%chk=000085591.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085591

0 1
 O   -1.712300       2.091000     -0.1234000    
 O   -3.508000     -0.6107000     -0.7226000    
 N    2.605000     -1.1300000E-02 -7.5800002E-02
 N   -2.939700     -0.3919000      0.3567000    
 C    1.202100     -0.1021000      3.3300001E-02
 C   0.4165000       1.043100     -9.7700000E-02
 C   0.5998000      -1.337500      0.2716000    
 C  -0.9714000      0.9528000      9.6000005E-03
 C    3.375800      -1.129000     -0.5833000    
 C    3.293600       1.206200      0.3049000    
 C  -0.7879000      -1.427900      0.3789000    
 C   -1.573500     -0.2828000      0.2478000    
 H   0.8595000       2.015700     -0.2956000    
 H    1.183100      -2.246200      0.3905000    
 H    3.520600      -1.885700      0.1949000    
 H    4.368500     -0.8059000     -0.9166000    
 H    2.888700      -1.592200      -1.448800    
 H    2.887400       1.624100       1.232900    
 H    3.222200       1.957000     -0.4890000    
 H    4.358000       1.017700      0.4850000    
 H   -1.239200      -2.399600      0.5677000    
 H   -2.659400       1.899800     -3.1500001E-02


%chk=000085591-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085591

0 1
O -1.698482 2.187647 0.228199
O -3.712629 -1.200973 0.043364
N 2.627126 -0.009568 -0.069978
N -3.004578 -0.112761 0.100113
C 1.241764 -0.067676 -0.030852
C 0.465395 1.128533 0.082330
C 0.563275 -1.347875 -0.104754
C -0.931788 1.043933 0.119062
C 3.431815 -1.240389 -0.170726
C 3.312044 1.292652 -0.002671
C -0.825196 -1.418800 -0.066750
C -1.603568 -0.230078 0.045745
H 0.924134 2.116596 0.144366
H 1.144845 -2.268536 -0.191675
H 3.247256 -1.918601 0.684301
H 4.500004 -0.976103 -0.169138
H 3.219266 -1.792600 -1.106466
H 3.092486 1.817528 0.947599
H 3.007746 1.951249 -0.838988
H 4.399878 1.139327 -0.066017
H -1.352607 -2.377457 -0.122272
H -2.658785 1.868553 0.234707


