%chk=000126905.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126905

0 1
 O   -2.043800      0.5586000       1.326200    
 O    4.033700      -1.963700     -0.1590000    
 O   -3.372200      -2.421400      -1.121600    
 O   -2.499100      -2.043500      0.9431000    
 N   -2.019800       2.977600     -0.2927000    
 C   -1.064600       1.879900     -0.4390000    
 C   0.2453000       2.192200      0.2965000    
 C    1.259400       1.079500      0.1743000    
 C   -1.742500      0.6401000      0.1348000    
 C   -2.011700     -0.4895000     -0.8376000    
 C    1.274200      6.8700001E-02   1.121200    
 C    2.155200       1.091500     -0.8823000    
 C    2.211000     -0.9588000       1.008600    
 C    3.091900      6.4099997E-02 -0.9952000    
 C    3.119700     -0.9612000     -4.9600001E-02
 C   -2.636900      -1.714000     -0.2275000    
 H  -0.8719000       1.718400      -1.505700    
 H   5.6899998E-02   2.384000       1.362200    
 H   0.6818000       3.121600     -9.3800001E-02
 H   -2.690400     -9.7400002E-02  -1.603100    
 H   -1.068100     -0.7909000      -1.302500    
 H   0.5806000      6.3100003E-02   1.956500    
 H    2.139300       1.884500      -1.624400    
 H   -1.618400       3.829100     -0.6842000    
 H   -2.171500       3.173900      0.6965000    
 H    2.229100      -1.753300       1.749600    
 H    3.794000      7.3500000E-02  -1.824500    
 H    4.580800      -1.806400     -0.9477000    
 H   -3.774300      -3.218700     -0.7154000    


%chk=000126905-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126905

0 1
O -3.087593 1.092880 0.530165
O 4.048397 -2.091211 -0.407249
O -3.259977 -2.352749 -0.582720
O -1.889523 -1.877875 1.231058
N -1.886548 3.301211 -0.486541
C -1.127916 2.056066 -0.542364
C 0.103299 2.028299 0.474131
C 1.144574 0.947876 0.238087
C -2.080948 0.902452 -0.199742
C -1.763979 -0.474887 -0.794975
C 1.171800 -0.246127 1.009558
C 2.124339 1.107186 -0.776183
C 2.140381 -1.243807 0.783298
C 3.100432 0.116309 -1.019200
C 3.106831 -1.061300 -0.232745
C -2.276281 -1.607842 0.074493
H -0.711017 1.888172 -1.557221
H -0.305140 1.978457 1.500483
H 0.577317 3.022886 0.360469
H -2.230278 -0.526159 -1.796006
H -0.672613 -0.582048 -0.923343
H 0.415901 -0.410111 1.786509
H 2.136127 2.024758 -1.378120
H -1.335337 4.160031 -0.449508
H -2.680096 3.270368 0.161177
H 2.160066 -2.161596 1.377805
H 3.852781 0.264196 -1.805283
H 4.681389 -1.871562 -1.135237
H -3.588688 -3.072374 0.022905


