%chk=000079281.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079281

0 1
 O   6.9799997E-02   1.239200       1.685800    
 O   0.1960000       3.303700       2.718300    
 N   -4.723000      -2.538400     -0.2080000    
 N    4.850500      -2.344300     -0.1601000    
 C  -1.6000000E-03  0.6769000      0.3252000    
 C  -0.1059000       1.942300     -0.4744000    
 C   -1.264200     -0.1821000      0.1823000    
 C    1.295500     -0.1300000      0.1960000    
 C  -3.1300001E-02   3.045700      0.3558000    
 C   9.8999999E-02   2.604200       1.730500    
 C  -0.2833000       2.127600      -1.839500    
 C   -1.496000     -0.8965000     -0.9948000    
 C    1.564200      -1.171600       1.086400    
 C   -2.185500     -0.2531000       1.229500    
 C    2.211800      0.1735000     -0.8131000    
 C  -0.1053000       4.348000     -0.1076000    
 C  -0.3601000       3.431400      -2.340400    
 C   -2.643800      -1.678500      -1.124400    
 C    2.743900      -1.906400      0.9683000    
 C   -3.333300      -1.035100       1.100100    
 C    3.391500     -0.5613000     -0.9315000    
 C   -3.562500      -1.747900     -7.6899998E-02
 C    3.657700      -1.601400     -4.0700000E-02
 C  -0.2690000       4.535200      -1.479000    
 C   -4.711200      -3.728000      -1.036000    
 C   -5.938900      -2.179400      0.4946000    
 C    5.469600      -2.932000       1.011200    
 C    5.465500      -2.541700      -1.457700    
 H  -0.3483000       1.291200      -2.526100    
 H  -0.7878000     -0.8716000      -1.817900    
 H   0.8638000      -1.424200       1.878100    
 H   -2.043100      0.2858000       2.161200    
 H    2.061100      0.9751000      -1.525800    
 H  -4.6200000E-02   5.196900      0.5641000    
 H  -0.4908000       3.591900      -3.407200    
 H   -2.796000      -2.214500      -2.056900    
 H    2.915200      -2.717200       1.670700    
 H   -4.022400      -1.076500       1.938900    
 H    4.088600     -0.2903000      -1.719400    
 H  -0.3322000       5.541000      -1.884700    
 H   -4.812700      -3.465300      -2.094200    
 H   -3.790300      -4.305200     -0.8958000    
 H   -5.542400      -4.395300     -0.7817000    
 H   -6.124600      -1.100200      0.4504000    
 H   -6.812300      -2.666800      4.6900000E-02
 H   -5.888500      -2.492600       1.542700    
 H    6.522400      -3.171000      0.8234000    
 H    5.450800      -2.243200       1.863600    
 H    4.965300      -3.862900       1.290900    
 H    6.033600      -1.654500      -1.756700    
 H    6.161400      -3.388000      -1.440800    
 H    4.717100      -2.764700      -2.226600    


%chk=000079281-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079281

0 1
O 0.133926 1.245157 1.723577
O 0.191350 3.391749 2.646353
N -4.886241 -2.463955 -0.043407
N 5.027705 -2.306410 -0.196780
C 0.035624 0.613066 0.319652
C -0.117605 1.850746 -0.572528
C -1.237919 -0.243218 0.285344
C 1.327498 -0.169607 0.102523
C -0.075700 3.022061 0.209460
C 0.097949 2.660412 1.641120
C -0.303106 1.934514 -1.965038
C -1.397845 -1.248066 -0.701520
C 1.514095 -1.414756 0.757703
C -2.324207 0.002049 1.158582
C 2.412561 0.343812 -0.649096
C -0.209826 4.306074 -0.356309
C -0.437091 3.217565 -2.547658
C -2.592148 -1.982066 -0.818093
C 2.721785 -2.123266 0.664300
C -3.523571 -0.726397 1.060494
C 3.628842 -0.353794 -0.760143
C -3.694203 -1.737917 0.062588
C 3.819212 -1.609640 -0.101173
C -0.390060 4.395303 -1.754156
C -5.026902 -3.498139 -1.073843
C -5.995556 -2.192039 0.877516
C 5.205438 -3.574867 0.520556
C 6.144087 -1.737415 -0.960998
H -0.350450 1.032238 -2.583454
H -0.568353 -1.475373 -1.381676
H 0.697715 -1.827634 1.360523
H -2.220574 0.755479 1.945233
H 2.315741 1.308107 -1.159797
H -0.175253 5.194838 0.282263
H -0.583140 3.304936 -3.630277
H -2.662438 -2.750676 -1.593074
H 2.816840 -3.074165 1.195777
H -4.326914 -0.507420 1.769613
H 4.434494 0.085955 -1.354601
H -0.499103 5.374616 -2.232615
H -4.916604 -3.081126 -2.096299
H -4.275343 -4.305892 -0.954362
H -6.026797 -3.954590 -1.001579
H -6.352768 -1.144760 0.796561
H -6.841387 -2.856411 0.639536
H -5.709246 -2.371762 1.934227
H 6.215837 -3.967559 0.325242
H 5.094562 -3.450022 1.617486
H 4.474116 -4.340181 0.189843
H 6.466043 -0.755889 -0.555779
H 7.006085 -2.421567 -0.915891
H 5.880641 -1.594199 -2.028926


