%chk=000133667.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133667

0 1
 O   -4.671500      -2.124400      0.2731000    
 O   -5.186000      3.7900001E-02 -0.2652000    
 N    1.486700      7.8500003E-02 -0.2808000    
 N   -2.106700      -1.752300      0.2067000    
 C    2.871300      0.5558000     -0.4595000    
 C   0.2916000      0.8072000     -0.4134000    
 C    1.477900      -1.266100      0.1053000    
 C    3.665500     -0.6705000     -1.7100001E-02
 C    2.851700      -1.703200      0.2772000    
 C   0.3810000       2.281700     -0.6956000    
 C  -0.8875000      0.1708000     -0.2596000    
 C  -0.8980000      -1.278700      9.6299998E-02
 C   0.4553000       3.127400      0.5814000    
 C   0.3711000      -1.996500      0.3005000    
 C    3.164500      0.9022000      -1.917000    
 C   -2.292200      0.4917000     -0.3459000    
 C    5.152900     -0.6061000      6.3600004E-02
 C    3.207600      -3.076400      0.7320000    
 C   -2.924400     -0.6667000     -6.7500003E-02
 C    1.655300       2.754100       1.456000    
 C  -0.8390000       2.961100       1.380900    
 C   -2.853600       1.816800     -0.7120000    
 C   -4.373700     -0.8443000     -3.9299998E-02
 H    3.159700       1.369700      0.1921000    
 H  -0.3998000       2.635400      -1.361200    
 H    1.268800       2.524500      -1.270700    
 H   0.5526000       4.183700      0.3010000    
 H   0.3588000      -3.035000      0.6014000    
 H    4.242000       1.020300      -2.079100    
 H    2.819500      0.1092000      -2.591600    
 H    2.716100       1.832300      -2.261600    
 H    5.592300     -0.5406000     -0.9360000    
 H    5.583900      -1.479900      0.5589000    
 H    5.461700      0.2743000      0.6365000    
 H    4.288000      -3.233500      0.7840000    
 H    2.806400      -3.825900      4.1499998E-02
 H    2.799100      -3.269700       1.729500    
 H    1.625100       3.349600       2.377900    
 H    1.662400       1.712200       1.782300    
 H    2.589000       3.043200      0.9686000    
 H   -1.669700       3.427500      0.8539000    
 H  -0.7539000       3.527600       2.317800    
 H   -1.064300       1.938200       1.682300    
 H   -3.718000       1.669800      -1.371400    
 H   -2.219300       2.473800      -1.291400    
 H   -3.240100       2.332700      0.1698000    
 H   -5.639500      -2.281000      0.3015000    


%chk=000133667-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133667

0 1
O -4.911998 -2.147238 0.067534
O -5.314534 0.012251 -0.650758
N 1.466811 0.103784 -0.214615
N -2.192610 -1.770887 0.187281
C 2.873803 0.526721 -0.544198
C 0.311743 0.853079 -0.378502
C 1.475777 -1.255917 0.192100
C 3.703684 -0.648112 -0.024476
C 2.874084 -1.677798 0.348345
C 0.409736 2.361898 -0.511528
C -0.912962 0.154480 -0.294652
C -0.930040 -1.272188 0.116801
C 0.448745 3.152560 0.855770
C 0.288175 -1.948680 0.393504
C 3.057722 0.707237 -2.075167
C -2.299062 0.503758 -0.514381
C 5.205031 -0.590309 -0.026901
C 3.235778 -3.048047 0.856759
C -3.013629 -0.696763 -0.208656
C 1.820177 3.074874 1.568254
C -0.676126 2.752139 1.837748
C -2.880195 1.782844 -1.068226
C -4.475543 -0.866127 -0.295731
H 3.119783 1.466808 -0.021907
H -0.473093 2.707386 -1.072370
H 1.297754 2.662736 -1.096254
H 0.287042 4.212264 0.565247
H 0.289083 -2.987988 0.730095
H 4.104362 0.981522 -2.296673
H 2.824163 -0.236354 -2.597390
H 2.405979 1.499919 -2.479451
H 5.612916 -0.484702 -1.051928
H 5.648073 -1.499602 0.411823
H 5.577329 0.277238 0.553253
H 4.327121 -3.192807 0.909244
H 2.820719 -3.835634 0.199778
H 2.819198 -3.219680 1.867170
H 1.814965 3.715134 2.469537
H 2.042557 2.043770 1.901542
H 2.643436 3.426314 0.916787
H -1.676815 2.831316 1.381274
H -0.654669 3.412884 2.724062
H -0.552822 1.711588 2.187916
H -3.966041 1.668854 -1.207198
H -2.432206 2.035087 -2.049763
H -2.718239 2.651386 -0.401436
H -5.904563 -2.152598 -0.023562


