%chk=000168843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168843

0 1
 O   -1.028900     -5.0000002E-04  -1.261000    
 O    1.735600      -2.301400     -7.8900002E-02
 O    1.736500       2.301100     -7.8400001E-02
 N    2.049100     -3.0000001E-04 -0.1670000    
 C   8.3999997E-03 -0.7668000      0.6580000    
 C   8.3999997E-03  0.7669000      0.6576000    
 C   -1.132700      -1.088000     -0.3088000    
 C   -1.132200       1.087900     -0.3098000    
 C   -2.479100     -0.7659000      0.3393000    
 C   -2.478900      0.7670000      0.3382000    
 C    1.356700      -1.154000      0.1054000    
 C    1.357100       1.153900      0.1053000    
 H  -0.1211000      -1.203100       1.652900    
 H  -0.1213000       1.203800       1.652200    
 H   -1.076800      -2.063100     -0.7983000    
 H   -1.075700       2.062500     -0.8001000    
 H   -2.586700      -1.194000       1.340100    
 H   -3.303900      -1.130200     -0.2834000    
 H   -3.303300       1.130600     -0.2854000    
 H   -2.586800       1.196500       1.338400    
 H    2.986000     -3.9999999E-04 -0.5548000    


%chk=000168843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168843

0 1
O -1.020865 -0.000322 -1.326273
O 1.812953 -2.347910 -0.069020
O 1.813688 2.347354 -0.070253
N 2.087267 -0.000343 -0.157744
C 0.003393 -0.782447 0.665957
C 0.003614 0.782843 0.665467
C -1.157995 -1.107042 -0.330005
C -1.157658 1.107111 -0.330764
C -2.516804 -0.786434 0.353657
C -2.516581 0.787385 0.353079
C 1.376915 -1.188798 0.116290
C 1.377266 1.188478 0.115637
H -0.152884 -1.253311 1.649951
H -0.152633 1.254369 1.649148
H -1.073277 -2.071219 -0.847542
H -1.072642 2.070915 -0.848948
H -2.587953 -1.216891 1.367526
H -3.348196 -1.183969 -0.250335
H -3.347816 1.184700 -0.251281
H -2.587697 1.218623 1.366616
H 3.028307 -0.000592 -0.559665


