%chk=000147493.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147493

0 1
 O    6.928500       2.690600       1.143800    
 O    5.064200      -2.212400       1.369000    
 O   -9.309400     -0.2009000       1.992300    
 N    5.157700     -8.8799998E-02 -0.4796000    
 N   -6.531700      0.1402000     -0.3604000    
 N  -0.4137000     -5.7000000E-02  0.1378000    
 N  -0.9670000      0.1094000     -0.9747000    
 C    5.913200       1.144600     -0.3887000    
 C    5.862400      -1.332700     -0.7186000    
 C    3.755800     -8.0899999E-02 -0.3240000    
 C    6.156600       1.498700       1.068500    
 C    6.239700      -1.978600      0.6037000    
 C    3.037400      -1.273100     -0.4135000    
 C    3.087900       1.119400     -8.1000000E-02
 C    1.651100      -1.265200     -0.2598000    
 C    1.701600       1.127300      7.2600000E-02
 C   0.9831000     -6.4900003E-02 -1.6899999E-02
 C   -5.129700      0.1326000     -0.5151000    
 C   -7.174100     -2.2800000E-02  0.9069000    
 C   -2.357000      0.1172000     -0.8212000    
 C   -4.306200     -3.9200000E-02  0.5976000    
 C   -4.566900      0.2969000      -1.780700    
 C   -2.919800     -4.6999998E-02  0.4445000    
 C   -3.180600      0.2892000      -1.933800    
 C   -8.683000     -2.4999999E-03  0.7312000    
 H    6.890900       1.028100     -0.8759000    
 H    5.457400       1.972900     -0.9447000    
 H    5.314900      -2.020400      -1.370700    
 H    6.790500      -1.132900      -1.269900    
 H    6.716500      0.7170000       1.586100    
 H    5.227100       1.663100       1.620500    
 H    6.926000      -1.361700       1.187500    
 H    6.727000      -2.941600      0.4194000    
 H    3.482600      -2.241400     -0.6090000    
 H    3.586100       2.079200     -2.7999999E-03
 H    1.098600      -2.198600     -0.3321000    
 H    1.189100       2.067100      0.2620000    
 H   -6.891300     -0.9742000       1.374600    
 H   -6.888700      0.7767000       1.602000    
 H   -7.090600      0.2744000      -1.196100    
 H    7.066900       2.882600       2.087000    
 H    5.343300      -2.637500       2.197800    
 H   -4.702900     -0.1690000       1.600100    
 H   -5.197600      0.4317000      -2.655800    
 H   -2.335800     -0.1849000       1.350600    
 H   -2.750600      0.4178000      -2.923500    
 H   -9.016400      0.9577000      0.3228000    
 H   -9.008900     -0.7987000      5.3100001E-02
 H   -10.26950     -0.1815000       1.839700    


%chk=000147493-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147493

0 1
O 6.952042 2.918890 -0.107055
O 5.776020 -2.425712 1.901096
O -9.764039 -1.253786 0.881513
N 5.285742 -0.412414 -0.436600
N -6.714488 0.664920 0.037262
N -0.388750 -0.384647 0.087162
N -1.050582 0.679483 -0.322733
C 6.046041 0.802891 -0.776312
C 6.034622 -1.679750 -0.394921
C 3.886162 -0.367731 -0.282369
C 6.151931 1.793130 0.400079
C 6.776121 -1.990923 0.916868
C 3.168179 -1.458274 0.302491
C 3.130894 0.773572 -0.718336
C 1.769349 -1.421227 0.397030
C 1.735012 0.803292 -0.613259
C 1.021990 -0.300996 -0.060443
C -5.320530 0.627514 -0.015416
C -7.548887 -0.399673 0.599899
C -2.463256 0.589047 -0.185785
C -4.575357 -0.509060 0.434335
C -4.604015 1.746892 -0.541703
C -3.176252 -0.525722 0.345693
C -3.205232 1.723409 -0.622008
C -9.016100 -0.188599 0.204933
H 7.069805 0.510337 -1.068585
H 5.609616 1.331240 -1.645948
H 5.353340 -2.520556 -0.614354
H 6.791133 -1.661572 -1.205572
H 6.649510 1.303276 1.263577
H 5.141863 2.122477 0.716136
H 7.327673 -1.091721 1.265134
H 7.510561 -2.803824 0.723323
H 3.718370 -2.295527 0.738416
H 3.639606 1.633176 -1.165906
H 1.220250 -2.254088 0.849840
H 1.163417 1.669510 -0.961511
H -7.221379 -1.380561 0.208665
H -7.481731 -0.444867 1.707987
H -7.162192 1.561119 -0.158540
H 6.946288 3.656141 0.552375
H 6.186830 -2.503206 2.797561
H -5.096744 -1.371704 0.861258
H -5.158860 2.627287 -0.890950
H -2.600733 -1.391941 0.687423
H -2.649332 2.576102 -1.026555
H -9.361950 0.815874 0.540156
H -9.120826 -0.249331 -0.898977
H -10.716431 -1.216166 0.616225


