%chk=000081897.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081897

0 1
 O    3.847500      0.2098000     -9.6400000E-02
 O   -2.374900       1.249400      0.4008000    
 N   -2.403200     -0.9721000     -0.2634000    
 C  -0.3012000      0.2168000      3.7599999E-02
 C   -3.840600      -1.121100     -0.2885000    
 C   -1.754700      0.2187000      8.3999999E-02
 C   0.3914000       1.405800     -0.1914000    
 C   0.4005000     -0.9746000      0.2217000    
 C    2.487200      0.2120000     -5.2299999E-02
 C    1.785500       1.403400     -0.2365000    
 C    1.794600     -0.9769000      0.1769000    
 C   -4.533600      0.1716000      0.1076000    
 C    4.501500      -1.043000      9.9799998E-02
 H   -4.125800      -1.421500      -1.301400    
 H   -4.102600      -1.932300      0.3975000    
 H  -0.1365000       2.343900     -0.3418000    
 H  -9.7400002E-02  -1.916100      0.4342000    
 H   -1.866300      -1.775400     -0.5711000    
 H    2.319600       2.332400     -0.4164000    
 H    2.277300      -1.935400      0.3350000    
 H   -4.335300      0.4662000       1.143400    
 H   -4.358800      0.9881000     -0.6007000    
 H   -5.616300     -6.6999998E-03  6.8800002E-02
 H    4.247900      -1.757600     -0.6906000    
 H    4.309100      -1.444900       1.100400    
 H    5.578700     -0.8594000      3.0900000E-02


%chk=000081897-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081897

0 1
O 3.971796 0.067783 -0.127315
O -2.206403 1.701883 -0.900509
N -2.543884 -0.548072 -0.407124
C -0.247356 0.346542 -0.428484
C -4.012065 -0.469008 -0.480762
C -1.728292 0.561833 -0.592606
C 0.622126 1.324860 -0.984717
C 0.325245 -0.746099 0.268423
C 2.573457 0.094997 -0.183848
C 2.014357 1.203495 -0.872171
C 1.725114 -0.881810 0.396255
C -4.691759 -0.793920 0.866125
C 4.604473 -1.051217 0.576714
H -4.244876 0.562333 -0.795676
H -4.379959 -1.154068 -1.270146
H 0.169642 2.179866 -1.496922
H -0.309032 -1.493836 0.760521
H -2.117074 -1.460903 -0.246893
H 2.690786 1.948520 -1.301445
H 2.135862 -1.731087 0.950192
H -4.453607 -1.819399 1.206521
H -4.363197 -0.084968 1.645754
H -5.790220 -0.717630 0.767285
H 4.351126 -2.019189 0.102379
H 4.311890 -1.071472 1.644455
H 5.685448 -0.868333 0.492094


