%chk=000000438.chk
%nprocshared=4
%mem=8GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000438

0 1
 O   9.4400004E-02   2.600100      0.7806000    
 O   -2.476100      -2.093500     -0.1704000    
 O   -3.388000     -0.2016000      0.6905000    
 N    2.810200     -7.4299999E-02  -1.061200    
 C  -0.3489000       1.272200      0.4903000    
 C   -1.308700       1.323500     -0.7115000    
 C   0.8729000      0.4123000      0.2644000    
 C   -1.827800     -4.0199999E-02  -1.172200    
 C    1.160200     -0.6235000       1.127300    
 C    1.703200      0.6570000     -0.8020000    
 C   -2.658200     -0.7477000     -0.1250000    
 C    2.290800      -1.398600      0.8936000    
 C    3.075900      -1.085800     -0.2044000    
 H  -0.8918000      0.9226000       1.376200    
 H   -2.157700       1.969300     -0.4499000    
 H  -0.8254000       1.825100      -1.559800    
 H   -2.465300      8.9100003E-02  -2.054200    
 H  -0.9925000     -0.6834000      -1.468500    
 H   0.5253000     -0.8461000       1.979400    
 H    1.524900       1.464500      -1.503900    
 H  -0.6943000       3.139300      0.9622000    
 H    2.549000      -2.221800       1.549900    
 H    3.968300      -1.660000     -0.4306000    
 H   -3.001000      -2.556500      0.5169000    


%chk=000000438-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000438

0 1
O 0.070816 2.723568 0.564873
O -3.193045 -2.065483 -0.182504
O -3.153511 -0.120375 1.080745
N 3.141549 0.289027 -0.812061
C -0.334680 1.308567 0.437514
C -1.300384 1.159733 -0.773491
C 0.943489 0.507144 0.263425
C -1.821440 -0.270442 -1.010351
C 1.123665 -0.745453 0.896558
C 1.988627 0.980320 -0.572990
C -2.765284 -0.756125 0.074100
C 2.310097 -1.476675 0.662101
C 3.284089 -0.926423 -0.201439
H -0.862457 0.978408 1.354976
H -2.163941 1.834944 -0.611648
H -0.768868 1.506657 -1.679019
H -2.368590 -0.329560 -1.970588
H -0.990323 -0.995565 -1.097773
H 0.354624 -1.135870 1.574751
H 1.907056 1.964621 -1.045248
H -0.741031 3.274531 0.704718
H 2.481863 -2.446297 1.140114
H 4.216472 -1.461873 -0.414655
H -3.819395 -2.355380 0.535594


