%chk=000097677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097677

0 1
 O    3.966000      -1.088900     -0.6492000    
 N    1.563700      0.1413000      0.1707000    
 C  -0.8382000      0.3783000     -2.0999999E-03
 C    2.828900      0.8698000      0.1407000    
 C   -1.915200       1.244700     -0.1900000    
 C   -1.064500     -0.9859000      0.1813000    
 C   0.5202000      0.8972000      2.3000001E-03
 C    3.969500     -0.1034000      0.3754000    
 C   -3.218300      0.7472000     -0.1945000    
 C   -2.367600      -1.483500      0.1767000    
 C   -3.444400     -0.6169000     -1.1200000E-02
 H    2.955300       1.343700     -0.8406000    
 H    2.848900       1.645900      0.9147000    
 H   -1.755100       2.310200     -0.3343000    
 H  -0.2452000      -1.684300      0.3298000    
 H   0.6381000       1.986400     -0.1470000    
 H    3.859400     -0.6090000       1.340200    
 H    4.930000      0.4204000      0.3542000    
 H   -4.056800       1.421800     -0.3408000    
 H   -2.544300      -2.545500      0.3194000    
 H   -4.459000      -1.004400     -1.4700000E-02
 H    4.708400      -1.690500     -0.4685000    


%chk=000097677-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097677

0 1
O 3.659187 -0.406977 -1.277836
N 1.620086 0.215371 0.792999
C -0.708076 0.326759 0.050952
C 2.975777 0.795343 0.797971
C -1.673632 1.054648 -0.695045
C -1.094178 -0.880622 0.697070
C 0.675357 0.840182 0.139868
C 3.955679 -0.203921 0.143493
C -3.001791 0.586451 -0.797202
C -2.419478 -1.345703 0.594748
C -3.377591 -0.614709 -0.152621
H 3.039237 1.770127 0.260934
H 3.286743 0.949261 1.850463
H -1.380072 1.987057 -1.194186
H -0.337647 -1.426114 1.270675
H 0.863556 1.806672 -0.381561
H 3.927443 -1.162893 0.700509
H 4.980621 0.201073 0.170178
H -3.739951 1.153371 -1.374977
H -2.713042 -2.275548 1.094630
H -4.407968 -0.979620 -0.229823
H 2.749539 -0.795607 -1.348739


