%chk=000035895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035895

0 1
 O  -0.7251000       1.238200      0.4878000    
 O   0.2136000      0.2919000      -1.370400    
 N   -3.903100      9.4200000E-02 -0.2104000    
 N    1.411800      0.5620000      0.6225000    
 C   -1.944000       1.410500     -0.2214000    
 C   -2.497400      4.3000001E-02 -0.6186000    
 C   -3.922600      0.8683000       1.029400    
 C   -3.003100       2.029800      0.6872000    
 C   -4.486800      -1.229000     -5.1800001E-02
 C   -4.420200      -1.997900      -1.368400    
 C   -5.927200      -1.094200      0.4318000    
 C   0.3090000      0.6543000     -0.2042000    
 C    2.685200      2.8899999E-02  0.3187000    
 C    2.932600      -1.318500      0.5412000    
 C    3.669100      0.8611000     -0.1968000    
 C    4.189600      -1.844400      0.2424000    
 C    4.925900      0.3350000     -0.4957000    
 C    1.885800      -2.229400       1.096200    
 C    3.420800       2.314100     -0.4431000    
 C    5.186100      -1.017700     -0.2761000    
 H   -1.774400       2.063200      -1.086600    
 H   -2.414700     -9.9299997E-02  -1.701400    
 H   -1.961900     -0.7715000     -0.1137000    
 H   -3.566300       2.789300      0.1306000    
 H   -2.584100       2.495300       1.584600    
 H   -3.516600      0.3017000       1.877100    
 H   -4.916200       1.245100       1.290500    
 H   -3.936100      -1.809000      0.7016000    
 H   -4.947000      -2.955000      -1.280000    
 H   -4.891000      -1.438600      -2.185000    
 H   -3.391400      -2.231900      -1.660900    
 H   -5.989400     -0.7203000       1.458900    
 H   -6.423700      -2.071600      0.4286000    
 H   -6.511800     -0.4304000     -0.2157000    
 H    1.307800      0.9167000       1.569800    
 H    4.409500      -2.895900      0.4064000    
 H    5.713900      0.9643000     -0.9011000    
 H    2.277900      -3.235000       1.283400    
 H    1.509800      -1.847600       2.051400    
 H    1.052800      -2.327200      0.3924000    
 H    4.329400       2.833800     -0.7665000    
 H    2.669800       2.444900      -1.229000    
 H    3.076900       2.807200      0.4723000    
 H    6.164700      -1.427300     -0.5092000    


%chk=000035895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000035895

0 1
O -0.739049 1.074786 0.671834
O 0.443170 0.846724 -1.358762
N -3.971578 0.151930 -0.190659
N 1.415020 0.380459 0.753611
C -1.946275 1.486595 -0.113843
C -2.609643 0.259019 -0.795678
C -3.867285 0.753653 1.167315
C -2.983979 1.990417 0.908914
C -4.564581 -1.210475 -0.260598
C -4.672414 -1.673684 -1.730500
C -5.955684 -1.237536 0.408378
C 0.400087 0.768585 -0.106273
C 2.723423 -0.072267 0.367434
C 3.154786 -1.338594 0.866208
C 3.573288 0.740250 -0.438315
C 4.449280 -1.795392 0.527845
C 4.854971 0.232365 -0.769747
C 2.238325 -2.184504 1.733300
C 3.157448 2.116902 -0.913895
C 5.294583 -1.021238 -0.296742
H -1.618221 2.247249 -0.840289
H -2.666274 0.378258 -1.890045
H -1.985017 -0.643405 -0.585641
H -3.590802 2.788597 0.446996
H -2.499075 2.388154 1.815081
H -3.372706 0.068942 1.903236
H -4.862423 1.020520 1.559805
H -3.901033 -1.938367 0.283690
H -5.140840 -2.673353 -1.780530
H -5.294506 -0.962962 -2.304677
H -3.683996 -1.740755 -2.217414
H -5.902554 -1.020842 1.489885
H -6.413314 -2.236195 0.289032
H -6.617586 -0.489680 -0.065718
H 1.132623 0.270567 1.730268
H 4.787241 -2.768646 0.902475
H 5.517238 0.843467 -1.394029
H 2.674535 -3.182735 1.904315
H 2.066428 -1.730512 2.730657
H 1.246871 -2.318788 1.262106
H 4.035011 2.696136 -1.247785
H 2.439637 2.043557 -1.750708
H 2.650938 2.683573 -0.110500
H 6.291832 -1.389676 -0.561237


