%chk=000013759.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013759

0 1
 O    2.244100      -3.126200     -0.7857000    
 O   0.1035000      -3.005800     -0.3137000    
 O    4.247400       2.629600      0.3337000    
 O    5.078200      0.7139000     -0.3436000    
 N  -0.9878000     -0.9111000      0.4664000    
 N    1.238100      -2.481500     -0.4072000    
 N    4.112600       1.417200      3.9999999E-02
 C   0.2973000     -0.3459000      0.3535000    
 C   -2.283900     -0.3726000      0.3257000    
 C    1.389500      -1.106900     -7.1800001E-02
 C   0.4768000       1.002200      0.6739000    
 C   -2.504800      0.6974000     -0.5415000    
 C   -3.786800       1.229300     -0.6803000    
 C    2.652300     -0.5236000     -0.1756000    
 C    2.827300      0.8226000      0.1454000    
 C   -3.345000     -0.9104000       1.054200    
 C    1.739400       1.585400      0.5702000    
 C   -4.847800      0.6913000      4.8099998E-02
 C   -4.626900     -0.3785000      0.9152000    
 C   -4.023400       2.373500      -1.606700    
 H  -0.9867000      -1.873000      0.7920000    
 H  -0.3451000       1.616800       1.031300    
 H   -1.694200       1.112200      -1.135500    
 H    3.503300      -1.114400     -0.5066000    
 H   -3.185800      -1.743600       1.734000    
 H    1.839500       2.635200      0.8336000    
 H   -5.851600       1.095300     -5.2299999E-02
 H   -5.453000     -0.7976000       1.482100    
 H   -3.163300       3.051700      -1.620300    
 H   -4.197700       2.004800      -2.622400    
 H   -4.891800       2.964500      -1.296300    


%chk=000013759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013759

0 1
O 2.506727 -3.268637 -0.445185
O 0.264380 -3.259500 -0.053076
O 4.229986 2.708613 0.304606
O 5.202697 0.667512 -0.036049
N -0.996285 -0.985929 0.191430
N 1.417558 -2.637199 -0.178683
N 4.170485 1.425031 0.141239
C 0.246101 -0.397428 0.181263
C -2.279904 -0.356865 0.195561
C 1.452499 -1.184871 -0.002922
C 0.427139 1.015171 0.384903
C -2.568307 0.782532 -0.600586
C -3.865549 1.347702 -0.613431
C 2.730028 -0.585157 -0.021904
C 2.839576 0.797261 0.159436
C -3.305655 -0.959865 0.966114
C 1.687781 1.603248 0.380954
C -4.879135 0.745992 0.178858
C -4.601359 -0.403248 0.950650
C -4.178033 2.549981 -1.487228
H -0.952471 -2.024520 0.178669
H -0.453087 1.629127 0.586111
H -1.792416 1.206437 -1.247222
H 3.618917 -1.202536 -0.174353
H -3.082223 -1.841005 1.577366
H 1.817092 2.674493 0.555995
H -5.888234 1.174048 0.180034
H -5.393341 -0.863316 1.551015
H -3.260342 3.062117 -1.823513
H -4.739484 2.246503 -2.391381
H -4.801440 3.286109 -0.948869


