%chk=000097872.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097872

0 1
 O   -1.851400       1.974400      0.4834000    
 O   -3.396400     -0.2955000      5.6000002E-02
 N    5.618800      1.8200001E-02 -6.8700001E-02
 C   -1.260900      0.7638000      0.2806000    
 C   0.7468000     -0.5658000      8.3499998E-02
 C   -2.036600     -0.3757000      6.7400001E-02
 C   0.1308000      0.6687000      0.2887000    
 C  -2.8899999E-02  -1.705500     -0.1297000    
 C   -1.420600      -1.610300     -0.1375000    
 C    2.197700     -0.6649000      9.1499999E-02
 C   -2.111800       2.770300     -0.6712000    
 C   -4.115200      -1.506700     -0.1686000    
 C    3.059500      0.3600000     -9.5200002E-02
 C    4.468300      0.1690000     -8.0200002E-02
 H   0.7001000       1.574500      0.4784000    
 H   0.4344000      -2.675700     -0.2928000    
 H   -1.958600      -2.536200     -0.3096000    
 H    2.600500      -1.663800      0.2528000    
 H   -2.789100       2.248300      -1.354600    
 H   -1.177300       3.018100      -1.184500    
 H   -2.589600       3.698800     -0.3467000    
 H   -3.940700      -2.234000      0.6317000    
 H   -3.908100      -1.920900      -1.161300    
 H   -5.181300      -1.257700     -0.1445000    
 H    2.717500       1.370800     -0.2861000    


%chk=000097872-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097872

0 1
O -1.632559 2.129929 0.284768
O -3.316504 -0.131919 -0.067386
N 5.903095 -0.208440 0.228996
C -1.115787 0.845345 0.061894
C 0.918639 -0.555357 -0.026663
C -1.931294 -0.326649 -0.094778
C 0.281370 0.712933 0.098691
C 0.095142 -1.699719 -0.205520
C -1.308282 -1.589201 -0.239899
C 2.371888 -0.732972 0.011852
C -2.639318 2.654806 -0.663218
C -4.175596 -1.320424 -0.140646
C 3.315989 0.251102 0.183373
C 4.719826 -0.014114 0.206394
H 0.857015 1.633755 0.233924
H 0.559802 -2.686598 -0.313326
H -1.913158 -2.491888 -0.364894
H 2.730372 -1.764337 -0.110416
H -3.556831 2.045473 -0.645765
H -2.221127 2.686072 -1.687816
H -2.845041 3.677400 -0.313019
H -3.970430 -2.009131 0.700423
H -4.044502 -1.851064 -1.102884
H -5.202037 -0.933920 -0.064645
H 3.027229 1.301118 0.313360


