%chk=000121609.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121609

0 1
 O    2.414900       1.639400      9.4700001E-02
 O   -2.921300      -1.832200      0.3936000    
 O  -0.9181000      -2.110600     -0.7056000    
 N   0.7644000     -2.5800001E-02 -2.6699999E-02
 C    3.071500     -0.6790000      1.0500000E-02
 C    4.527900     -0.2249000      8.1000000E-02
 C  -0.4395000      0.7181000     -2.4400000E-02
 C    2.065400      0.4651000      4.0800001E-02
 C   -1.663300      7.1699999E-02 -9.9500000E-02
 C    5.505300      -1.391600      4.8999999E-02
 C  -0.3599000       2.100200      5.2999999E-02
 C   -2.836800      0.8257000     -9.7000003E-02
 C   -1.533400       2.854100      5.5599999E-02
 C   -2.771800       2.216900     -1.9500000E-02
 C   -1.767000      -1.380000     -0.1821000    
 C   -3.138300      -3.247200      0.3766000    
 H    2.853300      -1.344200      0.8552000    
 H    2.908800      -1.248600     -0.9128000    
 H    4.745300      0.4483000     -0.7570000    
 H    4.689700      0.3541000      0.9982000    
 H   0.6607000      -1.035800     -7.7600002E-02
 H    5.339000      -2.063800      0.8966000    
 H    6.535300      -1.025300      0.1012000    
 H    5.394900      -1.968500     -0.8747000    
 H   0.5520000       2.673700      0.1157000    
 H   -3.817500      0.3628000     -0.1694000    
 H   -1.484500       3.937700      0.1156000    
 H   -3.685200       2.804600     -2.0900000E-02
 H   -3.190100      -3.608200     -0.6548000    
 H   -4.092100      -3.451400      0.8698000    
 H   -2.341100      -3.757500      0.9253000    


%chk=000121609-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121609

0 1
O 2.437749 1.692155 -0.434241
O -3.007090 -1.864045 0.317370
O -0.716798 -2.155355 0.119968
N 0.785641 0.031001 -0.165961
C 3.131295 -0.659367 -0.421736
C 4.419342 -0.341899 0.375445
C -0.400376 0.791926 -0.094701
C 2.102450 0.473390 -0.336630
C -1.660281 0.106716 0.069985
C 5.520450 -1.397183 0.144889
C -0.396420 2.213825 -0.179792
C -2.863017 0.863250 0.141263
C -1.604140 2.930865 -0.105991
C -2.844874 2.264506 0.054402
C -1.716145 -1.368659 0.165622
C -3.122392 -3.338056 0.417483
H 2.695675 -1.620750 -0.087726
H 3.397795 -0.782945 -1.491726
H 4.774599 0.660319 0.074444
H 4.175993 -0.279776 1.454088
H 0.624463 -0.990737 -0.085719
H 5.184729 -2.406256 0.450715
H 6.429392 -1.154959 0.724978
H 5.805487 -1.446736 -0.923189
H 0.561061 2.722830 -0.301858
H -3.804779 0.322771 0.266121
H -1.576140 4.024251 -0.173931
H -3.778400 2.833018 0.110794
H -2.724288 -3.815038 -0.493531
H -4.199706 -3.524653 0.526320
H -2.562774 -3.706608 1.293244


