%chk=000104014.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104014

0 1
 O   -1.204600      0.1452000       1.764800    
 O   0.2850000       2.277400     -0.6102000    
 O    2.166600       2.681700      0.5772000    
 N   -3.276800      -1.074400      0.7046000    
 N   0.2056000     -0.2812000     -3.8300000E-02
 C   -2.051400      -1.088300     -9.3800001E-02
 C   -2.405500     -0.3906000      -1.402800    
 C   -3.822700      0.1342000      -1.205000    
 C   -4.027900      0.1081000      0.2957000    
 C    2.696300     -0.2447000     -3.5500001E-02
 C    1.376300      0.3954000      0.4596000    
 C  -0.9900000     -0.3483000      0.6608000    
 C    2.748600      -1.739200      0.3492000    
 C    2.918000     -3.8600001E-02  -1.540300    
 C    1.331700       1.887900      0.1566000    
 C    4.050700      -2.424600     -4.2700000E-02
 H   -1.713300      -2.116700     -0.2595000    
 H   -2.384200      -1.090700      -2.245400    
 H   -1.738700      0.4434000      -1.646800    
 H   -3.954800       1.135600      -1.625700    
 H   -4.536900     -0.5363000      -1.698700    
 H   -3.620900       1.013000      0.7611000    
 H   -5.085100      2.6500000E-02  0.5632000    
 H    3.523700      0.2649000      0.4776000    
 H    1.340300      0.3217000       1.554800    
 H   -3.088800      -1.073800       1.704900    
 H   0.2480000     -0.6819000     -0.9706000    
 H    2.620700      -1.831600       1.434900    
 H    1.921100      -2.288200     -0.1155000    
 H    2.197500     -0.6096000      -2.134600    
 H    2.829300       1.015200      -1.821900    
 H    3.923200     -0.3544000      -1.837200    
 H    4.916300      -1.875900      0.3416000    
 H    4.079800      -3.436500      0.3745000    
 H    4.147800      -2.516800      -1.128300    
 H   0.2920000       3.244000     -0.7771000    


%chk=000104014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104014

0 1
O -0.602859 -0.534355 1.536540
O 1.095790 2.458945 -1.538588
O 2.758278 2.819263 0.042048
N -2.924719 -1.549273 0.349782
N 0.285185 0.167782 -0.499322
C -2.017042 -0.721706 -0.480170
C -2.846238 0.549268 -0.870697
C -4.305045 0.038261 -0.779634
C -4.258588 -0.890286 0.456629
C 2.775650 -0.258821 -0.136807
C 1.530432 0.680286 0.080597
C -0.725906 -0.361179 0.283384
C 2.562553 -1.596087 0.620828
C 3.077115 -0.467120 -1.638602
C 1.867172 2.080608 -0.424426
C 3.820933 -2.489185 0.662895
H -1.725834 -1.266587 -1.404998
H -2.580546 0.942190 -1.867449
H -2.679616 1.351795 -0.127481
H -5.039104 0.854674 -0.669351
H -4.564818 -0.544876 -1.682237
H -4.363895 -0.286066 1.386574
H -5.073501 -1.636747 0.441196
H 3.630901 0.273347 0.328730
H 1.361870 0.753160 1.173150
H -2.494333 -1.772391 1.258198
H 0.101322 0.364665 -1.485123
H 2.237996 -1.371351 1.655290
H 1.725653 -2.150303 0.151843
H 2.254751 -1.017650 -2.133443
H 3.220636 0.492340 -2.169390
H 4.000882 -1.055446 -1.772381
H 4.681298 -1.946444 1.098714
H 3.639215 -3.384567 1.284708
H 4.115868 -2.840523 -0.342363
H 1.375444 3.366279 -1.837444


