%chk=000001576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001576

0 1
 O    1.211200       1.110900      -1.266000    
 N    3.074300      7.3200002E-02  0.4166000    
 C    1.834400     -0.6811000      0.2238000    
 C   0.8051000      0.2390000     -0.4681000    
 C    2.111000      -1.907300     -0.6362000    
 C  -0.6158000      0.1097000     -0.1875000    
 C   -1.147700      -1.131500      0.1620000    
 C   -1.447000       1.227100     -0.2675000    
 C    2.837200       1.249700       1.237400    
 C   -2.510800      -1.255300      0.4315000    
 C   -2.809900       1.103400      2.3000001E-03
 C   -3.341900     -0.1378000      0.3518000    
 H    1.448300     -0.9976000       1.200000    
 H    2.549500      -1.621400      -1.600200    
 H    2.814100      -2.583200     -0.1367000    
 H    1.208100      -2.478400     -0.8642000    
 H    3.761600     -0.5246000      0.8753000    
 H  -0.5406000      -2.024600      0.2470000    
 H   -1.050700       2.203700     -0.5333000    
 H    3.802700       1.708900       1.476700    
 H    2.360200      0.9929000       2.189500    
 H    2.249700       2.025800      0.7400000    
 H   -2.925200      -2.220900      0.7061000    
 H   -3.457000       1.973600     -5.8400001E-02
 H   -4.402900     -0.2339000      0.5626000    


%chk=000001576-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001576

0 1
O 1.116378 1.657015 -0.580890
N 3.157879 0.039124 0.413659
C 1.822477 -0.537511 0.268269
C 0.769963 0.523507 -0.142694
C 1.864162 -1.648706 -0.815172
C -0.694784 0.174505 -0.026894
C -1.184149 -0.979286 0.646945
C -1.629649 1.063673 -0.626254
C 3.355812 1.045312 1.466628
C -2.570995 -1.233949 0.715489
C -3.012876 0.807404 -0.561032
C -3.489249 -0.343957 0.111495
H 1.460167 -0.994831 1.227340
H 2.190851 -1.213303 -1.775122
H 2.586901 -2.434385 -0.523703
H 0.879618 -2.123895 -0.956078
H 3.893757 -0.672524 0.370432
H -0.492645 -1.675179 1.133137
H -1.237989 1.950698 -1.135343
H 4.424943 1.316548 1.514055
H 3.038298 0.706526 2.484477
H 2.790804 1.959073 1.215543
H -2.936148 -2.122144 1.242899
H -3.720332 1.500276 -1.029734
H -4.565294 -0.543692 0.167046


