%chk=000043775.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043775

0 1
 O    1.769300      0.3156000     -0.4178000    
 O   -1.000700      -2.126000      0.1067000    
 N  -0.5220000     -8.0100000E-02  0.3020000    
 N  -0.8316000      -1.068200     -0.5114000    
 C  -0.9853000       1.217000     -0.1981000    
 C   0.9052000     -6.2000002E-03  0.6783000    
 C   -2.469600       1.408000      6.3800000E-02
 C    3.134600      0.3400000     -2.3300000E-02
 H  -0.4739000       2.032700      0.3305000    
 H  -0.7616000       1.355000      -1.264900    
 H    1.032000      0.7468000       1.467200    
 H    1.220400     -0.9647000       1.113100    
 H   -3.076300      0.6800000     -0.4849000    
 H   -2.699600       1.312800       1.130600    
 H   -2.781500       2.407600     -0.2565000    
 H    3.445700     -0.6438000      0.3409000    
 H    3.296500       1.097400      0.7496000    
 H    3.740600      0.5966000     -0.8963000    


%chk=000043775-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043775

0 1
O 1.730519 0.518307 -0.280799
O -0.351124 -2.451123 -0.524135
N -0.518002 -0.202412 -0.286681
N -1.000109 -1.393233 -0.845547
C -1.223576 1.023750 -0.710269
C 0.689704 -0.142217 0.520170
C -1.983914 1.711884 0.441885
C 3.017026 0.538986 0.421554
H -0.480988 1.711429 -1.153500
H -1.923122 0.709037 -1.503531
H 0.502142 0.439048 1.448172
H 0.971570 -1.186529 0.766888
H -2.733658 1.031656 0.881922
H -1.300735 2.046558 1.243303
H -2.508508 2.605061 0.057730
H 3.380943 -0.488358 0.629994
H 2.953190 1.101623 1.377385
H 3.720842 1.047032 -0.255040


