
 C   -7.212300      0.6318000      0.8131000    
 C   -2.001400     -0.7632000     -9.8200001E-02
 C   -3.895200      -1.812600      8.7099999E-02
 C   -1.791300      -2.087800      0.1517000    
 C   0.2811000     -0.3899000     -0.1526000    
 C  -0.4436000      -2.610000      0.2588000    
 C    2.581600      0.3249000     -0.2726000    
 C    3.457300       1.456600      0.1998000    
 C    4.934000       1.210900      0.2500000    
 C    5.444400     -4.3800000E-02 -0.1365000    
 C    3.204000     -0.8146000     -0.6090000    
 C    5.801300       2.224500      0.6800000    
 C    6.830900     -0.2553000     -8.2400002E-02
 C    7.175800       1.994200      0.7269000    
 C    7.689700      0.7577000      0.3467000    
 H   -3.333900       1.470200     -0.5281000    
 H   -6.999400       1.564600      -1.678600    
 H   -5.536900     -0.3568000      -1.622900    
 H   -4.521600      0.8025000      -2.504600    
 H   -6.207600       2.541300      0.8310000    
 H   -7.061300     -0.3866000      0.4413000    
 H   -8.192500      0.9939000      0.4879000    
 H   -4.964600      -1.970900      0.1170000    
 H   -6.134900       3.625900      -1.240500    
 H   -1.160600       1.105200     -0.4449000    
 H   -7.908800     -1.7800000E-02   2.503800    
 H   0.9615000       1.518900     -0.3083000    
 H    2.675000      -1.673100      -1.004800    
 H    5.453900       3.204800      0.9868000    
 H    7.260500      -1.210700     -0.3731000    
 H    7.846700       2.780700       1.060400    
 H    8.760600      0.5804000      0.3839000    
 H    3.558500       3.289200      0.8423000    
 H    5.190500      -2.169500      -1.904400    


%chk=000126025-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126025

0 1
O -3.778376 1.229482 -1.505825
O -6.189716 2.326242 0.128327
O -1.294019 2.311756 -0.488570
O -0.668726 -4.458950 -1.754409
O 4.510823 -2.252196 0.421975
N -4.012004 -1.154599 -1.617022
N -1.639527 -0.426989 -1.581661
N -3.645286 -3.418985 -1.748593
N -0.019526 -2.220061 -1.417067
N 0.529614 0.098003 -1.089847
N 3.789505 -1.016265 0.239273
N 1.212631 2.281212 0.318494
C -4.704624 0.107647 -1.256473
C -4.932106 1.699070 0.559876
C -5.085061 0.200786 0.245416
C -3.724580 2.130202 -0.310809
C -2.375770 2.021647 0.436654
C -2.641392 -1.359410 -1.644288
C -4.577580 -2.458517 -1.689419
C -2.404753 -2.744324 -1.709551
C -0.350096 -0.937409 -1.383900
C -1.018072 -3.252911 -1.651281
C 1.758559 0.055521 -0.435771
C 2.123740 1.288573 0.265233
C 3.464752 1.303957 0.876004
C 4.283465 0.117641 0.883787
C 2.561383 -1.077798 -0.388260
C 3.996558 2.466976 1.507045
C 5.551313 0.102411 1.530178
C 5.252140 2.461293 2.127027
C 6.027744 1.266818 2.144590
H -5.585043 0.220519 -1.912864
H -4.749777 1.890240 1.637035
H -4.391516 -0.404322 0.853766
H -6.116593 -0.131374 0.437743
H -3.828740 3.154498 -0.712607
H -2.269598 1.008455 0.888148
H -2.397284 2.761304 1.267771
H -5.653260 -2.618872 -1.697791
H -6.103691 3.312556 0.160178
H -1.839535 0.587071 -1.552855
H -0.316298 2.365836 -0.044044
H 0.097795 1.031524 -1.104323
H 2.221831 -2.024750 -0.818417
H 3.413030 3.395067 1.500621
H 6.126051 -0.825946 1.547689
H 5.636642 3.371093 2.598316
H 7.003363 1.255393 2.641560
H 1.541054 3.123192 0.817486
H 4.895859 -2.470008 -0.474143


