%chk=000091139.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091139

0 1
 O   -1.526500     -0.4264000      -2.079900    
 O    1.465200       4.710100      0.1413000    
 N    1.927000      -1.577000      0.1563000    
 C   0.8687000     -0.8573000     -0.5518000    
 C    1.772000      -3.027200     -2.4400000E-02
 C    3.249400      -1.123500     -0.2973000    
 C    2.842500      -3.797100      0.7504000    
 C    4.368200      -1.831300      0.4687000    
 C    4.244500      -3.346400      0.3562000    
 C  -0.5107000      -1.387600     -0.1089000    
 C    1.029700      0.6421000     -0.3647000    
 C   -1.662500     -0.8026000     -0.9182000    
 C    1.286100       1.430200      -1.469200    
 C   0.9142000       1.174600      0.9041000    
 C   -3.005100     -0.7086000     -0.2819000    
 C    1.433200       2.806600      -1.298000    
 C    1.061300       2.551000       1.075500    
 C    1.320800       3.367100     -2.5599999E-02
 C   -3.354200      -1.638900      0.6728000    
 C   -3.851700      0.3075000     -0.6691000    
 C   -4.611700      -1.548900       1.269700    
 C   -5.109300      0.3975000     -7.2200000E-02
 C   -5.489300     -0.5306000      0.8972000    
 C    1.338200       5.216900       1.469000    
 H   0.9611000      -1.075900      -1.626700    
 H    1.805100      -3.305600      -1.085600    
 H   0.8405000      -3.405700      0.4015000    
 H    3.404300     -5.3900000E-02 -0.1222000    
 H    3.376500      -1.301100      -1.373800    
 H    2.735400      -4.871900      0.5642000    
 H    2.700500      -3.643600       1.827900    
 H    4.332300      -1.538900       1.526000    
 H    5.342500      -1.511600      8.1600003E-02
 H    4.989900      -3.833500      0.9943000    
 H    4.451500      -3.655100     -0.6758000    
 H  -0.6696000      -1.196200      0.9582000    
 H  -0.6298000      -2.458000     -0.2959000    
 H    1.376300       1.006100      -2.464700    
 H   0.7179000      0.5523000       1.772000    
 H    1.635500       3.437200      -2.159400    
 H   0.9633000       2.919900       2.090800    
 H   -2.698200      -2.450900      0.9691000    
 H   -3.566700       1.040400      -1.417800    
 H   -4.909300      -2.273800       2.021800    
 H   -5.792200       1.191100     -0.3612000    
 H   -6.468700     -0.4609000       1.361500    
 H   0.3336000       5.045900       1.870600    
 H    1.481000       6.301200       1.416300    
 H    2.120600       4.823000       2.126600    


%chk=000091139-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091139

0 1
O -1.477434 -0.396674 -2.110988
O 1.404482 4.828772 0.346506
N 1.951249 -1.644718 0.130726
C 0.860346 -0.857984 -0.545738
C 1.823468 -3.119327 -0.040220
C 3.291547 -1.202040 -0.360733
C 2.925784 -3.876130 0.732095
C 4.437228 -1.888650 0.406368
C 4.333523 -3.424071 0.289020
C -0.545511 -1.278761 -0.036077
C 1.043003 0.643683 -0.290718
C -1.685731 -0.750303 -0.911832
C 0.923389 1.585045 -1.344596
C 1.287409 1.126594 1.017003
C -3.080399 -0.713095 -0.346396
C 1.047871 2.966171 -1.102242
C 1.417977 2.508346 1.280262
C 1.295351 3.432847 0.212165
C -3.399886 -1.194223 0.952166
C -4.120221 -0.188313 -1.162372
C -4.730224 -1.152538 1.422049
C -5.446260 -0.140790 -0.691069
C -5.755683 -0.624146 0.603867
C 1.649158 5.359521 1.687816
H 0.880634 -1.028067 -1.649974
H 1.872258 -3.401376 -1.126201
H 0.844129 -3.454885 0.342009
H 3.363809 -0.108768 -0.241822
H 3.397235 -1.423228 -1.456243
H 2.793352 -4.964146 0.574256
H 2.798558 -3.676569 1.814067
H 4.381186 -1.592410 1.472169
H 5.405900 -1.527791 0.009931
H 5.112507 -3.920851 0.897987
H 4.503363 -3.725540 -0.765393
H -0.665243 -0.951251 1.011723
H -0.657769 -2.381947 -0.035173
H 0.712403 1.228931 -2.358693
H 1.408758 0.402437 1.831524
H 0.954200 3.698080 -1.910298
H 1.614576 2.847309 2.302166
H -2.618583 -1.606565 1.598698
H -3.854941 0.173598 -2.161292
H -4.967907 -1.528466 2.423200
H -6.238938 0.269664 -1.326105
H -6.787346 -0.588894 0.971687
H 0.826710 5.097995 2.382535
H 1.693893 6.451421 1.561693
H 2.610117 4.992804 2.099784


