%chk=000042746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042746

0 1
 O    1.296800      0.6476000      0.5361000    
 O   -2.115100      0.4360000      -1.736300    
 O    1.576500     -0.4628000      -1.471900    
 N  -0.9596000     -8.3899997E-02 -5.0799999E-02
 N   -2.143600      0.2705000     -0.5109000    
 C  -5.1899999E-02   1.062600      0.2018000    
 C   -1.027000     -0.9370000       1.146600    
 C  -0.5846000       1.961900       1.325500    
 C   -1.316400      -2.381600      0.7757000    
 C    1.981600     -9.7199999E-02 -0.3772000    
 C    3.343200     -0.4162000      0.1616000    
 H   3.5000000E-02   1.675800     -0.7064000    
 H  -7.3600002E-02 -0.9534000       1.688900    
 H   -1.781500     -0.5811000       1.861600    
 H   -1.589900       2.343400       1.123200    
 H  -0.5808000       1.455000       2.296300    
 H   8.0399998E-02   2.826000       1.442200    
 H   -2.295100      -2.488900      0.2965000    
 H  -0.5547000      -2.774600      9.3500003E-02
 H   -1.316200      -3.008100       1.673800    
 H    3.897400      0.5085000      0.3409000    
 H    3.892100      -1.014700     -0.5712000    
 H    3.250300     -0.9952000       1.083900    


%chk=000042746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042746

0 1
O 1.124222 0.456890 0.602173
O -2.109298 0.862649 -1.659034
O 1.498770 -0.035860 -1.656635
N -1.231825 0.049408 0.259616
N -2.180508 -0.048227 -0.756467
C -0.182631 1.089218 0.262344
C -1.342882 -0.987757 1.312451
C -0.417080 2.184815 1.301605
C -0.821321 -2.365587 0.856320
C 1.877696 -0.080248 -0.470530
C 3.160142 -0.682451 0.057100
H -0.152418 1.487115 -0.769495
H -0.772716 -0.630908 2.186575
H -2.405769 -1.063016 1.601467
H -1.373291 2.693734 1.090505
H -0.450437 1.771686 2.324531
H 0.396951 2.927221 1.251229
H -1.375657 -2.707964 -0.033752
H 0.252232 -2.323817 0.604808
H -0.960606 -3.107248 1.663763
H 3.729174 0.071060 0.627912
H 3.766426 -1.054244 -0.781085
H 2.934126 -1.513870 0.748000


