%chk=000121073.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121073

0 1
 O   -4.622500      -1.916900     -0.5669000    
 O   -1.011100       1.021800       1.758900    
 N   -3.114200      0.4163000      5.2000001E-02
 N   0.1542000       1.929400     -3.5500001E-02
 C   -2.471200     -0.8962000     -0.1011000    
 C   -4.327200      0.4821000     -0.7748000    
 C   -2.188500       1.491600     -0.2983000    
 C   -3.459400      -2.002300      0.2575000    
 C   -5.271800     -0.6561000     -0.3992000    
 C  -0.9758000       1.440000      0.6046000    
 C    1.452000       2.006300      0.5957000    
 C    2.267700      0.7642000      0.3540000    
 C    3.104100      0.6733000     -0.7511000    
 C    2.165900     -0.2851000       1.258600    
 C    3.851300     -0.4867000     -0.9555000    
 C    3.755700      -1.545900     -5.2800000E-02
 C    2.913000      -1.444900       1.054300    
 C    3.223700       1.795300      -1.729700    
 C    4.554100      -2.786500     -0.2708000    
 H   -1.598000      -1.019700      0.5461000    
 H   -2.138400      -1.033300      -1.138800    
 H   -4.067900      0.4042000      -1.838700    
 H   -4.841600       1.437300     -0.6194000    
 H   -1.887700       1.426400      -1.351400    
 H   -2.660300       2.468900     -0.1400000    
 H   -3.001900      -2.981600      8.4100001E-02
 H   -3.753900      -1.955900       1.313100    
 H   -5.628200     -0.5622000      0.6339000    
 H   -6.148800     -0.6439000      -1.054200    
 H    1.315200       2.156700       1.674000    
 H    1.950600       2.909800      0.2319000    
 H   8.2500003E-02   2.252000     -0.9959000    
 H    1.515300     -0.2199000       2.126000    
 H    4.509200     -0.5707000      -1.817300    
 H    2.828600      -2.263600       1.764000    
 H    3.838400       1.512900      -2.591900    
 H    2.243400       2.080300      -2.124300    
 H    3.701000       2.663400      -1.263800    
 H    4.003500      -3.479000     -0.9152000    
 H    5.516700      -2.557600     -0.7408000    
 H    4.772800      -3.289600      0.6772000    


%chk=000121073-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121073

0 1
O -4.319208 -2.115606 -0.640285
O -1.069551 1.926686 1.834766
N -3.069160 0.411576 0.031475
N 0.001754 2.004843 -0.232335
C -2.271122 -0.714059 -0.513857
C -4.473622 0.354122 -0.443423
C -2.447610 1.727328 -0.205596
C -2.933257 -2.051235 -0.145822
C -5.094069 -1.001623 -0.067863
C -1.124406 1.887966 0.570035
C 1.364528 2.124564 0.332245
C 2.166319 0.829397 0.216910
C 3.228573 0.667975 -0.718842
C 1.820370 -0.254444 1.065073
C 3.903607 -0.580157 -0.772146
C 3.562735 -1.666388 0.069345
C 2.502511 -1.484200 0.995485
C 3.663306 1.792303 -1.649401
C 4.313091 -2.985346 -0.004548
H -1.253692 -0.684763 -0.081726
H -2.176306 -0.644136 -1.629251
H -4.542237 0.489387 -1.553770
H -5.048389 1.168302 0.037696
H -2.276551 1.924551 -1.299285
H -3.136983 2.507177 0.166851
H -2.409707 -2.897207 -0.620672
H -2.923440 -2.174673 0.958168
H -5.128340 -1.098663 1.038348
H -6.110323 -1.103086 -0.483336
H 1.217374 2.388410 1.394671
H 1.881057 2.964840 -0.162760
H -0.098413 1.882253 -1.241936
H 1.007739 -0.115540 1.789119
H 4.723010 -0.705864 -1.491782
H 2.219580 -2.304918 1.666160
H 4.439209 1.441361 -2.350785
H 2.824016 2.185408 -2.253943
H 4.086742 2.647546 -1.088743
H 3.621232 -3.834783 -0.155956
H 5.042690 -2.991679 -0.832504
H 4.867447 -3.183025 0.932723


