%chk=000173713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173713

1 1
 O   0.8800000      0.5640000       1.507700    
 O    1.461300       3.079900      0.5704000    
 O    4.997200     -0.9166000     -0.2203000    
 N   -2.872600      -1.337300      0.5390000    
 C   -1.324600     -0.9948000      0.4729000    
 C   -3.753100     -0.3109000     -0.2224000    
 C   -1.022700      0.4273000      4.3200001E-02
 C   -3.029000      0.2767000      -1.425000    
 C  -0.5437000      -1.956400     -0.4375000    
 C   -1.828500       1.032200     -0.9330000    
 C   -3.298800      -1.293400       2.018800    
 C   -3.212700      -2.741500      2.8100001E-02
 C   8.7800004E-02   1.116300      0.5460000    
 C   0.9284000      -1.680100     -0.3796000    
 C   -1.510700       2.307200      -1.410900    
 C   0.3915000       2.394400      7.6800004E-02
 C  -0.4037000       2.986800     -0.9031000    
 C    1.495500     -0.7745000      -1.269900    
 C    1.715700      -2.331700      0.5641000    
 C    2.865400     -0.5176000      -1.216200    
 C    3.085700      -2.074800      0.6179000    
 C    3.660600      -1.167600     -0.2722000    
 C    1.230900       3.912400       1.705300    
 H  -0.9879000      -1.167400       1.498500    
 H   -4.013100      0.4855000      0.4871000    
 H   -4.680400     -0.8136000     -0.5184000    
 H   -3.712200      0.9536000      -1.951200    
 H   -2.724300     -0.4978000      -2.136600    
 H  -0.8803000      -1.889100      -1.480000    
 H  -0.6906000      -3.000700     -0.1403000    
 H   -4.378800      -1.461500       2.071800    
 H   -2.762700      -2.081400       2.556400    
 H   -3.042600     -0.3087000       2.421400    
 H   -2.983300      -2.795100      -1.038800    
 H   -2.644700      -3.474000      0.6079000    
 H   -4.283000      -2.914700      0.1814000    
 H   -2.126100       2.781700      -2.170400    
 H  -0.1688000       3.980700      -1.274300    
 H   0.8980000     -0.2807000      -2.031400    
 H    1.278600      -3.037600       1.264800    
 H   0.3602000     -1.9600000E-02   2.080500    
 H    3.301800      0.1872000      -1.918900    
 H    3.699600      -2.583300       1.356200    
 H   0.8684000       3.319900       2.551300    
 H   0.5112000       4.700400       1.462400    
 H    2.179000       4.379000       1.986000    
 H    5.222300     -0.2647000     -0.9063000    


%chk=000173713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173713

1 1
O 0.663041 0.727387 1.559179
O 0.929857 3.569862 0.729306
O 5.158966 -1.117942 -0.022291
N -2.884622 -1.319365 0.430807
C -1.362362 -0.914875 0.404225
C -3.498226 -1.055772 -0.959904
C -1.252491 0.555902 0.022594
C -3.423130 0.426368 -1.357634
C -0.533881 -1.850923 -0.537291
C -2.165135 1.150736 -0.885606
C -3.601081 -0.498724 1.504819
C -3.069628 -2.792502 0.780610
C -0.189169 1.313336 0.594394
C 0.969240 -1.619421 -0.409402
C -1.978357 2.510752 -1.235153
C -0.034692 2.691233 0.263239
C -0.932541 3.261705 -0.679555
C 1.675663 -0.857106 -1.374383
C 1.705387 -2.198634 0.664215
C 3.070361 -0.667888 -1.276570
C 3.097090 -2.015733 0.778200
C 3.783801 -1.248591 -0.196949
C 1.797958 3.274798 1.891914
H -1.021465 -1.056307 1.448736
H -4.541521 -1.413860 -0.923994
H -2.939955 -1.694968 -1.661691
H -4.309821 0.961216 -0.964399
H -3.511781 0.476766 -2.459584
H -0.832274 -1.670246 -1.584838
H -0.742946 -2.909565 -0.298919
H -4.683365 -0.689528 1.434675
H -3.227399 -0.813311 2.491603
H -3.388875 0.567569 1.355955
H -2.782452 -3.424792 -0.070299
H -2.451238 -3.036166 1.658347
H -4.131209 -2.964629 1.016899
H -2.671901 2.993031 -1.933059
H -0.784375 4.312942 -0.942433
H 1.134125 -0.407033 -2.213767
H 1.193297 -2.818998 1.410405
H 1.120701 -0.082098 1.197400
H 3.595881 -0.078543 -2.037643
H 3.668700 -2.464696 1.594920
H 2.536556 2.495202 1.647790
H 1.201083 2.957983 2.762112
H 2.299308 4.233230 2.092273
H 5.585078 -0.599702 -0.750054


