%chk=000092532.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092532

0 1
 O    2.947800     -0.9755000     -0.5514000    
 N   0.8834000      0.7026000      0.3750000    
 C    1.601300     -0.1810000       1.272000    
 C    1.562700       1.862100     -0.1678000    
 C  -0.4635000      0.4446000      4.4900000E-02
 C    2.103300      -1.397000      0.5123000    
 C   -1.109200     -0.6743000      0.5710000    
 C   -1.149600       1.308500     -0.8087000    
 C    1.366800       3.057000      0.7455000    
 C   -2.440800     -0.9293000      0.2435000    
 C   -2.481300       1.053500      -1.136300    
 C   -3.126900     -6.5399997E-02 -0.6101000    
 C   -3.132000      -2.124600      0.8069000    
 C    3.438100      -2.081300      -1.296700    
 H    1.016200     -0.4586000       2.155600    
 H    2.474100      0.3517000       1.673000    
 H    2.641400       1.662100     -0.2132000    
 H    1.299300       2.087100      -1.206100    
 H    1.280800      -1.992100      0.1029000    
 H    2.676400      -2.034300       1.196000    
 H  -0.6257000      -1.374200       1.243900    
 H  -0.7149000       2.204000      -1.237500    
 H   0.3124000       3.340600      0.8223000    
 H    1.728800       2.847800       1.757800    
 H    1.920100       3.920200      0.3622000    
 H   -3.017800       1.728200      -1.797200    
 H   -4.165400     -0.2503000     -0.8714000    
 H   -2.471200      -2.998100      0.7921000    
 H   -3.439300      -1.929400       1.839100    
 H   -4.022700      -2.385800      0.2254000    
 H    2.611000      -2.633000      -1.754100    
 H    4.026900      -2.745500     -0.6566000    
 H    4.084400      -1.700400      -2.092100    


%chk=000092532-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092532

0 1
O 3.306773 -0.985025 -0.327914
N 0.809299 0.655196 0.318860
C 1.564530 -0.256743 1.186022
C 1.555857 1.782735 -0.277788
C -0.559067 0.458845 0.066825
C 2.169457 -1.473419 0.461856
C -1.242471 -0.716504 0.519598
C -1.325733 1.424354 -0.661513
C 1.484337 3.084775 0.555644
C -2.620123 -0.922856 0.278669
C -2.694214 1.207989 -0.912267
C -3.353477 0.046977 -0.450789
C -3.309020 -2.170410 0.811003
C 3.899090 -2.030768 -1.158018
H 0.924409 -0.609858 2.016295
H 2.401347 0.301224 1.646520
H 2.605408 1.459487 -0.387834
H 1.181578 1.963451 -1.302847
H 1.415607 -1.949577 -0.200990
H 2.520866 -2.227355 1.204166
H -0.697068 -1.497841 1.059366
H -0.861873 2.347282 -1.020189
H 0.441623 3.425945 0.679923
H 1.910862 2.928437 1.563517
H 2.059382 3.891863 0.063569
H -3.255007 1.964732 -1.474176
H -4.419604 -0.106501 -0.653177
H -2.594386 -2.999322 0.961315
H -3.793878 -1.971251 1.786804
H -4.097137 -2.520616 0.120457
H 3.163590 -2.439494 -1.883084
H 4.294144 -2.866660 -0.541111
H 4.729799 -1.559191 -1.706513


