%chk=000103888.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103888

0 1
 N    2.334700       1.184900     -0.1955000    
 N   -6.287000     -0.1020000     -0.5034000    
 C    2.473500      -1.177400      0.3997000    
 C    1.629600      0.1403000      0.5668000    
 C    3.817200     -0.5856000      3.7900001E-02
 C    3.660900      0.7637000     -0.3090000    
 C    2.002200      -2.086900     -0.7485000    
 C    2.510000      -1.969300       1.711900    
 C   0.2018000      3.5799999E-02  0.1355000    
 C    5.057100      -1.209400     -7.4000000E-03
 C    1.996200       2.588500     -9.0200000E-02
 C    4.764400       1.503400     -0.7146000    
 C    6.163600     -0.4614000     -0.4068000    
 C    6.018000      0.8861000     -0.7594000    
 C  -0.8360000      0.2785000      0.9509000    
 C   -2.255500      0.1793000      0.5721000    
 C   -2.611500     -0.5686000     -0.5388000    
 C   -3.209200      0.8360000       1.333800    
 C   -3.956200     -0.6624000     -0.8977000    
 C   -4.554000      0.7422000      0.9751000    
 C   -4.927500     -7.1000000E-03 -0.1406000    
 C   -6.787700      -1.287300      -1.170600    
 C   -7.204500      0.9787000     -0.2013000    
 H    1.670700      0.4441000       1.624400    
 H    2.695300      -2.923800     -0.8976000    
 H    1.017400      -2.519600     -0.5402000    
 H    1.945300      -1.547300      -1.701300    
 H    2.923100      -1.370900       2.532400    
 H    1.503400      -2.289300       2.003100    
 H    3.131500      -2.867600       1.622200    
 H   3.7900001E-02 -0.2036000     -0.9112000    
 H    5.170700      -2.256300      0.2531000    
 H   0.9113000       2.731400     -6.4400002E-02
 H    2.369700       3.150000     -0.9529000    
 H    2.414900       3.023100      0.8238000    
 H    4.675800       2.547900     -0.9952000    
 H    7.144400     -0.9268000     -0.4504000    
 H    6.888300       1.456600      -1.072800    
 H  -0.6433000      0.5625000       1.983200    
 H   -1.892300      -1.111300      -1.144200    
 H   -2.933500       1.422300       2.206400    
 H   -4.212900      -1.247900      -1.776000    
 H   -5.285700       1.255100       1.592900    
 H   -7.878000      -1.357600      -1.087000    
 H   -6.378600      -2.201300     -0.7253000    
 H   -6.540600      -1.265900      -2.237200    
 H   -6.753800       1.956800     -0.4044000    
 H   -7.519600      0.9390000      0.8467000    
 H   -8.107300      0.9146000     -0.8192000    


%chk=000103888-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103888

0 1
N 2.491814 1.066654 -0.542540
N -6.460857 -0.125789 -0.379657
C 2.521277 -1.105697 0.522013
C 1.673415 0.233938 0.401138
C 3.935032 -0.577097 0.243859
C 3.839197 0.682923 -0.416074
C 2.143269 -2.127907 -0.588366
C 2.341255 -1.746713 1.913484
C 0.245218 0.079409 -0.048357
C 5.185569 -1.169883 0.459890
C 2.105809 2.449256 -0.818235
C 4.998534 1.366054 -0.850200
C 6.362174 -0.496020 0.027731
C 6.258431 0.756313 -0.621137
C -0.827881 0.359023 0.750528
C -2.255936 0.215262 0.427800
C -2.739576 -0.278335 -0.818430
C -3.235117 0.585636 1.391962
C -4.111048 -0.391527 -1.089273
C -4.613543 0.478677 1.142327
C -5.092505 -0.014158 -0.113354
C -6.919593 -0.635764 -1.677531
C -7.441019 0.270250 0.638481
H 1.681061 0.716651 1.410395
H 2.837861 -2.986918 -0.557860
H 1.115186 -2.508162 -0.443578
H 2.214268 -1.667894 -1.590401
H 2.676762 -1.064769 2.715768
H 1.277719 -1.996783 2.087987
H 2.924997 -2.682385 1.994839
H 0.105445 -0.282564 -1.076166
H 5.262932 -2.140893 0.964407
H 1.009962 2.503863 -0.929733
H 2.562205 2.792358 -1.764431
H 2.411700 3.153599 -0.010413
H 4.936515 2.341318 -1.344363
H 7.346812 -0.943581 0.201006
H 7.168720 1.273131 -0.948033
H -0.615077 0.738368 1.763444
H -2.027583 -0.582958 -1.594207
H -2.902640 0.968912 2.365614
H -4.425555 -0.776964 -2.063398
H -5.317267 0.778331 1.923877
H -8.020665 -0.652686 -1.696216
H -6.560823 -1.668489 -1.865162
H -6.574956 0.001945 -2.517297
H -7.342322 1.341122 0.911125
H -7.335929 -0.327858 1.566847
H -8.459046 0.113002 0.248690


