%chk=000075870.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075870

0 1
 O   0.2424000       2.045900     -0.2196000    
 N  -0.5356000     -0.1522000      4.1499998E-02
 N   -4.978800      -2.076100      0.2525000    
 N    5.797500      -1.018600      6.7900002E-02
 C   -1.943000      7.0000002E-03  1.5100000E-02
 C    1.830000      0.3557000     -3.5599999E-02
 C   0.4563000      0.8318000     -7.2099999E-02
 C   -2.752700      -1.108400      0.1455000    
 C    2.847400       1.195800      0.4166000    
 C    2.130100     -0.9409000     -0.4534000    
 C   -2.477000       1.274800     -0.1405000    
 C   -4.138400     -0.9510000      0.1196000    
 C    4.465300     -0.5572000      3.3199999E-02
 C    4.165000      0.7395000      0.4508000    
 C    3.447700      -1.397300     -0.4191000    
 C   -3.862700       1.432100     -0.1663000    
 C   -4.693400      0.3192000     -3.6200002E-02
 H  -0.2424000      -1.112100      0.2015000    
 H   -2.318600      -2.097900      0.2669000    
 H    2.634500       2.207700      0.7514000    
 H    1.379300      -1.618000     -0.8496000    
 H   -1.903600       2.183200     -0.2472000    
 H    4.949000       1.403200      0.8064000    
 H    3.670600      -2.406800     -0.7552000    
 H   -4.296200       2.420700     -0.2875000    
 H   -5.771700      0.4549000     -5.7700001E-02
 H   -5.983600      -1.962600      0.2316000    
 H   -4.577300      -2.997600      0.3633000    
 H    6.015600      -1.958800     -0.2341000    
 H    6.535600     -0.4101000      0.3963000    


%chk=000075870-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075870

0 1
O 0.241234 2.113386 0.003768
N -0.570909 -0.091545 0.078809
N -4.996550 -2.112720 0.179259
N 5.894398 -1.029436 0.029002
C -1.979934 0.106657 0.029495
C 1.847490 0.299691 0.015121
C 0.455381 0.859201 0.024857
C -2.788443 -1.056475 0.127089
C 2.908495 1.179247 0.362269
C 2.181767 -1.032828 -0.352043
C -2.578986 1.386855 -0.114232
C -4.203907 -0.964191 0.082018
C 4.571793 -0.594893 0.019991
C 4.242440 0.748714 0.373253
C 3.515294 -1.477982 -0.352389
C -3.988111 1.462524 -0.161037
C -4.805299 0.319702 -0.066088
H -0.276014 -1.061266 0.206472
H -2.315423 -2.042678 0.238271
H 2.649645 2.212193 0.617236
H 1.409391 -1.735608 -0.690540
H -1.950004 2.274554 -0.177575
H 5.041708 1.446203 0.652047
H 3.749101 -2.506158 -0.654419
H -4.459768 2.445761 -0.272872
H -5.897526 0.410352 -0.103352
H -6.008869 -2.044083 0.148591
H -4.579248 -3.031039 0.293335
H 6.133762 -1.982603 -0.228146
H 6.648392 -0.395638 0.277812


