%chk=000171824.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171824

0 1
 O    3.809500      -1.082800      0.8296000    
 N    1.381800     -3.8800001E-02 -0.5836000    
 N    1.731000      0.7761000      0.5637000    
 C  -5.4200001E-02  0.1358000     -0.8072000    
 C  -0.8280000     -0.3057000      0.4485000    
 C    1.687100      -1.454000     -0.2973000    
 C    2.798800       1.706600      0.1915000    
 C  -0.3103000       1.599000      -1.168900    
 C    3.192200      -1.751700     -0.2670000    
 C    4.074100       1.078400     -0.3877000    
 C   -2.327200     -0.2011000      0.3027000    
 C    4.699600     -3.1399999E-02  0.4620000    
 C   -2.963300      0.9777000      0.6580000    
 C   -3.039500      -1.285600     -0.1839000    
 C   -4.348200       1.074600      0.5233000    
 C   -4.424500      -1.188600     -0.3187000    
 C   -5.078800     -8.5000005E-03  3.5000000E-02
 H  -0.3614000     -0.4719000      -1.668900    
 H  -0.5464000      0.2714000       1.339400    
 H  -0.6354000      -1.351900      0.7082000    
 H    1.246300      -2.088300      -1.076500    
 H    1.291900      -1.783200      0.6705000    
 H    2.044500      0.1954000       1.340700    
 H    3.068800       2.270900       1.092400    
 H    2.416000       2.449600     -0.5186000    
 H   0.3744000       1.936700      -1.956400    
 H  -0.2147000       2.280000     -0.3163000    
 H   -1.320300       1.723100      -1.574700    
 H    3.326900      -2.825800     -9.6000001E-02
 H    3.674500      -1.524800      -1.224800    
 H    3.858300      0.6984000      -1.393100    
 H    4.820900       1.870300     -0.5257000    
 H    5.560300     -0.4646000     -6.0899999E-02
 H    5.078700      0.4009000       1.394400    
 H   -2.406100       1.826300       1.044100    
 H   -2.539400      -2.207900     -0.4653000    
 H   -4.857900       1.993000      0.7996000    
 H   -4.993600      -2.031600     -0.6997000    
 H   -6.157200      6.6900000E-02 -6.9899999E-02


%chk=000171824-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171824

0 1
O 4.054019 -1.175368 0.707078
N 1.386932 -0.046534 -0.356141
N 1.896197 0.827036 0.702252
C -0.080713 0.187322 -0.588647
C -0.962903 -0.116112 0.674594
C 1.728545 -1.471717 -0.116145
C 3.015480 1.708735 0.272667
C -0.298926 1.620156 -1.100412
C 3.213348 -1.815883 -0.320767
C 4.160367 1.040882 -0.528397
C -2.452834 -0.114371 0.381051
C 4.912180 -0.079509 0.213630
C -3.276306 0.985663 0.737691
C -3.058408 -1.216742 -0.280864
C -4.658784 0.987648 0.442570
C -4.438887 -1.219731 -0.579857
C -5.246398 -0.115234 -0.219440
H -0.366870 -0.524390 -1.391002
H -0.707757 0.637278 1.442157
H -0.672707 -1.108991 1.072354
H 1.134989 -2.085539 -0.821922
H 1.453546 -1.801649 0.917930
H 2.172566 0.259928 1.520780
H 3.410422 2.167602 1.202170
H 2.594003 2.527676 -0.339850
H 0.287861 1.793570 -2.019750
H 0.028723 2.341902 -0.330956
H -1.365542 1.798058 -1.321814
H 3.344230 -2.908239 -0.193548
H 3.542222 -1.536140 -1.340572
H 3.734990 0.653791 -1.473086
H 4.901822 1.818306 -0.806898
H 5.705184 -0.498721 -0.444315
H 5.391651 0.306536 1.131799
H -2.828154 1.843390 1.254400
H -2.442854 -2.084220 -0.553576
H -5.276990 1.845553 0.731666
H -4.886641 -2.082245 -1.087341
H -6.318400 -0.116797 -0.446989


