%chk=000070317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070317

0 1
 O    1.590400      -1.189500      0.9568000    
 N   0.6615000      0.7356000     -1.8900000E-02
 N    2.921600      0.1369000     -0.3604000    
 C  -0.7129000      0.2698000     -3.9799999E-02
 C  -0.9467000      -1.022400     -0.4219000    
 C   -1.693800       1.150400      0.3248000    
 C   0.9492000       2.155600     -0.2751000    
 C    1.708000     -0.1860000      0.2485000    
 C   -2.267600      -1.470200     -0.4410000    
 C   -3.014700      0.7026000      0.3059000    
 C   -3.301500     -0.6077000     -7.7000000E-02
 C    4.106600     -0.6751000     -0.2019000    
 H  -0.1690000      -1.705800     -0.7449000    
 H   -1.509800       2.169500      0.6417000    
 H   0.5388000       2.433300      -1.250500    
 H    2.017000       2.381900     -0.2571000    
 H   0.5037000       2.768400      0.5134000    
 H   -2.492200      -2.487900     -0.7470000    
 H   -3.820200       1.372800      0.5920000    
 H   -4.330100     -0.9559000     -9.3000002E-02
 H    2.944300      0.8479000      -1.082800    
 H    4.977800     -7.8599997E-02 -0.4818000    
 H    4.022600      -1.544100     -0.8593000    
 H    4.197100      -1.009100      0.8350000    


%chk=000070317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070317

0 1
O 1.652287 -1.566791 -0.167981
N 0.694885 0.594407 0.067501
N 3.003346 0.311902 -0.413097
C -0.681826 0.173694 0.010257
C -1.091241 -1.144203 0.359153
C -1.672774 1.115537 -0.387603
C 0.970709 2.024973 0.311389
C 1.770955 -0.302971 -0.171867
C -2.457364 -1.492870 0.309535
C -3.036733 0.754681 -0.421720
C -3.441612 -0.552590 -0.072830
C 4.211567 -0.493644 -0.621540
H -0.337570 -1.878463 0.644200
H -1.385781 2.125335 -0.698409
H 1.083306 2.617536 -0.621161
H 1.885650 2.131084 0.919793
H 0.141620 2.459139 0.891614
H -2.752182 -2.512582 0.582720
H -3.779797 1.497440 -0.734037
H -4.499888 -0.833461 -0.101568
H 3.057105 1.312005 -0.597794
H 5.016253 -0.194792 0.075729
H 4.584624 -0.407098 -1.659904
H 3.944563 -1.545868 -0.436680


