%chk=000045693.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045693

0 1
 O    1.152300      0.1470000     -8.9999998E-04
 O   -3.247900       1.297800      1.4000000E-03
 O  -0.1797000      -1.709200     -4.1999999E-03
 N   -1.067200      0.4616000       0.000000    
 C    3.596400      0.1528000     -1.3000000E-03
 C    2.303700     -0.6874000     -2.7000001E-03
 C    4.829300     -0.7665000     -4.1000000E-03
 C    3.621600       1.028700       1.261300    
 C    3.646200       1.056200      -1.245100    
 C  -6.6299997E-02 -0.4897000     -1.9000000E-03
 C   -2.441800      0.2203000     -3.0000001E-04
 C   -3.133800     -0.9468000     -1.8000000E-03
 C   -4.498100     -0.5701000     -1.0000000E-03
 C   -4.514600      0.8053000      7.9999998E-04
 H    2.278800      -1.334600      0.8833000    
 H    2.279600      -1.326700     -0.8946000    
 H    4.835100      -1.420600      0.8749000    
 H    5.758600     -0.1860000      5.5999998E-03
 H    4.842600      -1.404800     -0.8946000    
 H    3.566500      0.4168000       2.168700    
 H    4.545600       1.616000       1.313800    
 H    2.784300       1.735100       1.282300    
 H    3.604400      0.4622000      -2.164900    
 H    4.571300       1.643400      -1.269300    
 H    2.808800       1.762200      -1.264900    
 H  -0.7949000       1.440400      1.6000000E-03
 H   -2.744500      -1.954200     -3.3000000E-03
 H   -5.361400      -1.219700     -1.8000000E-03
 H   -5.303200       1.543600      1.9000000E-03


%chk=000045693-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045693

0 1
O 1.167562 0.182768 -0.000656
O -3.267501 1.309479 0.004408
O -0.230203 -1.722045 -0.010232
N -1.072996 0.480800 0.000647
C 3.629171 0.175280 0.003940
C 2.362915 -0.705607 -0.005433
C 4.845667 -0.790155 -0.000188
C 3.660965 1.053883 1.281217
C 3.666940 1.072337 -1.260346
C -0.067887 -0.477495 -0.003905
C -2.436724 0.177482 -0.000917
C -3.184592 -0.988101 -0.006501
C -4.574297 -0.567142 -0.004635
C -4.599494 0.813673 0.001968
H 2.315152 -1.356948 0.887447
H 2.318555 -1.342599 -0.908808
H 4.844926 -1.446417 0.890705
H 5.787794 -0.212401 0.007030
H 4.850047 -1.432436 -0.901200
H 3.648244 0.430328 2.195221
H 4.579341 1.669156 1.301857
H 2.789728 1.730836 1.315989
H 3.658175 0.461951 -2.183259
H 4.585514 1.687608 -1.268056
H 2.795977 1.749919 -1.289244
H -0.799328 1.465226 0.005398
H -2.783887 -1.996828 -0.011249
H -5.443236 -1.222373 -0.007825
H -5.374831 1.572921 0.005524


