%chk=000111636.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111636

0 1
 O    1.908600      7.6899998E-02  0.5576000    
 O   0.4793000      -2.266200      0.2126000    
 N   -2.102600       2.653800     -8.0700003E-02
 C   -1.528400      -1.006800     -0.1080000    
 C   0.5684000      0.1164000      0.3146000    
 C  -0.1569000      -1.062200      0.1400000    
 C   -1.449500       1.405800     -6.2000002E-03
 C   -2.174700      0.2272000     -0.1810000    
 C  -7.7900000E-02   1.350400      0.2416000    
 C   -2.321700      -2.257600     -0.2981000    
 C    2.757000      0.7319000     -0.3831000    
 C    4.098300      3.0500000E-02 -0.4093000    
 H   -3.244000      0.2751000     -0.3742000    
 H   0.4836000       2.270500      0.3859000    
 H   -1.953600      -2.820700      -1.162200    
 H   -2.274500      -2.884900      0.5982000    
 H   -3.379800      -2.041300     -0.4831000    
 H    2.319500      0.7107000      -1.389000    
 H    2.889000       1.775300     -7.7000000E-02
 H    4.779700      0.5154000      -1.114000    
 H    4.556100      3.5999998E-02  0.5854000    
 H    3.978600      -1.018800     -0.6985000    
 H   -3.097100       2.694900     -0.2593000    
 H   -1.577200       3.508500      4.6799999E-02
 H  -0.1388000      -3.000100      7.2800003E-02


%chk=000111636-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111636

0 1
O 1.950767 -0.327612 -0.183722
O 0.374213 -2.488158 -0.065514
N -1.976483 2.661664 -0.201430
C -1.673020 -1.073907 -0.069614
C 0.571656 -0.076108 -0.159978
C -0.265487 -1.226246 -0.096899
C -1.414657 1.376475 -0.167322
C -2.237482 0.223801 -0.104594
C -0.001261 1.215034 -0.195216
C -2.561965 -2.305679 -0.004189
C 2.855059 0.832934 -0.252046
C 4.277128 0.277723 -0.266485
H -3.328454 0.333850 -0.082658
H 0.637229 2.102618 -0.244554
H -2.419804 -2.970258 -0.880757
H -2.378205 -2.906322 0.910082
H -3.625928 -2.017299 0.010455
H 2.642322 1.417879 -1.171707
H 2.687640 1.488141 0.628733
H 5.009679 1.104014 -0.319190
H 4.472307 -0.309720 0.646652
H 4.425434 -0.381919 -1.138215
H -2.983408 2.786457 -0.188566
H -1.388453 3.487085 -0.250519
H -0.307426 -3.203744 -0.020946


