%chk=000122683.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122683

0 1
 O    3.980100       1.154500     -0.2799000    
 O   -2.000200      -2.741800      0.1105000    
 N   0.4736000       2.115200     -0.1495000    
 N   0.6796000      -2.720900     -1.1100000E-02
 C   0.6099000     -0.2914000     -8.2000002E-02
 C  -0.1243000      0.9011000     -8.5000001E-02
 C   -1.593900      0.8568000     -1.6799999E-02
 C    2.012100     -0.2383000     -0.1478000    
 C   9.4999997E-03  -1.548000     -1.6200000E-02
 C   -2.256700     -0.3872000      5.1300000E-02
 C   -1.461600      -1.644400      5.3700000E-02
 C    2.630100       1.013200     -0.2144000    
 C   -2.384200       2.018600     -1.7100001E-02
 C    2.732500      -1.439700     -0.1441000    
 C   -3.653600     -0.4637000      0.1164000    
 C    1.824900       2.141100     -0.2121000    
 C    2.026800      -2.633900     -7.5300001E-02
 C   -3.778400       1.942800      4.7800001E-02
 C   -4.411000      0.7047000      0.1144000    
 C    4.684800       1.261300      0.9573000    
 H   -1.929000       3.005300     -6.8099998E-02
 H    3.816300      -1.462800     -0.1972000    
 H   -4.165400      -1.420600      0.1687000    
 H    2.256300       3.136200     -0.2630000    
 H    2.549600      -3.584900     -7.1400002E-02
 H   -4.369700       2.854100      4.6300001E-02
 H   -5.494500      0.6502000      0.1647000    
 H    4.501200      0.3865000       1.588900    
 H    4.388800       2.173400       1.485200    
 H    5.754500       1.315800      0.7377000    


%chk=000122683-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122683

0 1
O 4.077415 0.676335 0.347682
O -2.277671 -2.829544 -0.372152
N 0.549766 1.930668 0.342800
N 0.526566 -2.927917 -0.252511
C 0.572075 -0.492290 0.047559
C -0.121727 0.764841 0.169770
C -1.594866 0.787254 0.105633
C 2.009152 -0.512846 0.109858
C -0.118717 -1.740764 -0.136792
C -2.320119 -0.430756 -0.077012
C -1.630611 -1.752336 -0.208292
C 2.690010 0.744384 0.294253
C -2.307257 2.009429 0.222993
C 2.674440 -1.766778 -0.013777
C -3.737867 -0.402144 -0.138340
C 1.922705 1.917585 0.403459
C 1.900654 -2.923714 -0.189703
C -3.713402 2.023455 0.160487
C -4.434361 0.813876 -0.020859
C 4.821321 1.932732 0.529038
H -1.732247 2.929101 0.361803
H 3.765320 -1.814997 0.028561
H -4.262410 -1.352587 -0.279178
H 2.392769 2.895521 0.544301
H 2.376140 -3.905409 -0.288144
H -4.253286 2.972282 0.252393
H -5.528334 0.828286 -0.068932
H 4.557199 2.411767 1.490319
H 4.625490 2.629818 -0.306964
H 5.879953 1.637946 0.533647


