%chk=000079888.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079888

0 1
 O    1.512400     -0.2617000      0.2683000    
 O   0.3938000       1.642900     -0.4088000    
 N   -1.908800      0.7990000      0.6439000    
 C  -0.7578000     -8.9800000E-02  0.8014000    
 C   -1.147800      -1.393400      0.1129000    
 C   -2.488500      -1.107800     -0.5532000    
 C   -2.574800      0.4040000     -0.5931000    
 C   0.4256000      0.5526000      0.1458000    
 C    2.720500      0.2328000     -0.3184000    
 C    3.825200     -0.7786000     -9.8899998E-02
 H  -0.5353000     -0.2285000       1.864300    
 H   -1.258600      -2.208700      0.8364000    
 H  -0.4192000      -1.712500     -0.6409000    
 H   -2.558400      -1.555300      -1.549200    
 H   -3.300100      -1.519300      5.9500001E-02
 H   -2.047300      0.8024000      -1.467300    
 H   -3.610100      0.7549000     -0.6234000    
 H   -1.641700       1.781300      0.6303000    
 H    2.568000      0.3872000      -1.392500    
 H    2.991500       1.185000      0.1511000    
 H    4.765600     -0.4320000     -0.5363000    
 H    3.977200     -0.9571000      0.9707000    
 H    3.560300      -1.741900     -0.5472000    


%chk=000079888-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079888

0 1
O 1.640732 -0.261804 0.252114
O 0.651790 1.692797 -0.547779
N -1.889432 0.889108 0.472606
C -0.742239 -0.046842 0.545911
C -1.175577 -1.303970 -0.287107
C -2.718121 -1.169900 -0.349579
C -2.917154 0.357673 -0.462315
C 0.552548 0.574639 0.013410
C 2.974938 0.238479 -0.209593
C 3.995559 -0.836285 0.148678
H -0.541793 -0.349514 1.593417
H -0.828617 -2.241036 0.176166
H -0.752012 -1.251100 -1.307255
H -3.158882 -1.720030 -1.198516
H -3.176573 -1.539536 0.585370
H -2.761525 0.682271 -1.518221
H -3.930141 0.672335 -0.153396
H -1.603646 1.859415 0.291351
H 2.918254 0.426264 -1.297107
H 3.175370 1.200963 0.295149
H 5.003861 -0.516541 -0.172146
H 4.017035 -1.012362 1.237657
H 3.757326 -1.789526 -0.353413


