%chk=000089194.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089194

0 1
 O    1.085300       1.808100       1.071000    
 O    2.547400     -0.5542000     -0.1886000    
 O    1.109000      -2.302700      3.3700000E-02
 N   0.2831000     -9.5700003E-02 -8.3499998E-02
 C   0.6794000       1.323900     -0.2067000    
 C   -1.124200     -0.4095000      1.2000000E-02
 C   -2.080600      0.5636000     -0.3453000    
 C  -0.3840000       2.228600     -0.7302000    
 C   -1.668900       1.881600     -0.8141000    
 C   -1.594800      -1.653300      0.4658000    
 C   -3.453500      0.2748000     -0.2806000    
 C    1.288100      -1.091600     -6.3199997E-02
 C   -2.964000      -1.930700      0.5341000    
 C   -3.892900     -0.9705000      0.1558000    
 C    1.597000       3.129000      0.9838000    
 C    3.637700      -1.483300     -0.2000000    
 C    4.936000     -0.7181000     -0.3440000    
 H    1.527600       1.374000     -0.9012000    
 H  -9.5899999E-02   3.207200      -1.105900    
 H   -2.408200       2.565400      -1.215300    
 H  -0.9377000      -2.437200      0.8219000    
 H   -4.192600       1.020100     -0.5667000    
 H   -3.301400      -2.899100      0.8930000    
 H   -4.955500      -1.187100      0.2086000    
 H   0.7918000       3.866900      0.9208000    
 H    2.300000       3.243100      0.1519000    
 H    2.143000       3.332600       1.910100    
 H    3.644000      -2.049300      0.7381000    
 H    3.519700      -2.173500      -1.042600    
 H    5.792000      -1.398500     -0.3559000    
 H    4.936900     -0.1318000      -1.268800    
 H    5.058600     -9.2000002E-03  0.4814000    


%chk=000089194-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089194

0 1
O 0.800055 1.947663 1.050752
O 2.464744 -0.350070 -0.233821
O 1.083022 -2.210600 0.009268
N 0.170983 -0.019025 -0.185171
C 0.547996 1.405038 -0.320706
C -1.211374 -0.392066 -0.014578
C -2.212346 0.533847 -0.456545
C -0.516785 2.225580 -0.988927
C -1.815372 1.818367 -1.022619
C -1.613989 -1.623911 0.561791
C -3.583619 0.190860 -0.329527
C 1.206510 -0.967571 -0.116807
C -2.984965 -1.935000 0.683179
C -3.979758 -1.034834 0.235193
C 2.032268 2.738337 1.148719
C 3.621633 -1.294418 -0.220403
C 4.883309 -0.442024 -0.310315
H 1.496995 1.448758 -0.881653
H -0.202351 3.195323 -1.387522
H -2.592863 2.456203 -1.459279
H -0.864624 -2.342577 0.891148
H -4.335611 0.909817 -0.676777
H -3.272188 -2.892094 1.132310
H -5.041135 -1.286637 0.329234
H 1.961914 3.689679 0.581797
H 2.906950 2.158092 0.792057
H 2.152073 2.969866 2.219279
H 3.575446 -1.886437 0.710730
H 3.517244 -1.987301 -1.074634
H 5.772977 -1.097734 -0.309966
H 4.894919 0.155217 -1.238357
H 4.960339 0.243251 0.551548


