%chk=000023221.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023221

0 1
 O    2.667500      0.7383000       1.450100    
 O    4.815300      -1.043600       1.038400    
 N    1.600200       1.301300     -0.5360000    
 N    3.394700     -0.1426000     -0.5817000    
 N    5.088000      -1.584700      -1.178300    
 C  -0.6781000       1.448300      0.4169000    
 C   -1.396600      0.7594000     -0.7510000    
 C   0.6031000       2.182700      2.6799999E-02
 C   -2.678500      6.9700003E-02 -0.3576000    
 C   -2.642700      -1.257800      4.1700002E-02
 C   -3.872200      0.7743000     -0.4010000    
 C   -3.828400      -1.895900      0.4060000    
 C   -5.057900      0.1361000     -3.6699999E-02
 C   -5.035800      -1.199000      0.3668000    
 C    2.561900      0.6437000      0.2284000    
 C    4.459500     -0.9302000     -0.1330000    
 H  -0.4449000      0.6998000       1.185400    
 H   -1.360300       2.168900      0.8856000    
 H   -1.610800       1.498300      -1.534600    
 H  -0.7294000      2.5200000E-02  -1.220800    
 H    1.024900       2.679600      0.9072000    
 H   0.3877000       2.950300     -0.7238000    
 H    1.591500       1.149900      -1.539800    
 H   -1.706900      -1.808400      7.7699997E-02
 H   -3.899300       1.814800     -0.7118000    
 H   -3.811200      -2.935200      0.7209000    
 H   -5.998200      0.6788000     -6.6500001E-02
 H   -5.959000      -1.695700      0.6508000    
 H    3.209100     -0.1407000      -1.580400    
 H    4.778600      -1.477500      -2.138400    
 H    5.881300      -2.195400      -1.013800    


%chk=000023221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023221

0 1
O 2.447912 0.536751 1.311005
O 3.524000 -2.169891 0.350498
N 1.636497 1.392693 -0.708493
N 3.470065 -0.068222 -0.745646
N 5.300358 -1.507461 -1.013557
C -0.652920 1.483771 0.374292
C -1.428736 0.855861 -0.814873
C 0.623875 2.244849 -0.054947
C -2.679009 0.113970 -0.362797
C -2.578112 -1.173982 0.226322
C -3.963647 0.702609 -0.484045
C -3.729049 -1.854213 0.681748
C -5.118881 0.025912 -0.028716
C -5.005206 -1.256030 0.556315
C 2.491916 0.603469 0.056431
C 4.064789 -1.313588 -0.391039
H -0.369382 0.697805 1.097688
H -1.315896 2.190123 0.911770
H -1.703486 1.655480 -1.532235
H -0.753258 0.155959 -1.346421
H 1.095711 2.688214 0.839380
H 0.369426 3.065296 -0.753106
H 1.546312 1.205994 -1.708294
H -1.592288 -1.645736 0.326631
H -4.059205 1.696320 -0.940151
H -3.631885 -2.848816 1.131764
H -6.103862 0.495634 -0.132727
H -5.898981 -1.783623 0.908037
H 3.755497 0.370396 -1.623882
H 5.864559 -0.735568 -1.364650
H 5.745985 -2.411275 -0.868801


