%chk=000044613.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044613

0 1
 N  -0.6953000      9.1499999E-02  0.5013000    
 N    4.415500       2.000100     -0.4076000    
 C   0.4982000      0.7501000      0.3224000    
 C   -1.936400      0.7292000      0.8935000    
 C  -0.5524000      -1.254300      0.2582000    
 C    1.445300     -0.2048000     -4.8400000E-02
 C   0.7811000      -1.471900     -8.8699996E-02
 C   -2.750200       1.193900     -0.3133000    
 C   0.8065000       2.108300      0.4601000    
 C   -4.047400       1.872500      0.1237000    
 C    2.768500      0.2177000     -0.2946000    
 C   -1.496600      -2.285600      0.3198000    
 C    1.193800      -2.787100     -0.3897000    
 C    3.092000       1.572800     -0.1616000    
 C    2.123800       2.502500      0.2103000    
 C   -1.063700      -3.579500      1.7400000E-02
 C   0.2611000      -3.828900     -0.3322000    
 C   -4.843900       2.373300      -1.070500    
 H   -2.509300      2.1900000E-02   1.503200    
 H   -1.696600       1.571200       1.552300    
 H   -2.981300      0.3388000     -0.9606000    
 H   -2.155000       1.891100     -0.9164000    
 H   -4.660800       1.168100      0.6973000    
 H   -3.821400       2.718500      0.7833000    
 H   6.0699999E-02   2.842800      0.7443000    
 H    3.525900     -0.5059000     -0.5851000    
 H   -2.532200      -2.103900      0.5862000    
 H    2.223600      -2.997400     -0.6643000    
 H    2.382400       3.554400      0.3106000    
 H   -1.772800      -4.402400      5.4900002E-02
 H   0.5757000      -4.842900     -0.5637000    
 H   -5.768300       2.853900     -0.7350000    
 H   -4.269400       3.106300      -1.645900    
 H   -5.112600       1.547400      -1.736800    
 H    4.657100       2.977700     -0.3143000    
 H    5.121700       1.328800     -0.6784000    


%chk=000044613-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044613

0 1
N -0.718121 0.101449 0.564554
N 4.494373 1.992427 -0.415086
C 0.518812 0.755782 0.353777
C -1.978883 0.757115 0.922012
C -0.550832 -1.264123 0.283269
C 1.501044 -0.212530 -0.045760
C 0.820980 -1.501526 -0.091616
C -2.803157 1.227211 -0.302124
C 0.856083 2.117715 0.489908
C -4.122909 1.915072 0.112100
C 2.830466 0.189803 -0.304191
C -1.495999 -2.313578 0.333603
C 1.236960 -2.814431 -0.411840
C 3.183103 1.558288 -0.165839
C 2.185283 2.507406 0.230496
C -1.053767 -3.614569 0.009745
C 0.298062 -3.866967 -0.359603
C -4.958146 2.377460 -1.101104
H -2.581280 0.054910 1.529692
H -1.751205 1.621991 1.574305
H -3.021722 0.354614 -0.948868
H -2.190245 1.923657 -0.907562
H -4.724327 1.216871 0.730322
H -3.897105 2.787739 0.759300
H 0.115840 2.868623 0.786005
H 3.586217 -0.544077 -0.609233
H -2.540487 -2.134770 0.610529
H 2.275857 -3.014972 -0.698136
H 2.465740 3.563390 0.330743
H -1.766905 -4.446422 0.041179
H 0.607506 -4.888351 -0.606592
H -5.895396 2.869406 -0.782679
H -4.391486 3.097188 -1.721056
H -5.227922 1.520506 -1.746361
H 4.746319 2.970214 -0.314410
H 5.214551 1.335683 -0.697781


