%chk=000135556.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135556

0 1
 O   -2.853800     -0.7459000      0.2558000    
 O   -2.384500       1.336000     -0.5219000    
 O    2.530900     -0.5475000       2.131000    
 O    3.095600      -2.150100      -2.137800    
 N  -0.6415000     -3.6699999E-02  0.2838000    
 N    2.273100       1.905800     -1.4300000E-02
 N   0.1061000       2.134200     -0.4423000    
 N    2.890500      -1.388400      8.6000003E-03
 N    2.610800      -1.245000      -1.450400    
 C   -4.237000     -0.5088000     -8.6000003E-03
 C   -4.693300      0.6883000      0.8243000    
 C   -4.405900     -0.2301000      -1.501400    
 C   -5.004400      -1.766500      0.3934000    
 C   0.3962000      0.9279000      7.1800001E-02
 C    1.692700      0.7248000      0.3536000    
 C   -1.983000      0.2757000     -4.7400001E-02
 C    1.281900       2.720500     -0.4860000    
 C  -0.3198000      -1.358800      0.8474000    
 C    2.380800     -0.4028000      0.8983000    
 C    3.673300       2.247100      7.2200000E-02
 C    3.591400      -2.579700      0.4700000    
 H   -4.386800       1.661700      0.4335000    
 H   -5.788300      0.7240000      0.8730000    
 H   -4.314700      0.6187000       1.850700    
 H   -4.127100      0.7796000      -1.813100    
 H   -5.456800     -0.3445000      -1.793900    
 H   -3.813800     -0.9306000      -2.101800    
 H   -6.080300      -1.661500      0.2201000    
 H   -4.645900      -2.636200     -0.1691000    
 H   -4.844800      -1.996400       1.453200    
 H    1.471400       3.722700     -0.8463000    
 H   0.3183000      -1.908000      0.1544000    
 H   -1.206300      -1.979500      0.9971000    
 H   0.1311000      -1.237800       1.834500    
 H    3.815900       3.285500     -0.2375000    
 H    3.997600       2.122900       1.108500    
 H    4.232600       1.581600     -0.5899000    
 H    4.569500      -2.633200     -1.7000001E-02
 H    2.996900      -3.462800      0.2179000    
 H    3.739400      -2.553800       1.552500    


%chk=000135556-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000135556

0 1
O -2.773025 -0.406044 0.823698
O -0.917254 -0.199777 -0.622682
O 1.317870 -1.783743 0.374585
O 2.497875 0.759172 -3.225510
N -0.863231 0.558583 1.610102
N 2.606287 1.454533 1.025050
N 0.864421 2.115347 2.317431
N 2.038550 -0.543497 -1.458032
N 2.229329 0.750326 -1.976098
C -3.651658 -1.099275 -0.216192
C -3.880577 -0.145921 -1.405525
C -2.996273 -2.430711 -0.633156
C -4.947791 -1.333101 0.578730
C 0.468830 1.027105 1.539910
C 1.531596 0.588700 0.720596
C -1.471253 -0.035005 0.500576
C 2.154860 2.332818 1.993315
C -1.629769 0.799048 2.858894
C 1.608885 -0.647906 -0.088375
C 3.963133 1.426569 0.463459
C 2.087808 -1.727302 -2.333238
H -2.939297 0.048319 -1.942488
H -4.603205 -0.601999 -2.106990
H -4.300511 0.813817 -1.055391
H -2.058130 -2.255808 -1.181942
H -3.692200 -2.991171 -1.284043
H -2.780118 -3.049437 0.255542
H -5.692950 -1.838670 -0.061086
H -4.753556 -1.966868 1.461152
H -5.372330 -0.374234 0.922837
H 2.789193 3.099835 2.430960
H -2.573290 1.320636 2.634307
H -1.010351 1.427903 3.513831
H -1.865728 -0.158643 3.353143
H 4.615337 2.062635 1.082950
H 4.365077 0.398895 0.475331
H 3.958280 1.800528 -0.572955
H 3.073237 -1.794809 -2.823945
H 1.315154 -1.640364 -3.116401
H 1.894775 -2.608084 -1.705449


