%chk=000122620.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122620

0 1
 O    1.391800     -0.6093000       2.282100    
 O    3.282400      -1.455000      0.4825000    
 O    5.750300      0.4840000     -0.7411000    
 O   -4.303900      -1.866900     -0.5129000    
 N  -0.1390000     -0.1799000     -3.6699999E-02
 N   -1.979900       1.400900      0.1228000    
 N   -1.362100      -2.026100     -0.3909000    
 N   -4.154100      0.4161000     -0.1421000    
 N   -3.871000       2.724600      0.2399000    
 C    1.035100      0.6626000      0.1566000    
 C    3.402500      0.7943000     -0.4264000    
 C    2.001500      0.7094000      -1.048500    
 C    1.920200      0.3493000       1.388900    
 C    3.278800     -7.6099999E-02  0.8272000    
 C    4.496600      0.3643000      -1.391400    
 C   -1.439100      0.1910000     -4.2199999E-02
 C  -0.1405000      -1.538700     -0.2533000    
 C   -2.176200     -0.9366000     -0.2581000    
 C   -3.622500     -0.8674000     -0.3193000    
 C   -3.371000       1.459500      6.2700003E-02
 H   0.6551000       1.682500      0.2977000    
 H    3.591200       1.828600     -0.1060000    
 H    1.796100       1.571900      -1.692000    
 H    1.907200     -0.1882000      -1.671400    
 H    2.052600       1.281500       1.953000    
 H    4.080200      9.6500002E-02   1.553000    
 H    4.502000       1.017500      -2.270500    
 H    4.369700     -0.6668000      -1.735600    
 H    1.533500      -1.491200       1.899300    
 H    4.198000      -1.702400      0.2689000    
 H   0.7692000      -2.120200     -0.3079000    
 H    6.431500      0.2167000      -1.381300    
 H   -1.440000       2.244400      0.2836000    
 H   -3.259500       3.518300      0.3964000    
 H   -4.869300       2.902000      0.2186000    


%chk=000122620-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122620

0 1
O 0.740829 1.358869 1.783031
O 2.761049 -0.086367 1.886125
O 4.199459 -1.624108 0.358886
O -3.647438 -2.112260 -1.522097
N 0.311919 0.370949 -1.005936
N -1.561830 0.811975 0.601166
N -0.759947 -1.224592 -2.282361
N -3.574916 -0.482977 0.175288
N -3.487042 1.047354 1.945713
C 1.220823 1.525614 -0.751989
C 3.498654 0.535813 -0.480598
C 2.603246 1.372594 -1.443453
C 1.671335 1.760017 0.741912
C 3.037831 0.998228 0.940827
C 3.353656 -0.983248 -0.689430
C -0.969617 0.178979 -0.477688
C 0.359762 -0.512769 -2.128169
C -1.618305 -0.798437 -1.249404
C -2.998732 -1.213875 -0.919246
C -2.890777 0.421544 0.864259
H 0.699298 2.430392 -1.120320
H 4.564766 0.781445 -0.632232
H 3.035059 2.386177 -1.538259
H 2.548077 0.967648 -2.466544
H 1.839292 2.847770 0.844846
H 3.788977 1.673014 1.391019
H 3.725782 -1.264431 -1.692927
H 2.308236 -1.320943 -0.574281
H 1.173188 0.542244 2.199232
H 3.345591 -0.873815 1.645871
H 1.223794 -0.583731 -2.781297
H 4.246673 -2.601135 0.216817
H -0.917116 1.249457 1.295211
H -3.075596 1.852641 2.409760
H -4.438581 0.761062 2.161867


