%chk=000163890.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163890

0 1
 N   -3.005600      -1.127400      0.2780000    
 N  -0.2205000       2.824900      0.1892000    
 N    1.297600       1.045600      3.0000001E-04
 N   -3.987800      -3.118500      0.4777000    
 N    2.056000       3.266200      0.5488000    
 N    3.839500      -1.326600      0.4385000    
 C   -2.833000      0.2071000     -4.0700000E-02
 C   -1.447300       2.185600     -8.6700000E-02
 C   -1.620200      0.8390000      0.2336000    
 C   -3.873000      0.9217000     -0.6356000    
 C   -2.487100       2.900000     -0.6817000    
 C   -3.700100       2.268100     -0.9559000    
 C    1.106500       2.357100      0.2487000    
 C   -2.080900      -1.955200      0.8622000    
 C   -4.135100      -1.878100      6.8099998E-02
 C    2.580000      0.6317000      6.5899998E-02
 C    2.785400     -0.7719000     -0.2010000    
 C   -2.709500      -3.173000      0.9744000    
 C    3.640200       1.463800      0.3627000    
 C    3.315300       2.784000      0.5976000    
 C    1.943900      -1.465800      -1.055700    
 C    2.201000      -2.815700      -1.267900    
 C    3.276300      -3.422000     -0.6279000    
 C    4.058200      -2.640600      0.2075000    
 H  -0.8248000      0.3140000      0.7455000    
 H   -4.837500      0.4860000     -0.8727000    
 H   -2.364700       3.949400     -0.9376000    
 H  -0.2807000       3.836900      0.2515000    
 H   -4.509100       2.825200      -1.419400    
 H   -1.081500      -1.664200       1.150700    
 H   -5.045800      -1.507300     -0.3808000    
 H   -2.306100      -4.086500       1.386100    
 H    4.670800       1.134300      0.4068000    
 H    4.081700       3.513500      0.8364000    
 H    1.107500     -0.9976000      -1.564700    
 H    1.565500      -3.394100      -1.931800    
 H    3.495800      -4.472700     -0.7788000    
 H    4.908800      -3.065600      0.7300000    


%chk=000163890-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000163890

0 1
N -3.073197 -1.132049 -0.083325
N -0.202512 2.886190 -0.034675
N 1.311381 1.021682 -0.030496
N -3.886763 -3.211951 -0.515811
N 2.055468 3.351773 0.104277
N 4.192270 -1.244880 0.104171
C -2.925874 0.295530 -0.125088
C -1.464221 2.256034 -0.096980
C -1.628126 0.848558 -0.072083
C -4.072296 1.119905 -0.213979
C -2.612684 3.093481 -0.194543
C -3.896324 2.520465 -0.257434
C 1.087055 2.368737 0.014484
C -2.265766 -2.039954 0.627565
C -4.035838 -1.896890 -0.756580
C 2.621183 0.612070 0.019473
C 2.883806 -0.854745 -0.048282
C -2.786081 -3.305338 0.356701
C 3.684346 1.540230 0.123471
C 3.339641 2.910823 0.159745
C 1.835973 -1.785048 -0.267996
C 2.143317 -3.160671 -0.326833
C 3.486741 -3.569600 -0.164271
C 4.472002 -2.574660 0.046536
H -0.736463 0.222244 -0.036625
H -5.074922 0.682430 -0.219130
H -2.495346 4.183488 -0.220556
H -0.196486 3.909820 -0.016968
H -4.773562 3.172452 -0.324126
H -1.465487 -1.707033 1.282824
H -4.771592 -1.456074 -1.424121
H -2.452537 -4.267282 0.738935
H 4.713845 1.184095 0.168774
H 4.107886 3.687833 0.233598
H 0.814728 -1.421453 -0.400384
H 1.350351 -3.895588 -0.500154
H 3.769908 -4.626004 -0.202401
H 5.525877 -2.847318 0.173587


