%chk=000094747.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094747

0 1
 O    3.622900     -0.8528000      0.4037000    
 N    2.379200     -0.9129000     -0.2276000    
 C  -0.7000000     -3.5999999E-03  0.1886000    
 C   -2.101300      7.9200000E-02 -0.4233000    
 C   0.4000000      0.3428000     -0.8134000    
 C   -3.178400     -0.2454000      0.6123000    
 C    1.784100      0.2408000     -0.2003000    
 C   -4.573600     -0.1266000      1.9900000E-02
 C    2.367100       1.478500      0.4400000    
 H  -0.6324000      0.6764000       1.047200    
 H  -0.5304000      -1.013900      0.5819000    
 H   -2.176200     -0.6184000      -1.266100    
 H   -2.265800       1.087600     -0.8218000    
 H   0.2575000       1.355600      -1.206000    
 H   0.3516000     -0.3428000      -1.668200    
 H   -3.092700      0.4370000       1.466000    
 H   -3.033200      -1.262700      0.9940000    
 H   -5.328000     -0.3642000      0.7764000    
 H   -4.761900      0.8899000     -0.3401000    
 H   -4.703700     -0.8181000     -0.8187000    
 H    1.691300       2.329400      0.3229000    
 H    2.520400       1.299700       1.507800    
 H    3.322300       1.722700     -3.2600001E-02
 H    3.936800      -1.767400      0.3046000    


%chk=000094747-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094747

0 1
O 3.916003 -0.674482 0.133074
N 2.602147 -0.814812 -0.541099
C -0.691510 0.021255 0.221110
C -2.101936 0.045362 -0.409630
C 0.432770 0.162237 -0.840972
C -3.235062 -0.093024 0.632758
C 1.822624 0.201306 -0.233631
C -4.642206 -0.067347 -0.002530
C 2.226792 1.348468 0.666686
H -0.610096 0.838794 0.966036
H -0.545785 -0.927400 0.774923
H -2.186520 -0.773848 -1.153704
H -2.237203 0.992635 -0.973068
H 0.264813 1.096375 -1.416655
H 0.377664 -0.681492 -1.553250
H -3.148326 0.726100 1.375761
H -3.098606 -1.038826 1.195504
H -5.434261 -0.161712 0.762929
H -4.812432 0.878833 -0.550387
H -4.767511 -0.898006 -0.722506
H 1.498012 2.173292 0.606812
H 2.297390 1.013241 1.718962
H 3.230998 1.717037 0.392445
H 4.397841 -1.473187 -0.202368


