%chk=000077213.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077213

0 1
 O    2.445200      -1.491600      0.4820000    
 O   -3.394000     -3.9799999E-02 -5.5000000E-03
 O    2.867300      0.5425000     -0.4744000    
 N   -1.378100       1.011200      8.4299996E-02
 N   -1.524900      -1.346600     -0.1317000    
 N   0.6368000       2.236400      0.1909000    
 C   5.7000001E-03   1.025200      8.1699997E-02
 C   0.6403000     -0.1592000     -2.8500000E-02
 C  -0.2335000      -1.349100     -0.1351000    
 C   -2.165500     -0.1301000     -1.7999999E-02
 C    2.100700     -0.2990000     -4.5699999E-02
 H   -1.843100       1.910400      0.1682000    
 H   0.2740000      -2.321200     -0.2411000    
 H    1.647100       2.292500      0.1950000    
 H   7.8599997E-02   3.076800      0.2697000    
 H    3.417000      -1.625200      0.4887000    


%chk=000077213-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077213

0 1
O 2.568756 -1.594469 0.070650
O -3.483602 0.020518 -0.064077
O 2.857619 0.706809 0.154558
N -1.404818 1.051994 0.029968
N -1.570145 -1.378060 -0.053322
N 0.658784 2.226614 0.133895
C -0.031202 1.056201 0.073906
C 0.616076 -0.221472 0.052397
C -0.230789 -1.378072 -0.012265
C -2.239710 -0.145605 -0.031414
C 2.066244 -0.292583 0.096752
H -1.938233 1.927765 0.041012
H 0.254241 -2.360540 -0.032321
H 1.690297 2.133038 0.163445
H 0.198723 3.135042 0.150236
H 3.561360 -1.553980 0.107079


