%chk=000148722.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148722

0 1
 N   -1.274600     -1.8999999E-02  0.2944000    
 N    5.067900      0.7940000     -0.1682000    
 C   9.0499997E-02  0.1099000      0.1908000    
 C   0.6135000      -1.169300      1.6500000E-02
 C   -2.214600       1.068800      0.4841000    
 C   -1.650300      -1.337500      0.1936000    
 C  -0.4860000      -2.085400      1.8600000E-02
 C   -2.704800       1.639100     -0.8484000    
 C   0.8910000       1.258000      0.2385000    
 C    2.010100      -1.314100     -0.1184000    
 C   -3.709900       2.793000     -0.6833000    
 C    2.281900       1.106600      0.1036000    
 C    2.838000     -0.1756000     -7.4299999E-02
 C   -2.922800      -1.917800      0.2440000    
 C  -0.5971000      -3.485600     -0.1125000    
 C   0.2907000       2.618500      0.4272000    
 C    2.621600      -2.671500     -0.3084000    
 C   -3.142900       3.945200      0.1470000    
 C   -4.995400       2.273200     -3.5200000E-02
 C    3.136900       2.213700      0.1422000    
 C   -3.007200      -3.306400      0.1117000    
 C   -1.862800      -4.080800     -6.3900001E-02
 C    4.225500     -0.2629000     -0.2029000    
 C    4.500500       2.005700      3.5000001E-03
 H   -1.807200       1.791400       1.183900    
 H   -3.063300      0.6509000       1.036800    
 H   -3.186100      0.8369000      -1.424900    
 H   -1.874300       1.967600      -1.481800    
 H   -3.957900       3.170900      -1.683000    
 H   -3.824600      -1.329400      0.3732000    
 H   0.2637000      -4.133400     -0.2275000    
 H  -3.2400001E-02   2.753900       1.463600    
 H   0.9548000       3.455700      0.2154000    
 H  -0.5107000       2.802800     -0.2765000    
 H    2.776100      -3.157700      0.6595000    
 H    1.985800      -3.299600     -0.9346000    
 H    3.564200      -2.666700     -0.8592000    
 H   -2.216200       4.325700     -0.2923000    
 H   -3.855400       4.777800      0.1674000    
 H   -2.950500       3.663800       1.186200    
 H   -5.767900       3.050200     -5.5000000E-02
 H   -5.388000       1.406100     -0.5766000    
 H   -4.849900       1.989600       1.011800    
 H    2.827100       3.238200      0.2935000    
 H   -3.980900      -3.788200      0.1460000    
 H   -1.952200      -5.159600     -0.1594000    
 H    4.763500      -1.196000     -0.3174000    
 H    5.194800       2.839400      3.3199999E-02


%chk=000148722-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148722

0 1
N -1.201653 0.128399 0.178863
N 5.327387 0.596257 0.078722
C 0.211259 0.216844 0.102610
C 0.734579 -1.140510 -0.025921
C -2.196566 1.180724 0.459577
C -1.585155 -1.224420 0.068372
C -0.416059 -2.045521 -0.060387
C -2.895951 1.712397 -0.817336
C 1.053352 1.347069 0.118104
C 2.115090 -1.395596 -0.093580
C -4.056382 2.714938 -0.555796
C 2.470380 1.088324 0.106150
C 3.004963 -0.267263 0.001085
C -2.887173 -1.768986 0.092933
C -0.577052 -3.449081 -0.171062
C 0.553053 2.784428 0.111147
C 2.609878 -2.821660 -0.251965
C -3.584155 3.989213 0.187947
C -5.253034 2.056350 0.175101
C 3.438901 2.148704 0.205738
C -3.017841 -3.170734 -0.018385
C -1.876095 -4.003279 -0.151078
C 4.438451 -0.411620 -0.009489
C 4.804129 1.874136 0.189927
H -1.708425 1.996052 1.012433
H -2.948808 0.746697 1.144145
H -3.287991 0.848400 -1.389146
H -2.137670 2.193566 -1.466801
H -4.417481 3.030722 -1.557104
H -3.775631 -1.136928 0.188568
H 0.285382 -4.111977 -0.268717
H 0.456955 3.206876 1.131103
H 1.248105 3.436443 -0.443727
H -0.422011 2.878614 -0.388622
H 2.282204 -3.448342 0.599078
H 2.196375 -3.277427 -1.171276
H 3.704279 -2.898405 -0.313824
H -2.726474 4.463050 -0.326430
H -4.398413 4.735070 0.241326
H -3.277573 3.763704 1.226875
H -6.107933 2.755083 0.231189
H -5.594433 1.147129 -0.355014
H -4.995457 1.772039 1.212888
H 3.116296 3.187356 0.315119
H -4.017205 -3.619988 -0.005054
H -2.004247 -5.087373 -0.238523
H 4.884860 -1.407889 -0.088948
H 5.543190 2.678514 0.271685


