%chk=000104145.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104145

0 1
 O   -4.971000      -2.297600      9.2799999E-02
 O   -5.024500       2.322100      9.8999999E-03
 N   -4.699400      1.8800000E-02  0.2518000    
 N   -1.013100      1.9099999E-02  0.8167000    
 N    2.584900     -6.0199998E-02 -0.1819000    
 N    6.267200      5.5500001E-02  0.3091000    
 N    9.852700     -3.3599999E-02 -0.6903000    
 C   -3.452100      3.6699999E-02  0.9920000    
 C   -2.254600     -2.8899999E-02  5.5399999E-02
 C   -6.579900     -0.7824000     -0.8666000    
 C   -6.595000      0.7368000     -0.8960000    
 C   -5.329200      -1.147500     -0.1208000    
 C   -5.354500       1.156700     -0.1616000    
 C   0.1422000     -5.3100001E-02 -6.7100003E-02
 C    1.442700      4.2800002E-02  0.7171000    
 C    3.837500      1.9500000E-02  0.5568000    
 C    5.020100     -4.9600001E-02 -0.3981000    
 C    7.412100     -5.3900000E-02 -0.5960000    
 C    8.713800      9.8899998E-02  0.1768000    
 H   -3.416900      0.9554000       1.589500    
 H   -3.441700     -0.8192000       1.677500    
 H   -2.299300      0.8074000     -0.6536000    
 H   -2.302900     -0.9552000     -0.5305000    
 H   -6.543400      -1.200600      -1.876800    
 H   -7.452900      -1.180200     -0.3410000    
 H   -6.562800       1.115900      -1.921700    
 H   -7.478000       1.137100     -0.3894000    
 H   0.1225000      -1.000800     -0.6203000    
 H   0.1021000      0.7608000     -0.8027000    
 H    1.474700      0.9957000       1.260600    
 H    1.478700     -0.7659000       1.457900    
 H  -0.9770000      0.8795000       1.362800    
 H    3.898800     -0.8078000       1.275200    
 H    3.881400      0.9584000       1.123600    
 H    2.544400      0.6856000     -0.8761000    
 H    4.939600      0.7642000      -1.130300    
 H    4.975800     -0.9950000     -0.9546000    
 H    6.328700     -0.6668000       1.026000    
 H    7.395200      -1.027400      -1.102600    
 H    7.352000      0.7257000      -1.365900    
 H    8.744200       1.076600      0.6722000    
 H    8.775500     -0.6634000      0.9621000    
 H    10.71030      0.1204000     -0.1619000    
 H    9.829900      0.6845000      -1.413100    


%chk=000104145-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104145

0 1
O -4.766784 -2.420307 0.040172
O -5.354784 2.225002 0.245103
N -4.790795 -0.068871 0.276468
N -1.057335 0.423327 0.562083
N 2.632923 0.259034 -0.227178
N 6.365880 -0.086060 0.296672
N 10.055806 -0.207141 -0.535040
C -3.469229 0.072635 0.909683
C -2.338180 0.216442 -0.135950
C -6.714805 -1.049204 -0.736275
C -6.907380 0.485160 -0.672904
C -5.337771 -1.315328 -0.115385
C -5.634395 1.029994 -0.014307
C 0.156103 0.260912 -0.265319
C 1.420400 0.335812 0.611083
C 3.907555 0.183439 0.518541
C 5.092170 0.001798 -0.449541
C 7.577634 -0.160747 -0.549389
C 8.852382 -0.146976 0.318571
H -3.508411 0.970126 1.553562
H -3.279390 -0.818762 1.529806
H -2.601703 1.035129 -0.849205
H -2.266797 -0.720730 -0.718348
H -6.726959 -1.448638 -1.764699
H -7.476762 -1.607045 -0.165471
H -7.024621 0.951028 -1.666313
H -7.779629 0.790216 -0.069872
H 0.122083 -0.730176 -0.753033
H 0.232168 1.021570 -1.085834
H 1.378970 1.263809 1.241579
H 1.417376 -0.520323 1.310534
H -1.044936 1.312526 1.081562
H 3.849602 -0.694002 1.195337
H 4.107810 1.074594 1.161229
H 2.653045 1.015541 -0.926524
H 5.155888 0.883415 -1.121045
H 4.886627 -0.883503 -1.098483
H 6.341975 -0.862577 0.974279
H 7.613746 -1.058359 -1.211822
H 7.580781 0.727979 -1.214048
H 8.801030 0.739966 0.992147
H 8.853937 -1.045193 0.968306
H 10.915728 -0.468287 -0.045462
H 10.187847 0.617775 -1.128371


